data_1lqc_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 1lqc _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.423 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 105.465 -2.05 . . . . 0.0 105.465 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 1.1 p -60.0 97.02 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 127.053 2.141 . . . . 0.0 107.415 174.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.3 mt -39.95 -19.96 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 119.085 2.994 . . . . 0.0 119.085 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -54.85 -35.22 63.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.228 0.611 . . . . 0.0 111.353 166.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -58.01 -48.87 78.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.071 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -58.25 -46.35 88.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 173.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.64 -50.73 69.42 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 112.629 -2.078 . . . . 0.0 111.917 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -43.39 75.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.83 2.452 . . . . 0.0 113.844 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -66.98 -33.7 76.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.266 1.026 . . . . 0.0 110.384 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.08 -9.26 57.03 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.081 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.54 24.45 76.2 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 126.821 2.153 . . . . 0.0 112.477 170.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.9 p -122.77 134.19 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 124.183 0.993 . . . . 0.0 110.665 -170.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.4 p -41.08 128.54 2.8 Favored 'General case' 0 N--CA 1.51 2.558 0 C-N-CA 127.648 2.379 . . . . 0.0 107.751 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -42.98 -31.31 0.5 Allowed 'General case' 0 N--CA 1.523 3.186 0 N-CA-C 116.658 2.096 . . . . 0.0 116.658 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -48.25 -45.16 34.06 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 125.175 1.547 . . . . 0.0 112.149 177.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.7 p -59.88 -53.98 51.5 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.329 79.3 t -59.86 -50.97 78.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.705 0.802 . . . . 0.0 111.25 -163.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.508 49.4 m -66.3 -29.01 69.14 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -44.4 92.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 112.429 -2.169 . . . . 0.0 115.736 164.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.4 t -60.94 -43.9 96.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.564 1.545 . . . . 0.0 108.4 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.1 t -53.8 -49.07 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.334 -172.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -90.94 14.81 12.78 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 171.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 63.3 14.7 8.05 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.196 2.599 . . . . 0.0 117.819 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 29.06 40.96 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 110.53 -3.032 . . . . 0.0 116.326 -172.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p 56.59 -52.96 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.62 1.968 . . . . 0.0 115.919 -165.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -137.27 117.03 13.08 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 170.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -133.73 154.39 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 120.18 1.355 . . . . 0.0 113.215 169.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 p -59.94 128.62 37.77 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.706 0.802 . . . . 0.0 112.757 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.79 -53.79 36.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -174.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.87 -36.95 8.08 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 42.1 m -60.63 -49.25 78.29 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.509 1.524 . . . . 0.0 108.142 175.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.3 mtp-105 -60.41 -43.49 96.67 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.214 1.806 . . . . 0.0 113.182 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -35.06 70.84 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -77.89 -46.23 21.92 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 112.071 -2.331 . . . . 0.0 111.604 -179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 51.1 t -62.52 -47.29 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 C-N-CA 126.169 1.788 . . . . 0.0 108.039 177.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.24 -43.8 79.03 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 128.888 2.875 . . . . 0.0 111.57 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -52.63 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 112.235 -2.257 . . . . 0.0 110.673 176.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.58 -39.68 68.05 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 112.903 -1.953 . . . . 0.0 113.174 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.1 mtt -59.87 -52.81 63.85 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 117.428 2.381 . . . . 0.0 117.428 -173.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.04 96.52 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 112.412 -2.176 . . . . 0.0 112.866 178.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.92 -33.1 75.04 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 111.324 -2.671 . . . . 0.0 113.987 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 65.2 mt -98.78 21.11 11.9 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.996 1.718 . . . . 0.0 113.878 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.17 24.14 7.73 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -99.74 157.26 16.61 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -172.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.358 7.2 mm . . . . . 0 C--N 1.328 -0.326 0 N-CA-C 118.806 2.891 . . . . 0.0 118.806 -177.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.443 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.458 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 p -78.56 114.75 17.75 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 102.706 -3.072 . . . . 0.0 102.706 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.3 mt -48.69 -19.91 0.41 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -54.74 -35.52 63.81 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.382 0.673 . . . . 0.0 111.318 167.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -60.76 -47.69 85.19 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.992 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.7 t -59.26 -43.06 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.83 -52.84 61.59 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 111.582 -2.553 . . . . 0.0 111.877 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.39 -39.47 92.26 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.387 1.875 . . . . 0.0 113.868 178.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -66.97 -34.32 77.5 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.156 0.91 . . . . 0.0 110.829 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.45 -13.46 34.77 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 125.018 1.327 . . . . 0.0 112.099 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.39 26.3 72.27 Favored Glycine 0 CA--C 1.546 2.002 0 C-N-CA 126.674 2.083 . . . . 0.0 112.985 173.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -125.96 136.14 61.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 121.448 0.642 . . . . 0.0 109.865 -171.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.8 p -36.65 128.65 0.82 Allowed 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 128.694 2.798 . . . . 0.0 108.131 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -49.23 -36.55 20.48 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.522 0.0 OUTLIER -59.48 -27.19 65.9 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 121.734 3.975 . . . . 0.0 121.734 172.695 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.3 p -62.58 -52.82 61.88 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.457 1.098 . . . . 0.0 111.796 163.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.28 -50.29 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.969 1.308 . . . . 0.0 108.532 -173.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.7 p -55.69 -42.47 75.25 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.683 1.193 . . . . 0.0 113.901 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 40.8 mtt85 -62.06 -47.41 84.8 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 111.817 -2.447 . . . . 0.0 116.328 170.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.1 t -58.28 -41.38 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 C-N-CA 127.048 2.139 . . . . 0.0 107.556 178.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.5 t -56.8 -42.55 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.286 -170.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.284 15.1 m120 -101.31 22.99 11.61 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 168.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.389 9.3 pt20 58.47 -0.36 0.12 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 130.988 3.715 . . . . 0.0 119.404 -177.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.09 33.08 0.14 Allowed 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 112.14 -2.3 . . . . 0.0 114.716 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p 59.96 -54.04 0.07 Allowed 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 126.999 2.12 . . . . 0.0 114.432 -159.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -144.41 116.37 8.32 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-N 113.606 -1.634 . . . . 0.0 111.985 -172.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.2 t -146.43 156.49 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 120.254 1.388 . . . . 0.0 113.083 168.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -45.57 133.82 7.55 Favored 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.89 -53.44 52.61 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -49.11 -35.59 16.73 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 117.827 2.529 . . . . 0.0 117.827 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.7 m -60.05 -50.24 74.5 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -58.48 -42.5 87.69 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.81 -39.78 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -74.34 -43.79 55.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.531 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.7 t -63.08 -49.1 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 125.83 1.652 . . . . 0.0 108.052 177.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.87 -41.38 82.35 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.251 2.62 . . . . 0.0 114.886 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -49.31 75.1 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 111.311 -2.677 . . . . 0.0 110.325 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.61 -39.86 85.65 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 112.638 -2.074 . . . . 0.0 113.308 175.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.7 mtt -58.89 -51.59 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.68 97.68 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 112.248 -2.251 . . . . 0.0 111.88 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -62.85 -42.51 99.77 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 111.534 -2.575 . . . . 0.0 112.249 -178.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.8 mt -93.09 23.21 4.44 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.355 1.862 . . . . 0.0 114.02 -177.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 50.4 34.15 8.73 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.955 2.206 . . . . 0.0 116.955 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -96.17 160.69 14.31 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 113.986 -1.461 . . . . 0.0 112.754 -173.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.898 0 CA-C-N 112.556 -2.111 . . . . 0.0 109.048 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 103.448 -2.797 . . . . 0.0 103.448 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.257 80.3 m -61.86 110.46 1.55 Allowed 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 105.202 -2.148 . . . . 0.0 105.202 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -51.85 -17.46 0.97 Allowed 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.373 23.1 m-85 -57.78 -29.38 64.8 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 120.28 1.4 . . . . 0.0 112.687 165.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -63.43 -50.96 67.72 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.399 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -56.89 -43.04 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 CA-C-O 121.302 0.572 . . . . 0.0 112.418 175.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.12 -50.77 71.86 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 112.436 -2.165 . . . . 0.0 111.847 -176.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.78 -40.65 79.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.624 1.97 . . . . 0.0 115.182 175.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -62.79 -33.93 76.21 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.048 1.339 . . . . 0.0 110.079 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.68 -22.64 17.43 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 113.891 -1.504 . . . . 0.0 111.663 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.53 25.35 56.91 Favored Glycine 0 CA--C 1.554 2.524 0 C-N-CA 125.699 1.619 . . . . 0.0 113.18 173.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.9 p -126.25 94.5 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.222 0 C-N-CA 122.992 0.517 . . . . 0.0 110.066 -167.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.6 p -7.62 127.11 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.734 0 C-N-CA 127.334 2.254 . . . . 0.0 113.672 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -50.17 -38.89 41.88 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 117.924 2.565 . . . . 0.0 117.924 -171.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -51.2 -40.11 57.98 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 118.906 0.775 . . . . 0.0 112.472 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 20.4 m -55.39 -53.26 58.48 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.835 2.054 . . . . 0.0 112.169 171.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 73.6 t -63.73 -53.42 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-O 118.675 -0.679 . . . . 0.0 109.698 -173.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.413 3.2 m -60.22 -34.09 73.17 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 117.198 2.295 . . . . 0.0 117.198 -177.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 mtp85 -59.06 -49.54 77.51 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.249 -1.796 . . . . 0.0 115.36 166.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.5 t -57.82 -47.24 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 126.533 1.933 . . . . 0.0 108.749 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.3 t -57.35 -42.07 79.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 O-C-N 126.594 2.434 . . . . 0.0 112.299 -166.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -94.54 15.01 19.04 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 125.209 1.568 . . . . 0.0 112.773 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 69.03 9.63 7.51 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.15 2.18 . . . . 0.0 116.571 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.66 38.63 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.789 -2.46 . . . . 0.0 117.197 -173.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.4 p 58.88 -50.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 126.343 1.857 . . . . 0.0 115.758 -164.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -146.86 93.8 2.33 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -116.63 155.34 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.58 124.87 21.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.82 -63.56 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.362 0.1 OUTLIER -42.6 -35.63 1.15 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 119.652 3.204 . . . . 0.0 119.652 173.078 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 m -65.46 -50.55 64.95 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 112.879 -1.964 . . . . 0.0 108.178 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -57.16 -45.79 83.32 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.59 -36.43 73.99 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.5 ttmt -76.06 -44.32 39.6 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 112.266 -2.243 . . . . 0.0 111.186 -177.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.91 -47.94 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 126.463 1.905 . . . . 0.0 108.18 177.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -54.55 -44.84 73.21 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.452 2.701 . . . . 0.0 111.405 -178.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.89 69.53 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.142 -2.299 . . . . 0.0 111.0 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.52 -41.37 89.83 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 113.206 -1.816 . . . . 0.0 114.019 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.5 mtt -62.07 -44.83 95.82 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 119.949 -1.719 . . . . 0.0 112.962 -174.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.52 93.49 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 126.271 2.232 . . . . 0.0 111.496 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -65.91 -34.18 77.53 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.914 -2.403 . . . . 0.0 113.351 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.5 mt -97.24 13.92 27.8 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.294 2.237 . . . . 0.0 114.486 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.37 33.75 21.48 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 117.573 2.435 . . . . 0.0 117.573 175.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -92.1 152.68 19.81 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.925 -171.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.294 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.74 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.694 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.53 1.1 t . . . . . 0 N--CA 1.497 1.925 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 40.0 p -95.32 145.33 25.18 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.262 0.937 . . . . 0.0 109.556 -175.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mt -59.94 -14.9 17.94 Favored 'General case' 0 N--CA 1.506 2.343 0 N-CA-C 117.095 2.258 . . . . 0.0 117.095 -163.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -55.87 -38.42 70.1 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.468 1.485 . . . . 0.0 111.448 174.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -64.73 -44.51 89.94 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.767 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.1 t -59.64 -43.61 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-N 118.747 0.703 . . . . 0.0 112.886 172.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.9 69.94 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 113.173 -1.83 . . . . 0.0 113.394 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.75 -39.55 87.94 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.473 1.909 . . . . 0.0 114.274 174.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -63.43 -33.7 76.13 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.414 1.086 . . . . 0.0 110.31 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.28 -19.58 19.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.106 1.362 . . . . 0.0 112.216 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.83 25.1 56.92 Favored Glycine 0 CA--C 1.549 2.216 0 C-N-CA 126.613 2.054 . . . . 0.0 113.399 174.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.268 3.9 p -129.83 119.16 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.33 0 C-N-CA 124.914 1.285 . . . . 0.0 108.24 -166.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.7 p -27.47 143.55 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.344 0 C-N-CA 128.647 2.779 . . . . 0.0 111.849 -174.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -57.62 -34.33 69.19 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 119.238 -2.164 . . . . 0.0 114.665 175.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.266 14.8 tp60 -56.41 -45.95 80.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 117.434 -1.27 . . . . 0.0 112.596 173.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.4 m -53.31 -54.17 40.35 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.885 1.274 . . . . 0.0 111.388 175.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.6 t -64.18 -49.26 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.837 -176.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.281 69.6 p -57.42 -39.38 76.07 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 119.196 3.036 . . . . 0.0 119.196 -174.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.6 mtp85 -61.58 -51.18 69.6 Favored 'General case' 0 C--N 1.319 -0.72 1 CA-C-N 106.857 -4.701 . . . . 0.0 114.198 167.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.1 t -58.58 -43.01 86.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.861 1.265 . . . . 0.0 109.764 -176.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.9 t -49.14 -53.22 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 112.705 -2.043 . . . . 0.0 111.816 -171.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.331 16.4 m120 -107.37 37.43 2.4 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 113.67 -1.605 . . . . 0.0 114.589 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.253 2.2 tp60 73.92 -5.46 2.03 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 129.289 3.036 . . . . 0.0 117.873 166.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 36.69 36.32 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 113.302 -1.772 . . . . 0.0 115.256 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.0 p 55.31 -48.37 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -151.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.262 71.7 m80 -157.57 130.91 7.77 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -170.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -145.5 150.68 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 116.967 2.21 . . . . 0.0 116.967 162.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.3 p -51.47 139.47 19.88 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -57.48 9.34 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -173.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.2 -43.22 1.63 Allowed 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 176.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.8 m -57.79 -48.79 78.69 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 126.528 1.931 . . . . 0.0 108.577 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtt-85 -65.33 -44.8 86.63 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 117.475 2.398 . . . . 0.0 117.475 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.21 -29.94 64.15 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -80.31 -42.28 23.31 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 111.381 -2.645 . . . . 0.0 112.048 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.54 -49.7 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 125.686 1.595 . . . . 0.0 109.204 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -55.63 -46.84 77.34 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.605 3.162 . . . . 0.0 111.757 -176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -51.17 64.02 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.339 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.97 -42.05 84.23 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 112.974 -1.921 . . . . 0.0 114.598 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -56.09 -45.2 79.49 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 178.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.09 -43.74 91.1 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.646 -2.07 . . . . 0.0 113.071 177.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -66.1 -38.46 88.27 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 112.759 -2.019 . . . . 0.0 113.014 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.3 mt -85.3 13.66 6.25 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 127.089 2.156 . . . . 0.0 113.842 177.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.401 0.2 OUTLIER 44.99 31.5 0.71 Allowed 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 115.98 1.844 . . . . 0.0 115.98 -176.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -98.59 101.14 12.47 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.058 -160.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.173 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 167.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.434 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.483 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -77.56 107.0 9.71 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 101.388 -3.56 . . . . 0.0 101.388 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -51.14 -10.24 0.07 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 120.161 3.393 . . . . 0.0 120.161 -175.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -53.75 -31.9 50.23 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.644 0.656 . . . . 0.0 112.221 162.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.76 -52.74 62.99 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 176.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.15 -43.23 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 172.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.05 -51.09 71.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 113.119 -1.855 . . . . 0.0 111.876 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -39.5 91.24 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.219 2.207 . . . . 0.0 114.146 174.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -65.79 -34.05 77.28 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.141 0.977 . . . . 0.0 110.909 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.39 -13.63 37.31 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.829 1.251 . . . . 0.0 111.332 177.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.9 23.12 64.67 Favored Glycine 0 N--CA 1.491 2.32 0 C-N-CA 127.199 2.333 . . . . 0.0 113.387 172.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.49 124.28 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.514 1.126 . . . . 0.0 111.331 -168.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -32.2 129.63 0.18 Allowed 'General case' 0 N--CA 1.526 3.336 0 C-N-CA 125.347 1.459 . . . . 0.0 109.631 175.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -45.26 -34.57 2.93 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 118.318 2.711 . . . . 0.0 118.318 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.58 -30.2 12.66 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.9 p -66.77 -56.67 9.43 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 168.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 78.5 t -57.47 -53.48 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 C-N-CA 123.901 0.88 . . . . 0.0 110.237 -164.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 2.0 m -60.93 -35.04 75.68 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -64.51 -47.33 79.3 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.0 t -59.56 -40.9 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.207 1.403 . . . . 0.0 108.851 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 91.9 t -51.14 -46.18 31.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 O-C-N 125.461 1.726 . . . . 0.0 111.492 -171.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.303 20.3 m120 -107.42 32.4 4.69 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 173.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 64.52 0.34 1.08 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 130.089 3.355 . . . . 0.0 118.95 175.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.59 35.25 0.18 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 113.064 -1.88 . . . . 0.0 114.698 -173.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.9 p 62.52 -44.95 0.18 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -158.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.298 69.1 m80 -165.51 116.75 1.09 Allowed 'General case' 0 CA--C 1.561 1.395 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 -168.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.4 162.67 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 159.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 p -45.94 135.61 7.13 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.67 -61.1 2.3 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -171.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.3 pptp? -39.69 -37.47 0.52 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 117.82 2.526 . . . . 0.0 117.82 176.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -61.41 -50.03 74.5 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.447 1.499 . . . . 0.0 108.866 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -43.84 97.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.99 -35.46 76.88 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -80.18 -46.04 17.04 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 112.657 -2.065 . . . . 0.0 112.243 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.7 t -59.91 -49.93 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.527 1.131 . . . . 0.0 108.953 173.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -56.35 -41.54 76.27 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.816 2.046 . . . . 0.0 114.91 -178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.93 -53.28 52.72 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 111.679 -2.51 . . . . 0.0 110.469 175.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.55 -40.45 78.9 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 113.298 -1.773 . . . . 0.0 113.476 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.0 mtt -59.44 -48.55 81.2 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -176.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.88 -41.05 95.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 112.175 -2.284 . . . . 0.0 112.996 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -65.6 -37.18 85.89 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.292 -1.776 . . . . 0.0 113.286 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.9 mt -90.81 14.33 13.89 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.538 2.335 . . . . 0.0 112.878 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.275 3.7 p-10 53.92 19.05 1.82 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 120.029 3.344 . . . . 0.0 120.029 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -87.45 91.82 8.87 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 112.243 -2.253 . . . . 0.0 110.887 -169.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.51 2.557 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.236 153.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.378 1.2 t . . . . . 0 N--CA 1.484 1.269 0 CA-C-O 122.134 0.969 . . . . 0.0 108.606 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.417 1.2 m -51.85 109.17 0.34 Allowed 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 131.014 3.725 . . . . 0.0 107.701 175.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -48.71 -24.46 1.39 Allowed 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 117.726 2.491 . . . . 0.0 117.726 171.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.262 54.0 m-85 -61.62 -31.57 71.66 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 168.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.66 -46.56 87.64 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 118.154 -0.927 . . . . 0.0 110.464 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.9 t -56.94 -42.74 79.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 174.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.59 -54.9 39.85 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.809 1.644 . . . . 0.0 112.709 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -36.61 84.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.157 1.783 . . . . 0.0 113.387 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -64.93 -37.38 87.45 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.873 0.844 . . . . 0.0 109.859 177.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.66 -10.86 50.09 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.604 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.54 24.19 73.39 Favored Glycine 0 N--CA 1.487 2.061 0 C-N-CA 127.528 2.49 . . . . 0.0 113.431 172.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -125.98 122.49 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.026 0.93 . . . . 0.0 111.879 -167.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.7 p -29.41 121.42 0.15 Allowed 'General case' 0 N--CA 1.524 3.249 0 C-N-CA 127.929 2.491 . . . . 0.0 107.95 171.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -49.85 -27.47 5.14 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.8 tp60 -46.1 -40.51 11.0 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.94 1.4 . . . . 0.0 112.133 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.4 p -61.07 -55.24 34.92 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 173.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.255 74.2 t -59.96 -46.65 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.617 1.167 . . . . 0.0 109.648 -169.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.9 p -59.77 -45.87 90.93 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.5 mtp85 -57.5 -46.47 83.73 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.595 -2.093 . . . . 0.0 114.843 170.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.0 t -60.18 -44.94 96.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.724 1.209 . . . . 0.0 109.089 -176.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.2 t -52.92 -46.17 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 O-C-N 126.213 2.196 . . . . 0.0 111.269 -169.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.251 16.6 m120 -106.57 27.68 8.58 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 65.7 9.08 5.66 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 118.518 2.785 . . . . 0.0 118.518 171.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 34.25 33.68 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 128.266 2.626 . . . . 0.0 116.423 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 58.84 -42.75 0.07 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 -160.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -149.0 92.78 2.01 Favored 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.7 p -110.18 151.92 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 N-CA-C 117.223 2.305 . . . . 0.0 117.223 171.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -65.07 136.41 56.71 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 176.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.64 -43.38 96.96 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -175.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.85 -45.14 50.12 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 173.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.9 m -64.34 -47.47 79.25 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 112.658 -2.064 . . . . 0.0 108.386 177.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.45 -42.46 78.2 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.126 1.37 . . . . 0.0 114.631 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -60.96 -39.83 91.01 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 113.394 -1.73 . . . . 0.0 113.733 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -72.99 -43.59 62.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.661 1.985 . . . . 0.0 111.031 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.8 t -66.08 -48.98 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.087 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -52.49 -45.07 66.03 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 130.913 3.685 . . . . 0.0 110.354 -178.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.71 -51.14 66.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.172 176.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -46.15 87.16 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.339 -1.755 . . . . 0.0 113.306 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.41 -45.38 80.69 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.679 1.592 . . . . 0.0 112.972 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.57 -46.45 88.3 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 112.903 -1.953 . . . . 0.0 112.34 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -64.43 -38.49 91.2 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.034 -2.348 . . . . 0.0 112.837 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 11.4 mt -87.32 11.92 13.2 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.939 2.496 . . . . 0.0 114.185 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.41 0.2 OUTLIER 52.47 23.58 2.6 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.196 2.598 . . . . 0.0 113.388 -176.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -96.56 87.63 4.44 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.386 -1.446 . . . . 0.0 110.52 -159.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.519 2.987 0 CA-C-N 113.178 -1.828 . . . . 0.0 113.509 153.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.308 4.2 p -70.39 97.6 1.29 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -177.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.4 mt -41.49 -14.27 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 -175.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -53.74 -33.3 55.28 Favored 'General case' 0 CA--C 1.561 1.368 0 O-C-N 123.514 0.508 . . . . 0.0 110.913 165.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -59.07 -52.4 65.89 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 118.474 -0.774 . . . . 0.0 113.024 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 66.5 t -57.99 -45.04 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.506 0.722 . . . . 0.0 112.855 174.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.93 -49.18 78.81 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 113.444 -1.707 . . . . 0.0 112.016 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -43.61 79.2 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.139 1.776 . . . . 0.0 115.198 176.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -32.38 74.03 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.792 0.837 . . . . 0.0 111.311 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.7 -17.39 26.84 Favored 'General case' 0 CA--C 1.562 1.408 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.062 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.03 23.42 69.03 Favored Glycine 0 N--CA 1.49 2.264 0 C-N-CA 125.721 1.629 . . . . 0.0 113.524 173.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.253 4.5 p -123.28 126.07 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.426 0 C-N-CA 124.627 1.171 . . . . 0.0 107.929 -170.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.2 p -33.24 139.48 0.05 Allowed 'General case' 0 N--CA 1.528 3.432 0 C-N-CA 126.21 1.804 . . . . 0.0 111.269 -177.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.365 55.2 t80 -40.45 -65.87 0.37 Allowed 'General case' 0 N--CA 1.519 3.019 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.401 0.0 OUTLIER -58.0 -23.47 54.18 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 121.785 3.994 . . . . 0.0 121.785 -177.39 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 83.4 m -53.64 -48.43 69.38 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.595 163.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.57 -51.31 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.199 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.253 1.3 m -57.26 -36.03 70.47 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -178.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.8 mtt85 -59.21 -49.24 78.6 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 166.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 77.3 t -59.41 -41.0 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.454 -176.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.1 t -54.68 -50.23 61.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.319 0 CA-C-N 112.974 -1.921 . . . . 0.0 112.409 -167.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.398 3.9 m120 -100.6 29.74 4.31 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 170.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.81 14.65 7.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 129.16 2.984 . . . . 0.0 118.445 169.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.04 47.46 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 111.036 -2.802 . . . . 0.0 115.413 -173.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.254 91.5 p 57.32 -59.86 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 126.288 1.835 . . . . 0.0 115.214 -161.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -141.16 94.6 2.72 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -177.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.28 150.68 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 p -60.89 142.06 56.63 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -38.58 -79.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.125 2.17 . . . . 0.0 115.682 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -34.37 55.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.8 m -61.74 -49.28 77.04 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.618 178.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtm105 -58.39 -53.37 59.02 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.305 1.594 . . . . 0.0 115.305 173.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -50.85 -38.57 49.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -76.82 -47.88 20.13 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 111.242 -2.708 . . . . 0.0 113.127 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 43.2 t -61.18 -48.54 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.377 176.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -57.46 -45.83 84.32 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 128.161 2.584 . . . . 0.0 114.973 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.12 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 112.855 -1.975 . . . . 0.0 110.665 176.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.42 -36.94 74.38 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 112.763 -2.017 . . . . 0.0 115.081 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 20.5 mtt -60.65 -53.33 58.72 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -171.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.31 97.31 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 113.499 -1.682 . . . . 0.0 113.311 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.63 -39.29 93.44 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.264 -2.244 . . . . 0.0 113.693 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.2 mt -94.3 25.3 3.91 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.933 1.693 . . . . 0.0 112.682 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 59.54 21.57 10.12 Favored 'General case' 0 CA--C 1.57 1.741 0 C-N-CA 125.473 1.509 . . . . 0.0 114.32 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -93.19 166.57 12.26 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.956 0.902 . . . . 0.0 110.009 -175.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.702 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.457 1.1 t . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 103.374 -2.825 . . . . 0.0 103.374 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.8 p -101.99 145.44 29.28 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 117.57 -1.652 . . . . 0.0 108.944 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.24 -9.58 1.01 Allowed 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -165.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -58.82 -37.56 76.67 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.926 0.784 . . . . 0.0 111.514 170.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -62.31 -48.43 79.9 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 118.062 -0.971 . . . . 0.0 111.603 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.21 -40.89 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 N-CA-C 112.235 0.458 . . . . 0.0 112.235 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.47 -55.26 36.9 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 125.827 1.651 . . . . 0.0 114.716 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -41.68 94.36 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 127.153 2.181 . . . . 0.0 113.841 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -65.91 -31.47 72.43 Favored 'General case' 0 CA--C 1.551 0.981 0 O-C-N 124.411 1.07 . . . . 0.0 110.592 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.84 -16.86 22.59 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.111 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.94 23.2 59.92 Favored Glycine 0 CA--C 1.547 2.04 0 C-N-CA 126.496 1.998 . . . . 0.0 113.459 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.272 9.9 p -128.54 129.0 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -167.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.8 p -35.44 146.86 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 128.283 2.633 . . . . 0.0 112.181 -172.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -59.37 -32.8 70.46 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 119.192 -2.192 . . . . 0.0 114.648 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.271 27.2 tp60 -55.28 -38.93 69.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 117.473 -1.251 . . . . 0.0 113.01 171.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 20.3 m -59.9 -53.39 58.49 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.469 0.708 . . . . 0.0 110.917 174.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.377 62.7 t -65.52 -43.11 94.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.826 -171.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.9 p -58.31 -48.1 81.6 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -53.6 53.82 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 110.932 -2.849 . . . . 0.0 113.491 170.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 76.4 t -62.24 -44.81 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.991 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.9 t -64.28 -41.64 93.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 CA-C-N 113.771 -1.558 . . . . 0.0 111.23 -168.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -77.22 5.07 9.1 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 113.787 -1.551 . . . . 0.0 113.832 169.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 69.97 3.68 4.45 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.895 2.478 . . . . 0.0 114.653 177.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.61 42.35 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 128.745 2.818 . . . . 0.0 116.898 -173.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.259 84.8 p 65.41 -62.19 0.23 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.584 1.954 . . . . 0.0 112.266 -164.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.8 m170 -138.2 137.57 37.7 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 124.2 0.938 . . . . 0.0 109.357 172.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.253 1.4 p -138.21 153.84 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 120.278 1.399 . . . . 0.0 113.671 175.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -55.66 126.41 25.31 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.01 -60.88 1.27 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.1 -31.82 69.26 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.7 m -60.5 -48.17 82.92 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.145 1.378 . . . . 0.0 107.506 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -61.14 -44.66 96.98 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 116.773 2.138 . . . . 0.0 116.773 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.61 -34.36 71.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.864 178.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -80.28 -43.52 21.17 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.534 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.1 t -60.82 -48.28 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.549 1.54 . . . . 0.0 107.778 173.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.57 -40.76 88.4 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.916 2.086 . . . . 0.0 112.623 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.29 -49.66 70.94 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 113.783 -1.553 . . . . 0.0 111.137 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.01 -40.85 77.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 112.055 -2.339 . . . . 0.0 113.432 169.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 28.6 ttm -61.78 -46.24 90.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.632 1.573 . . . . 0.0 112.189 -172.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.44 -48.55 79.17 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.097 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.98 -39.15 93.83 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 113.19 -1.823 . . . . 0.0 113.561 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.6 mt -92.03 22.79 4.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -176.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 p30 57.03 19.35 4.6 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 117.624 2.453 . . . . 0.0 117.624 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -85.12 100.11 11.5 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.136 -1.393 . . . . 0.0 112.325 -163.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 116.41 -1.757 . . . . 0.0 113.024 160.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.481 1.1 t . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 100.523 -3.88 . . . . 0.0 100.523 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.7 p -81.31 139.05 35.62 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.895 -1.128 . . . . 0.0 108.491 -162.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 53.8 mt -62.09 -6.2 2.8 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 120.909 3.67 . . . . 0.0 120.909 -155.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.257 70.4 m-85 -57.69 -37.91 74.26 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.319 1.418 . . . . 0.0 111.611 173.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.94 -53.29 58.58 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 171.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.1 t -59.95 -44.32 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.129 0.572 . . . . 0.0 111.818 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.07 77.7 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.058 1.343 . . . . 0.0 112.818 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.42 -41.71 76.01 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.91 2.084 . . . . 0.0 114.185 178.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -63.96 -35.11 79.61 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.539 1.136 . . . . 0.0 110.003 177.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.81 -19.77 24.28 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.298 1.439 . . . . 0.0 111.528 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.72 28.21 61.53 Favored Glycine 0 N--CA 1.488 2.153 0 C-N-CA 125.721 1.629 . . . . 0.0 112.772 174.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.27 5.1 p -132.31 123.4 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.191 0 C-N-CA 124.82 1.248 . . . . 0.0 107.707 -170.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.7 p -32.46 145.09 0.02 OUTLIER 'General case' 0 N--CA 1.528 3.431 0 C-N-CA 128.005 2.522 . . . . 0.0 111.803 -171.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -57.89 -35.92 71.68 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 119.067 -2.27 . . . . 0.0 115.313 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -57.32 -40.23 77.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 118.772 -0.632 . . . . 0.0 112.187 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 57.4 m -55.24 -50.2 70.06 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.685 0.794 . . . . 0.0 110.122 173.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.332 74.2 t -66.54 -42.39 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.174 0.59 . . . . 0.0 112.459 -174.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.6 p -63.28 -47.38 82.59 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.4 mtp85 -51.61 -47.19 63.72 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.395 -2.184 . . . . 0.0 112.996 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.18 -48.41 88.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-O 122.035 0.921 . . . . 0.0 110.076 -176.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.9 t -59.76 -47.98 89.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 112.859 -1.973 . . . . 0.0 111.222 -172.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -84.99 23.13 1.26 Allowed 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.914 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.271 0.0 OUTLIER 59.22 7.79 0.96 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.382 2.673 . . . . 0.0 116.249 174.047 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 29.47 36.25 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 128.548 2.739 . . . . 0.0 116.075 -167.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p 59.33 -46.88 0.07 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 126.639 1.975 . . . . 0.0 115.759 -162.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -144.1 95.57 2.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.4 p -111.93 150.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -65.77 142.22 58.05 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.25 -69.47 0.11 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -49.62 -36.65 25.1 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 117.779 2.511 . . . . 0.0 117.779 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.2 m -58.82 -52.27 66.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.603 -1.635 . . . . 0.0 108.333 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.0 mtm105 -56.6 -47.52 79.42 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 175.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.09 -34.38 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -178.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.73 -42.95 57.34 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 112.542 -2.117 . . . . 0.0 112.02 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.62 -48.9 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 112.897 -1.956 . . . . 0.0 109.56 178.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -57.32 -47.15 82.28 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.655 2.782 . . . . 0.0 112.368 -178.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.34 -48.3 80.43 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 112.749 -2.023 . . . . 0.0 110.892 177.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.26 -43.63 88.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.527 -2.124 . . . . 0.0 114.703 175.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.9 mtt -59.28 -46.31 88.87 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.21 -44.35 95.55 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.881 -1.509 . . . . 0.0 112.437 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -61.54 -34.52 75.68 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.107 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.5 mt -99.79 13.08 34.94 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.625 2.37 . . . . 0.0 115.269 -177.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.378 0.2 OUTLIER 54.74 18.41 2.1 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 126.778 2.031 . . . . 0.0 115.763 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -83.83 102.29 12.24 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.428 -1.42 . . . . 0.0 108.467 -171.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.459 168.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.47 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.205 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.4 p -87.38 142.25 28.02 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.919 -168.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mt -58.94 -12.04 4.07 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 121.511 3.893 . . . . 0.0 121.511 -158.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -60.64 -34.14 73.83 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.557 0.617 . . . . 0.0 110.544 173.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -59.4 -50.55 73.51 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 170.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.49 -42.59 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 174.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.93 51.69 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 112.934 -1.939 . . . . 0.0 112.992 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -39.53 93.24 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.57 1.948 . . . . 0.0 114.309 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -64.44 -36.12 83.13 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.184 0.994 . . . . 0.0 110.39 176.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.98 -13.94 37.73 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.645 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.75 25.42 69.74 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 127.753 2.597 . . . . 0.0 113.31 172.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.25 128.62 71.73 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 CA-C-O 121.08 0.467 . . . . 0.0 111.894 -167.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.8 p -28.74 124.25 0.12 Allowed 'General case' 0 N--CA 1.52 3.053 0 C-N-CA 128.639 2.775 . . . . 0.0 109.323 174.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -45.31 -39.38 6.57 Favored 'General case' 0 N--CA 1.529 3.476 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.344 0.0 OUTLIER -54.05 -34.7 60.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 118.734 2.864 . . . . 0.0 118.734 -178.912 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 69.4 p -59.06 -47.11 86.42 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.755 1.222 . . . . 0.0 112.044 174.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.6 t -66.02 -54.31 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.546 1.139 . . . . 0.0 109.675 -177.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.511 20.1 m -64.11 -26.89 68.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -61.27 -48.43 81.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 110.542 -3.026 . . . . 0.0 115.273 163.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.65 -46.5 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.417 178.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.9 t -55.4 -48.04 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.852 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -104.93 19.7 20.11 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.26 2.9 mp0 64.92 14.8 9.53 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 174.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 44.36 6.28 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 110.524 -3.035 . . . . 0.0 119.066 175.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.2 t 65.04 -51.76 0.34 Allowed 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 124.224 1.01 . . . . 0.0 110.867 -155.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -130.1 101.94 6.03 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.159 175.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -108.7 134.61 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 176.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.0 p -72.43 133.95 45.14 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.9 -63.38 1.11 Allowed 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.375 0.0 OUTLIER -45.38 -33.38 2.52 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 117.492 2.404 . . . . 0.0 117.492 178.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.8 m -62.56 -49.73 74.1 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -56.64 -45.16 81.76 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.202 1.801 . . . . 0.0 112.884 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.44 -38.21 83.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 113.759 -1.564 . . . . 0.0 113.844 -175.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 ttpt -78.19 -44.96 24.35 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 126.93 2.092 . . . . 0.0 110.415 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 49.0 t -62.05 -45.71 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.647 1.579 . . . . 0.0 108.233 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.01 -43.12 69.82 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.228 3.011 . . . . 0.0 113.058 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.43 -50.02 71.43 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 111.548 -2.569 . . . . 0.0 110.96 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.92 -45.7 86.14 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.758 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.69 -47.53 84.22 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.069 2.148 . . . . 0.0 113.885 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.33 85.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 113.145 -1.843 . . . . 0.0 111.527 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -66.54 -37.4 84.91 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.317 -178.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.5 mt -88.83 14.28 10.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 178.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 53.48 28.54 7.76 Favored 'General case' 0 CA--C 1.57 1.725 0 C-N-CA 126.602 1.961 . . . . 0.0 113.62 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -89.51 169.27 11.5 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.543 -168.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.384 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -178.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 104.886 -2.265 . . . . 0.0 104.886 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.274 1.1 p -66.96 97.08 0.46 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.4 mt -36.35 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.623 0 N-CA-C 118.882 2.919 . . . . 0.0 118.882 -176.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -54.94 -33.46 62.27 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.574 1.079 . . . . 0.0 110.863 167.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -56.44 -52.79 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.939 172.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.53 -44.89 90.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.652 0.66 . . . . 0.0 112.003 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.11 -50.03 74.9 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.37 -178.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.76 -43.23 80.34 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.339 1.856 . . . . 0.0 115.497 174.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -65.47 -34.63 78.73 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.468 1.107 . . . . 0.0 111.131 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -17.95 25.36 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.801 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.46 26.02 68.9 Favored Glycine 0 N--CA 1.485 1.935 0 C-N-CA 125.822 1.677 . . . . 0.0 113.038 174.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.4 p -129.64 108.38 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -169.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.8 p -17.27 145.93 0.0 OUTLIER 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 127.051 2.14 . . . . 0.0 114.516 -174.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -52.32 -46.67 66.1 Favored 'General case' 0 N--CA 1.52 3.042 0 O-C-N 119.758 -1.839 . . . . 0.0 114.129 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.54 -41.94 61.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.435 1.084 . . . . 0.0 112.516 177.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.2 m -57.33 -50.7 72.1 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.296 1.039 . . . . 0.0 111.998 177.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.5 t -65.16 -51.0 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.044 -176.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m -58.02 -32.79 68.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.385 1.074 . . . . 0.0 112.645 -177.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.9 mtp85 -65.28 -49.44 69.54 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 168.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.3 t -62.08 -38.11 80.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.707 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.3 t -48.65 -54.33 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.578 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -87.37 16.15 5.67 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.175 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.375 0.2 OUTLIER 69.19 -1.42 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 130.212 3.405 . . . . 0.0 118.494 177.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 5.83 51.32 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 109.738 -3.392 . . . . 0.0 118.086 -164.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t 63.58 -57.29 0.19 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 110.95 -2.841 . . . . 0.0 115.427 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -130.59 21.64 5.1 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -163.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.321 93.6 t -74.06 111.68 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 N-CA-C 119.509 3.152 . . . . 0.0 119.509 -160.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 m -13.16 132.34 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.27 -2.241 . . . . 0.0 116.074 -174.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.64 -55.43 11.29 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -172.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.16 -49.48 42.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 117.936 2.569 . . . . 0.0 117.936 173.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.6 m -55.96 -49.53 73.3 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.254 1.021 . . . . 0.0 108.609 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -47.68 83.15 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 176.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.05 79.83 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -79.65 -42.21 25.29 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 112.662 -2.063 . . . . 0.0 112.534 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.9 t -60.84 -50.81 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 174.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -55.9 -44.24 78.01 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.631 2.773 . . . . 0.0 112.738 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.8 -51.27 65.54 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.673 -2.058 . . . . 0.0 110.83 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.46 84.37 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 112.935 -1.939 . . . . 0.0 113.356 175.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.9 mtt -59.17 -49.32 78.3 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -174.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.87 98.12 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 111.865 -2.425 . . . . 0.0 113.131 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.12 -38.15 87.48 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 112.525 -2.125 . . . . 0.0 114.022 -176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.2 mt -94.91 21.82 7.17 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 126.717 2.007 . . . . 0.0 113.314 -174.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.59 25.98 13.86 Favored 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -98.48 166.45 11.35 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.075 -1.42 . . . . 0.0 108.311 -171.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.952 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.995 -174.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.387 0.5 OUTLIER . . . . . 0 CA--C 1.554 1.123 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 5.0 p -80.93 102.97 10.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 102.636 -3.098 . . . . 0.0 102.636 177.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -46.36 -13.79 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.829 0 N-CA-C 118.681 2.845 . . . . 0.0 118.681 -174.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -53.99 -32.75 55.04 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 118.44 0.564 . . . . 0.0 111.2 165.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -57.9 -50.27 73.92 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.2 t -59.27 -43.32 89.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 118.492 0.587 . . . . 0.0 111.771 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.19 -49.94 75.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.638 -175.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.79 -41.77 78.3 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.894 2.078 . . . . 0.0 114.718 175.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -63.9 -33.66 76.21 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.975 0.91 . . . . 0.0 110.88 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.89 -18.73 22.44 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-N 113.497 -1.683 . . . . 0.0 111.037 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.24 26.78 56.96 Favored Glycine 0 N--CA 1.487 2.088 0 C-N-CA 126.383 1.945 . . . . 0.0 113.703 173.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.1 p -125.6 114.84 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 124.326 1.051 . . . . 0.0 110.932 -170.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -21.73 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 128.636 2.774 . . . . 0.0 110.989 175.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -42.23 -40.55 2.44 Favored 'General case' 0 N--CA 1.52 3.052 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -50.35 -38.91 44.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.582 1.176 . . . . 0.0 113.611 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.256 24.3 p -62.7 -51.23 68.03 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 173.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.411 76.5 t -59.54 -41.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.867 0.867 . . . . 0.0 112.53 -167.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.72 -38.12 89.91 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.2 mtp85 -62.97 -38.54 91.51 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 172.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 97.2 t -56.97 -47.82 82.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 126.717 2.007 . . . . 0.0 108.824 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.37 -55.96 20.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 109.285 -3.598 . . . . 0.0 114.303 -169.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -82.92 0.5 44.09 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 125.464 1.728 . . . . 0.0 114.336 175.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 55.0 36.93 28.05 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 124.744 2.212 . . . . 0.0 110.184 -170.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.381 . . -68.79 84.14 0.3 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 118.821 2.897 . . . . 0.0 118.821 -165.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 57.8 p 80.43 -88.76 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.728 169.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -112.36 44.05 1.51 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.3 p -34.07 135.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 111.931 -2.395 . . . . 0.0 113.246 151.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.4 t -111.23 126.43 54.86 Favored 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -170.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.03 -59.66 1.67 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -47.37 83.41 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.6 m -58.4 -48.26 81.22 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 112.605 -2.088 . . . . 0.0 105.599 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -39.42 76.07 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 113.798 -1.546 . . . . 0.0 115.06 -174.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -62.58 -40.82 98.12 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.453 -1.703 . . . . 0.0 114.269 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -75.56 -40.97 56.02 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.47 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.6 t -62.2 -48.92 86.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 127.486 2.314 . . . . 0.0 106.638 176.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -55.6 -43.31 75.93 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 128.409 2.683 . . . . 0.0 113.786 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.19 -51.65 62.71 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 110.73 -2.941 . . . . 0.0 110.4 172.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.87 -54.77 40.63 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.36 0.0 OUTLIER -64.29 -25.55 68.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 -174.66 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.17 -47.62 73.39 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.82 172.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.95 -34.2 75.68 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.588 1.555 . . . . 0.0 112.558 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.6 mt -95.68 7.24 46.84 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.304 2.642 . . . . 0.0 115.344 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.416 0.2 OUTLIER 60.4 14.57 4.83 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 178.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -73.44 105.37 4.78 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 C-N-CA 118.484 -1.286 . . . . 0.0 112.741 163.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.416 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -90.83 135.68 33.57 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 103.324 -2.843 . . . . 0.0 103.324 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.1 mt -54.91 -18.55 5.1 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 128.945 2.898 . . . . 0.0 116.053 -162.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -55.03 -33.57 62.78 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 119.566 1.076 . . . . 0.0 111.142 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -65.55 -47.83 74.52 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.169 176.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.5 t -55.79 -45.9 79.66 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 124.516 1.126 . . . . 0.0 112.625 173.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.05 -54.98 36.18 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 126.172 1.789 . . . . 0.0 112.671 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -38.07 89.75 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.123 1.769 . . . . 0.0 113.728 177.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.23 -34.8 78.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.022 1.329 . . . . 0.0 110.7 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.62 -4.57 55.11 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.13 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 70.15 23.45 77.21 Favored Glycine 0 N--CA 1.492 2.374 0 C-N-CA 127.274 2.368 . . . . 0.0 113.089 172.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.252 8.8 p -123.73 137.02 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -166.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 p -55.03 138.12 44.73 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.842 1.257 . . . . 0.0 109.013 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -49.95 -28.56 6.95 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -172.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 -46.96 -47.38 21.8 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 124.853 1.345 . . . . 0.0 112.292 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 65.3 p -58.78 -51.81 68.4 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.1 t -62.96 -51.82 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.817 1.647 . . . . 0.0 109.549 -173.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.8 t -59.13 -41.23 87.73 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.6 mtp85 -60.25 -45.2 94.08 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 113.804 -1.543 . . . . 0.0 114.854 173.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.6 t -57.56 -44.04 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.631 1.972 . . . . 0.0 109.277 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.0 t -58.07 -42.05 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 CA-C-N 111.315 -2.675 . . . . 0.0 112.491 -171.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -91.38 4.22 52.97 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 113.529 -1.668 . . . . 0.0 113.354 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? 58.1 17.18 4.31 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 128.852 2.861 . . . . 0.0 114.63 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.59 38.55 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 110.615 -2.993 . . . . 0.0 116.307 -174.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 97.6 p 55.36 -28.86 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 119.246 3.054 . . . . 0.0 119.246 -160.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -161.85 80.04 0.56 Allowed 'General case' 0 CA--C 1.564 1.501 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 -161.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -117.27 147.26 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 120.452 -1.405 . . . . 0.0 114.674 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.4 p -63.06 135.11 57.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.042 0.937 . . . . 0.0 113.458 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.15 -66.23 0.43 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.309 1.6 pptp? -48.02 -33.22 7.64 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 120.299 3.444 . . . . 0.0 120.299 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -61.77 -49.67 75.45 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.608 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.2 mtm105 -57.83 -46.89 84.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 175.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.39 -36.09 70.84 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -75.54 -44.1 45.27 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.493 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -63.93 -45.24 97.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.415 176.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -55.39 -43.78 75.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 129.532 3.133 . . . . 0.0 111.784 -177.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.11 -50.93 66.36 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.469 -1.696 . . . . 0.0 111.583 175.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.36 89.02 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 113.547 -1.66 . . . . 0.0 114.137 176.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.61 -45.21 85.64 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.926 1.69 . . . . 0.0 114.356 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.98 -46.31 85.18 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 113.553 -1.658 . . . . 0.0 111.035 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -64.81 -37.27 87.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 113.122 -1.854 . . . . 0.0 113.726 -178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.9 mt -96.37 17.82 15.2 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.94 2.496 . . . . 0.0 114.391 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.383 0.2 OUTLIER 51.41 21.74 1.28 Allowed 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 127.402 2.281 . . . . 0.0 115.772 177.436 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -74.72 154.72 38.29 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.436 -0.79 . . . . 0.0 110.54 -168.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.718 0 CA-C-N 112.181 -2.282 . . . . 0.0 111.813 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.487 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 102.121 -3.289 . . . . 0.0 102.121 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -93.85 134.16 36.51 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.079 -1.013 . . . . 0.0 108.39 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.6 mt -48.45 -17.69 0.18 Allowed 'General case' 0 N--CA 1.511 2.603 0 N-CA-C 118.454 2.761 . . . . 0.0 118.454 -163.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -58.1 -35.38 71.35 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.78 0.718 . . . . 0.0 111.316 172.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -64.18 -45.77 86.92 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 117.525 -1.226 . . . . 0.0 111.339 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 71.2 t -57.61 -42.22 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 CA-C-N 119.052 0.842 . . . . 0.0 112.987 174.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.18 -52.98 61.62 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 111.646 -2.525 . . . . 0.0 111.748 -176.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.67 -38.07 83.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.202 2.201 . . . . 0.0 113.204 177.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -64.35 -35.39 80.73 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.417 1.487 . . . . 0.0 109.521 177.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.15 -18.32 24.67 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.876 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.44 29.54 57.95 Favored Glycine 0 N--CA 1.49 2.24 0 C-N-CA 126.391 1.948 . . . . 0.0 113.003 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.1 p -125.36 137.9 56.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 123.908 0.883 . . . . 0.0 109.028 -170.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.0 p -43.41 122.07 2.48 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 127.038 2.135 . . . . 0.0 107.852 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -33.05 -48.76 0.22 Allowed 'General case' 0 N--CA 1.524 3.241 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.554 0.0 OUTLIER -57.84 -20.98 40.11 Favored 'General case' 0 C--N 1.314 -0.963 1 N-CA-C 124.232 4.901 . . . . 0.0 124.232 -179.956 . . . . . . . . 4 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.696 0.7 OUTLIER -76.56 -43.56 38.43 Favored 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 160.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.4 t -59.72 -49.39 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.635 -176.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.3 p -58.01 -44.43 87.26 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -173.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -60.36 -47.39 86.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 108.695 -3.866 . . . . 0.0 114.852 168.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.19 -40.66 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 68.5 t -53.62 -50.0 52.89 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 CA-C-N 113.914 -1.493 . . . . 0.0 112.966 -172.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.308 3.7 m120 -99.34 27.78 4.98 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 123.103 1.43 . . . . 0.0 114.706 170.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 71.31 -16.58 0.36 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 131.589 3.956 . . . . 0.0 116.583 173.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 45.18 37.93 2.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.113 2.165 . . . . 0.0 111.781 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.2 p 57.55 -46.34 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.751 -2.022 . . . . 0.0 115.821 -150.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -154.73 109.82 3.07 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.192 -165.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.3 t -132.97 132.55 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 120.628 1.558 . . . . 0.0 114.763 157.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -16.16 135.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 175.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.93 -49.08 79.08 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.559 1.144 . . . . 0.0 113.416 -173.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -44.2 43.65 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 175.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.0 m -62.03 -51.27 68.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 113.068 -1.878 . . . . 0.0 108.273 175.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.3 mtt-85 -53.87 -46.81 71.42 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.386 1.074 . . . . 0.0 113.856 178.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.88 -37.42 76.52 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.792 -1.095 . . . . 0.0 113.539 -176.274 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -76.44 -45.3 32.02 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.741 -2.027 . . . . 0.0 111.908 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.4 t -61.29 -47.91 91.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-N 113.884 -1.507 . . . . 0.0 108.513 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -58.53 -46.12 87.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.009 3.324 . . . . 0.0 111.503 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.54 -48.98 73.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 113.434 -1.712 . . . . 0.0 110.873 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.8 -43.94 86.01 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 112.95 -1.932 . . . . 0.0 112.661 173.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.9 mtt -55.04 -46.65 75.33 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 125.436 1.495 . . . . 0.0 112.169 -178.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -47.45 83.26 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 112.951 -1.931 . . . . 0.0 111.731 -175.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -61.03 -40.31 93.09 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 112.413 -2.176 . . . . 0.0 112.916 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.4 mt -87.13 6.23 33.81 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 128.393 2.677 . . . . 0.0 116.645 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.43 0.2 OUTLIER 52.6 23.1 2.45 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 128.09 2.556 . . . . 0.0 113.792 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.8 t80 -82.05 97.96 8.4 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 118.614 -2.554 . . . . 0.0 110.824 -172.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.633 155.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.327 0.5 OUTLIER . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 p -67.81 147.15 52.96 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -152.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.8 mt -48.89 -17.54 0.2 Allowed 'General case' 0 N--CA 1.517 2.889 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 -162.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -60.83 -40.58 93.32 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 118.596 0.635 . . . . 0.0 111.241 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -51.81 -55.86 17.37 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.299 1.04 . . . . 0.0 112.057 166.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.6 t -58.94 -39.72 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.07 -55.57 33.18 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 126.384 1.873 . . . . 0.0 112.701 172.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -38.37 89.3 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.52 1.928 . . . . 0.0 114.237 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -64.57 -37.28 87.02 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.466 1.107 . . . . 0.0 109.808 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.17 -12.33 44.23 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.829 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 26.61 67.57 Favored Glycine 0 CA--C 1.549 2.169 0 C-N-CA 127.533 2.492 . . . . 0.0 113.337 172.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.0 p -124.06 132.08 71.9 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 123.909 0.883 . . . . 0.0 110.663 -171.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -36.79 127.76 0.86 Allowed 'General case' 0 N--CA 1.522 3.137 0 C-N-CA 126.638 1.975 . . . . 0.0 108.952 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -48.05 -33.0 7.41 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 115.848 1.795 . . . . 0.0 115.848 176.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -52.38 -46.19 66.11 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-O 117.115 -1.421 . . . . 0.0 111.315 175.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.905 0.6 OUTLIER -67.86 -40.01 83.68 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.963 2.209 . . . . 0.0 116.963 176.544 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.278 78.2 t -59.61 -46.79 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 117.294 -1.336 . . . . 0.0 110.279 -177.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.347 3.5 m -68.08 -29.7 68.71 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 120.358 3.466 . . . . 0.0 120.358 -174.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -63.91 -52.18 61.08 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 110.808 -2.905 . . . . 0.0 113.184 162.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 62.8 t -62.39 -42.27 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 C-N-CA 124.488 1.115 . . . . 0.0 110.255 -172.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 52.3 t -51.65 -54.87 10.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 O-C-N 125.418 1.699 . . . . 0.0 111.112 -162.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.289 17.7 m120 -105.89 42.01 1.32 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 113.948 -1.478 . . . . 0.0 112.858 176.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.384 10.6 pt20 80.97 -9.97 1.27 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.546 3.539 . . . . 0.0 118.417 163.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.36 30.55 0.08 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.717 2.007 . . . . 0.0 115.075 -168.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.9 p 61.02 -44.82 0.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 115.98 1.845 . . . . 0.0 115.98 -155.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.276 78.4 m80 -152.53 126.4 9.0 Favored 'General case' 0 CA--C 1.558 1.275 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -170.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.7 p -141.53 162.75 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.568 0 CA-C-N 120.157 1.344 . . . . 0.0 112.656 170.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -59.45 130.03 44.88 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 170.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.93 -59.53 4.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -175.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.6 tptp -41.41 -41.3 1.98 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.7 m -58.51 -47.0 85.59 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 113.639 -1.619 . . . . 0.0 109.173 -178.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.6 mmt85 -55.34 -45.19 76.43 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -35.13 76.05 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -78.55 -42.3 29.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 112.477 -2.147 . . . . 0.0 112.217 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.3 t -60.83 -50.8 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.007 1.723 . . . . 0.0 108.059 173.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -54.95 -44.9 74.77 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 125.327 1.451 . . . . 0.0 112.922 -178.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.89 -49.26 71.18 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 112.479 -2.146 . . . . 0.0 111.213 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.17 -45.59 83.52 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 113.581 -1.645 . . . . 0.0 113.249 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.1 mmt -60.11 -47.39 86.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.667 -1.151 . . . . 0.0 114.019 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 113.27 -1.786 . . . . 0.0 111.449 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -64.78 -40.62 95.56 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.027 -2.351 . . . . 0.0 112.358 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.78 6.67 26.93 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 127.81 2.444 . . . . 0.0 112.517 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.474 0.2 OUTLIER 44.16 34.05 0.92 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -171.257 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -98.34 88.46 4.16 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 111.324 -2.671 . . . . 0.0 108.778 -166.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.853 0 CA-C-N 111.65 -2.523 . . . . 0.0 114.219 155.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.5 OUTLIER . . . . . 0 CA--C 1.558 1.268 0 N-CA-C 102.578 -3.119 . . . . 0.0 102.578 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.337 0.8 OUTLIER -71.09 106.09 3.6 Favored 'General case' 0 CA--C 1.563 1.475 0 N-CA-C 101.75 -3.426 . . . . 0.0 101.75 -179.392 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.7 mt -45.48 -16.3 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.894 0 N-CA-C 118.341 2.719 . . . . 0.0 118.341 -179.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.314 56.4 m-85 -54.54 -32.5 58.37 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.621 1.555 . . . . 0.0 111.447 166.395 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -60.19 -49.67 76.71 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.327 175.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.98 -46.25 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 174.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.75 -49.51 77.44 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 111.67 -2.513 . . . . 0.0 111.66 -176.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.89 -43.09 80.14 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.629 2.372 . . . . 0.0 114.678 177.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -63.24 -32.89 74.41 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.864 0.728 . . . . 0.0 110.601 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.75 -16.44 25.43 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 113.94 -1.482 . . . . 0.0 111.723 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.77 25.78 66.5 Favored Glycine 0 CA--C 1.55 2.24 0 C-N-CA 126.56 2.028 . . . . 0.0 113.618 173.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.276 4.3 p -129.94 125.12 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.511 0 C-N-CA 124.115 0.966 . . . . 0.0 108.394 -167.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -32.96 139.26 0.05 Allowed 'General case' 0 N--CA 1.526 3.37 0 C-N-CA 127.507 2.323 . . . . 0.0 111.274 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -52.52 -41.73 63.71 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-N 121.117 1.78 . . . . 0.0 115.047 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.529 0.0 OUTLIER -61.77 -30.51 70.84 Favored 'General case' 0 C--N 1.318 -0.77 1 N-CA-C 122.718 4.34 . . . . 0.0 122.718 175.331 . . . . . . . . 4 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -55.19 -49.34 72.16 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 112.801 -2.0 . . . . 0.0 109.581 162.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.284 73.9 t -64.67 -48.06 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.772 -178.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.338 3.3 m -63.37 -33.24 75.12 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.7 mtt85 -60.9 -48.84 79.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.085 -1.87 . . . . 0.0 114.354 167.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.07 -39.98 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.695 1.198 . . . . 0.0 108.954 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.1 t -55.28 -42.53 66.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-N 113.53 -1.668 . . . . 0.0 112.996 -170.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.12 19.4 19.62 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 171.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.28 0.7 OUTLIER 65.47 11.65 7.56 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 129.459 3.104 . . . . 0.0 118.731 176.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.73 42.08 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 110.57 -3.014 . . . . 0.0 116.096 -173.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.275 69.7 m 58.14 -44.45 0.05 Allowed 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 117.906 2.558 . . . . 0.0 117.906 -165.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -152.68 101.32 2.62 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.276 4.2 p -132.04 147.82 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -57.21 143.09 40.53 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -172.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.35 -67.16 0.31 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -40.63 66.77 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -177.123 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 36.8 m -56.95 -52.47 65.09 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 113.058 -1.883 . . . . 0.0 106.938 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm105 -61.39 -48.55 80.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.792 1.237 . . . . 0.0 114.265 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.11 86.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.294 1.837 . . . . 0.0 114.826 -176.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -75.43 -42.84 52.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 112.059 -2.337 . . . . 0.0 110.761 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.78 -49.83 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 CA-C-N 114.187 -1.37 . . . . 0.0 107.76 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.39 -46.42 73.08 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 126.661 1.985 . . . . 0.0 112.599 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.61 80.75 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 112.361 -2.2 . . . . 0.0 111.134 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.23 -39.97 80.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.584 -2.098 . . . . 0.0 113.293 173.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 30.5 mtt -61.01 -52.11 66.39 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -172.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.28 -41.33 85.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.254 -1.793 . . . . 0.0 113.673 174.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -59.46 -37.83 79.2 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 113.402 -1.726 . . . . 0.0 113.45 -178.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.9 mt -91.99 26.06 2.6 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 52.38 33.6 13.28 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.82 1.772 . . . . 0.0 114.139 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 66.3 t80 -101.45 -177.49 3.45 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.423 1.489 . . . . 0.0 109.751 -174.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 47' ' ' TYR 0.258 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 117.374 -1.298 . . . . 0.0 108.683 -177.24 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.2 p -61.45 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 174.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.7 mt -35.17 -16.89 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.347 0 N-CA-C 119.596 3.184 . . . . 0.0 119.596 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -53.34 -33.89 55.35 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.407 0.683 . . . . 0.0 110.899 164.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -57.23 -50.6 72.37 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 172.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.6 t -59.95 -43.12 91.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 123.252 0.621 . . . . 0.0 112.592 173.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.78 -55.11 39.4 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 112.065 -2.334 . . . . 0.0 112.175 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.24 -40.59 90.33 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.717 2.007 . . . . 0.0 115.049 177.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -65.22 -35.76 82.05 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.964 0.887 . . . . 0.0 110.73 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.11 -19.33 27.17 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 113.632 -1.622 . . . . 0.0 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 26.19 57.93 Favored Glycine 0 CA--C 1.545 1.951 0 C-N-CA 126.793 2.139 . . . . 0.0 113.001 172.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.6 p -119.56 126.4 75.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 125.325 1.45 . . . . 0.0 110.605 -171.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.2 p -28.3 121.4 0.12 Allowed 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 129.154 2.982 . . . . 0.0 110.476 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -44.46 -45.1 8.97 Favored 'General case' 0 N--CA 1.521 3.091 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.665 0.6 OUTLIER -56.56 -18.63 12.4 Favored 'General case' 0 C--N 1.321 -0.643 1 N-CA-C 125.265 5.283 . . . . 0.0 125.265 176.22 . . . . . . . . 4 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 71.0 p -64.66 -53.01 54.13 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 113.714 -1.584 . . . . 0.0 113.65 159.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.25 80.1 t -60.99 -50.86 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 O-C-N 121.106 -0.996 . . . . 0.0 110.87 -164.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.29 13.8 m -59.76 -35.18 74.08 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -179.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.2 mtt85 -67.23 -42.73 83.54 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 112.055 -2.339 . . . . 0.0 117.103 170.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.63 -43.13 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 125.813 1.645 . . . . 0.0 108.161 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.2 t -49.04 -49.45 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.289 0 O-C-N 125.708 1.88 . . . . 0.0 111.416 -171.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.377 14.3 m120 -106.46 29.85 6.51 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 18.3 tt0 61.05 17.76 8.3 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 129.493 3.117 . . . . 0.0 115.604 170.372 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.58 39.88 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 111.735 -2.484 . . . . 0.0 116.998 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.257 86.1 p 61.01 -56.72 0.09 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 126.313 1.845 . . . . 0.0 113.663 -163.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.288 98.8 m-70 -138.26 115.49 11.04 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.969 167.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 p -127.17 156.11 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 172.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.9 p -54.63 134.71 47.01 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 174.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.99 -53.28 57.83 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -175.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -48.4 -41.71 29.79 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -56.46 -48.72 76.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 114.271 -1.331 . . . . 0.0 107.881 176.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -59.22 -42.64 91.46 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 117.72 2.489 . . . . 0.0 117.72 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -36.07 76.13 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 113.479 -1.691 . . . . 0.0 115.445 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -77.99 -44.56 26.3 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 111.949 -2.387 . . . . 0.0 111.283 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.6 t -64.25 -45.36 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 113.803 -1.544 . . . . 0.0 108.636 177.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -58.44 -42.09 86.53 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.565 3.146 . . . . 0.0 112.985 -177.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -52.03 65.06 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 112.585 -2.098 . . . . 0.0 109.843 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.66 -38.15 74.6 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 113.285 -1.78 . . . . 0.0 114.999 175.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 36.3 mtt -59.81 -53.21 60.61 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.04 94.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 113.07 -1.877 . . . . 0.0 112.386 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.42 -37.29 86.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 112.619 -2.082 . . . . 0.0 113.732 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.5 mt -98.75 20.76 12.46 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 126.455 1.902 . . . . 0.0 113.539 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 56.72 25.24 9.91 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 116.52 2.045 . . . . 0.0 116.52 175.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -86.82 170.83 11.35 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.294 -172.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.861 -170.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.494 1.728 1 N-CA-C 122.388 4.218 . . . . 0.0 122.388 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.31 7.0 t 71.82 149.59 0.09 Allowed 'General case' 0 N--CA 1.491 1.602 1 C-N-CA 133.92 4.888 . . . . 0.0 117.587 -177.862 . . . . . . . . 3 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.9 mt -62.55 -27.85 69.45 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -58.1 -37.54 74.71 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.876 0.871 . . . . 0.0 109.695 172.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -64.94 -49.51 70.08 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.885 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -43.34 90.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.1 -46.53 82.5 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.415 1.886 . . . . 0.0 113.214 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.54 -43.96 71.9 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 126.315 1.846 . . . . 0.0 115.673 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -64.55 -33.22 75.4 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.559 0.695 . . . . 0.0 110.546 177.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.38 -20.64 23.73 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.555 -1.657 . . . . 0.0 111.568 -179.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.18 27.9 61.18 Favored Glycine 0 N--CA 1.489 2.229 0 C-N-CA 125.524 1.535 . . . . 0.0 112.773 171.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.255 8.6 p -132.28 120.94 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.476 0.71 . . . . 0.0 109.727 -167.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.6 p -26.35 139.67 0.01 OUTLIER 'General case' 0 N--CA 1.524 3.27 0 C-N-CA 128.233 2.613 . . . . 0.0 110.623 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -54.51 -34.8 62.31 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 119.483 -2.011 . . . . 0.0 114.728 178.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -53.51 -44.69 69.29 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.909 0.756 . . . . 0.0 111.62 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 36.6 m -55.13 -52.53 62.98 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.958 1.303 . . . . 0.0 111.127 176.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 76.9 t -65.33 -50.83 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.393 -0.813 . . . . 0.0 110.911 -175.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.384 7.6 m -63.15 -31.15 72.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 118.453 2.76 . . . . 0.0 118.453 -178.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.6 mtp85 -60.01 -48.85 80.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.356 -2.657 . . . . 0.0 115.121 164.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.8 t -59.72 -45.11 94.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 124.949 1.3 . . . . 0.0 108.797 -179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.8 t -53.14 -44.69 52.64 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 112.753 -2.021 . . . . 0.0 112.108 -171.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.285 11.1 m120 -104.22 25.82 9.6 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 173.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.87 19.99 7.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.668 2.787 . . . . 0.0 115.997 172.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.79 45.64 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 111.371 -2.65 . . . . 0.0 116.699 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 88.5 p 59.44 -52.93 0.06 Allowed 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 126.129 1.772 . . . . 0.0 114.802 -162.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.8 m170 -138.44 117.15 12.25 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.3 p -118.18 147.56 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 172.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 p -61.92 139.43 58.39 Favored 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.43 -66.53 0.39 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.271 0.0 OUTLIER -52.94 -34.07 53.74 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -62.48 -50.89 69.65 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -57.69 -46.91 83.7 Favored 'General case' 0 N--CA 1.434 -1.254 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 175.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.03 -36.35 65.42 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -175.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -74.56 -44.61 50.18 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.748 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.1 t -66.6 -50.01 70.03 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 113.677 -1.602 . . . . 0.0 109.606 177.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -49.77 -45.59 49.82 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.648 3.179 . . . . 0.0 111.394 178.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.15 77.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 111.404 -2.634 . . . . 0.0 110.887 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.61 -46.67 88.82 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 113.356 -1.747 . . . . 0.0 114.965 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.55 -45.41 81.26 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.342 1.857 . . . . 0.0 113.662 -177.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.42 78.58 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.177 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.42 -43.28 94.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 112.612 -2.085 . . . . 0.0 113.104 -177.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 mt -81.15 14.09 2.5 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.333 1.2 p-10 50.28 41.85 24.88 Favored 'General case' 0 CA--C 1.574 1.893 0 CA-C-O 122.777 1.275 . . . . 0.0 113.338 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -105.11 179.41 4.28 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 114.83 -1.077 . . . . 0.0 108.916 -173.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.272 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.082 0 O-C-N 121.36 -0.838 . . . . 0.0 112.1 -174.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.307 2.7 p -71.07 94.14 1.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 105.616 -1.994 . . . . 0.0 105.616 -175.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.9 mt -27.87 -16.66 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 1 N-CA-C 123.028 4.455 . . . . 0.0 123.028 177.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -56.5 -36.45 69.17 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 118.97 0.805 . . . . 0.0 111.158 165.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.02 -52.25 59.06 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 172.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.22 -45.93 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.166 0.987 . . . . 0.0 112.387 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.45 79.4 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.238 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -44.48 76.67 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 115.296 175.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -63.59 -33.53 75.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.993 1.317 . . . . 0.0 111.248 178.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.63 -15.35 25.44 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.92 -1.491 . . . . 0.0 111.21 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.95 26.69 68.32 Favored Glycine 0 N--CA 1.494 2.504 0 C-N-CA 125.949 1.738 . . . . 0.0 112.6 171.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.5 p -131.78 117.68 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.478 1.111 . . . . 0.0 108.441 -168.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.7 p -22.24 142.87 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.984 0 C-N-CA 127.066 2.146 . . . . 0.0 112.73 -174.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.25 83.3 t80 -50.73 -42.89 57.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 119.919 -1.738 . . . . 0.0 114.295 171.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -52.52 -41.9 63.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 123.872 0.733 . . . . 0.0 112.754 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.4 m -56.55 -51.86 66.97 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.75 175.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.328 86.9 t -64.91 -45.39 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 118.085 -0.959 . . . . 0.0 112.4 -173.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 3.7 m -63.57 -36.0 82.36 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -178.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -60.17 -47.45 85.89 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 167.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.98 -39.59 80.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.668 -178.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.9 t -53.06 -50.94 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 CA-C-N 113.898 -1.501 . . . . 0.0 112.293 -171.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -84.45 7.46 19.68 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 171.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 62.66 14.24 7.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 128.091 2.557 . . . . 0.0 113.781 -177.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.05 42.53 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 111.937 -2.392 . . . . 0.0 115.967 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.4 m 56.25 -36.1 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -165.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.281 79.1 m80 -157.29 103.25 1.97 Allowed 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 -178.14 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.98 156.88 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 120.093 -1.629 . . . . 0.0 114.53 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -60.57 136.26 58.0 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.21 -53.84 50.96 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -175.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.32 -38.97 66.59 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 177.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.7 m -62.07 -52.02 65.63 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 mtm105 -56.82 -45.07 82.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 178.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -61.38 -35.71 78.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.141 -1.845 . . . . 0.0 114.039 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -75.63 -42.12 52.44 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 111.712 -2.494 . . . . 0.0 111.046 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.3 t -61.77 -48.37 88.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 125.347 1.459 . . . . 0.0 107.399 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -55.02 -41.33 71.18 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 128.105 2.562 . . . . 0.0 113.78 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.42 -51.04 61.08 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 111.698 -2.501 . . . . 0.0 111.447 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.29 -43.41 88.02 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 113.689 -1.596 . . . . 0.0 113.936 178.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -47.55 82.74 Favored 'General case' 0 CA--C 1.598 2.805 0 C-N-CA 128.805 2.842 . . . . 0.0 111.297 -176.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.01 82.9 Favored 'General case' 0 C--N 1.318 -0.767 0 O-C-N 126.439 2.337 . . . . 0.0 111.771 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -65.99 -41.41 91.15 Favored 'General case' 0 CA--C 1.586 2.346 0 C-N-CA 126.447 1.899 . . . . 0.0 111.94 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.4 mt -88.54 13.21 12.54 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.689 1.996 . . . . 0.0 114.649 -178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.267 2.2 p-10 56.76 32.33 21.05 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-N 114.202 -1.363 . . . . 0.0 114.535 176.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -94.79 174.28 7.18 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -175.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.932 0 CA-C-O 118.367 -0.825 . . . . 0.0 109.138 -178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.466 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.738 0 N-CA-C 106.517 -1.661 . . . . 0.0 106.517 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.258 1.6 p -68.94 90.71 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.9 mt -34.99 -14.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 -175.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -56.24 -29.94 61.72 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.183 0.901 . . . . 0.0 112.826 164.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -54.86 -50.56 68.36 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 168.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.41 -44.21 95.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 123.09 0.556 . . . . 0.0 111.889 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.1 -48.7 80.63 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.17 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -42.41 88.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.519 1.928 . . . . 0.0 114.902 176.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -66.52 -32.68 74.19 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.913 1.285 . . . . 0.0 111.434 177.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.63 -8.24 47.77 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.686 1.194 . . . . 0.0 111.674 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.59 20.53 79.83 Favored Glycine 0 N--CA 1.496 2.7 0 C-N-CA 126.92 2.2 . . . . 0.0 113.04 171.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.23 127.19 65.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.239 0.616 . . . . 0.0 112.253 -164.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -27.95 128.72 0.06 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 127.717 2.407 . . . . 0.0 110.53 176.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -42.81 -36.0 1.34 Allowed 'General case' 0 N--CA 1.521 3.111 0 C-N-CA 124.998 1.319 . . . . 0.0 114.111 177.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -51.18 -43.67 61.37 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.247 177.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.9 p -59.19 -54.31 48.34 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 176.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.5 t -61.33 -49.64 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 125.248 1.419 . . . . 0.0 109.951 -172.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.0 p -53.54 -47.06 70.33 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.381 1.473 . . . . 0.0 113.674 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -60.37 -45.66 92.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 110.754 -2.93 . . . . 0.0 116.985 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.4 t -62.55 -39.88 86.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.242 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 78.2 t -51.55 -55.09 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 113.312 -1.767 . . . . 0.0 112.486 -175.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.291 34.3 m120 -92.29 22.87 4.19 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 175.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 20.4 tt0 67.09 1.2 2.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 128.349 2.66 . . . . 0.0 117.433 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.21 35.81 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 111.675 -2.511 . . . . 0.0 116.827 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 59.24 -43.95 0.07 Allowed 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 117.97 2.582 . . . . 0.0 117.97 -167.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.274 69.3 m80 -152.49 103.59 2.83 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -174.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -123.29 151.7 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 171.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 p -67.48 145.93 54.48 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 -175.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.1 -73.87 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.292 0.0 OUTLIER -51.21 -28.9 12.56 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 119.832 3.271 . . . . 0.0 119.832 179.564 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.7 m -65.05 -56.97 9.96 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 175.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtm105 -55.35 -51.35 67.07 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.65 -34.64 62.48 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -175.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.19 -51.06 11.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.806 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.5 t -58.8 -46.39 90.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 125.86 1.664 . . . . 0.0 108.177 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.0 -44.11 91.61 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.147 2.179 . . . . 0.0 116.208 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.9 -50.01 70.41 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.626 -2.079 . . . . 0.0 110.511 174.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.15 -37.88 75.53 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 112.283 -2.235 . . . . 0.0 114.866 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 35.0 mtt -59.56 -51.29 70.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.21 -40.38 95.91 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 112.43 -2.168 . . . . 0.0 111.818 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.13 -41.07 95.15 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.783 -2.008 . . . . 0.0 113.495 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.1 mt -98.94 25.14 6.93 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 127.031 2.132 . . . . 0.0 112.24 -175.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.41 21.12 10.75 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 117.698 2.481 . . . . 0.0 117.698 173.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -87.93 159.64 18.26 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.518 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.944 0 CA-C-N 112.347 -2.206 . . . . 0.0 108.504 -171.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 122.282 1.039 . . . . 0.0 112.765 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -77.31 145.26 37.5 Favored 'General case' 0 CA--C 1.556 1.204 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 -169.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.2 mt -61.92 0.92 0.32 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 121.429 3.863 . . . . 0.0 121.429 -155.236 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -58.37 -38.18 76.76 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 119.539 1.063 . . . . 0.0 110.997 174.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -61.69 -46.96 87.48 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 114.935 -1.03 . . . . 0.0 113.14 173.566 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.23 -45.36 96.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.463 1.105 . . . . 0.0 112.827 174.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.12 -54.0 48.74 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.026 2.13 . . . . 0.0 112.35 176.247 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.28 -37.96 86.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.126 1.371 . . . . 0.0 114.266 177.855 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -67.98 -34.41 76.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 123.505 0.503 . . . . 0.0 110.317 179.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.57 -19.55 27.67 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.277 178.583 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.56 29.17 53.49 Favored Glycine 0 N--CA 1.486 2.016 0 C-N-CA 127.007 2.241 . . . . 0.0 113.704 174.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.296 8.5 p -130.21 130.58 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.623 0 C-N-CA 123.563 0.745 . . . . 0.0 109.12 -175.706 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.6 p -44.29 142.17 1.61 Allowed 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 128.658 2.783 . . . . 0.0 110.381 -173.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -48.84 -47.94 42.15 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 117.489 2.403 . . . . 0.0 117.489 -170.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.558 0.0 OUTLIER -56.57 -25.34 52.1 Favored 'General case' 0 C--N 1.322 -0.607 1 N-CA-C 124.359 4.948 . . . . 0.0 124.359 179.835 . . . . . . . . 4 3 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.1 m -58.13 -53.13 61.74 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 111.608 -2.542 . . . . 0.0 111.512 165.501 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.0 t -63.77 -49.57 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.46 -169.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.446 1.0 OUTLIER -58.32 -37.95 76.14 Favored 'General case' 0 CA--C 1.466 -2.278 0 N-CA-C 119.106 3.002 . . . . 0.0 119.106 176.247 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mtt85 -63.54 -44.38 94.35 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 110.412 -3.086 . . . . 0.0 114.78 169.012 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 99.4 t -61.19 -42.87 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.091 -1.413 . . . . 0.0 110.342 -176.6 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.88 -50.01 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 112.899 -1.955 . . . . 0.0 112.395 -168.292 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -91.72 17.48 8.89 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 171.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 67.49 11.74 8.53 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.99 2.916 . . . . 0.0 114.85 172.326 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.9 40.03 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 127.723 2.409 . . . . 0.0 116.441 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.6 p 57.91 -34.67 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -160.227 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -157.6 99.32 1.72 Allowed 'General case' 0 CA--C 1.564 1.487 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -168.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 4.6 p -137.96 152.88 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 175.551 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.5 p -61.29 145.32 51.8 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -173.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.36 -63.83 1.0 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.574 1.949 . . . . 0.0 113.359 -177.323 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.254 11.6 tptp -56.96 -42.01 79.35 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.6 m -57.82 -50.49 73.09 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 113.344 -1.753 . . . . 0.0 108.054 178.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.8 mtm105 -57.05 -48.88 77.47 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 174.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.47 -34.47 74.07 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 113.708 -1.587 . . . . 0.0 114.896 -176.199 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -78.47 -43.19 27.72 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.212 2.205 . . . . 0.0 111.001 -179.434 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.3 t -63.24 -46.79 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.095 174.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -52.76 -45.51 67.12 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 126.452 1.901 . . . . 0.0 111.966 179.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.56 -52.5 60.8 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 110.582 -3.008 . . . . 0.0 111.037 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.33 -52.16 65.82 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 112.85 -1.977 . . . . 0.0 115.674 178.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.264 0.0 OUTLIER -59.98 -33.32 71.8 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -178.111 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.91 -50.62 63.82 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.542 179.471 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -62.76 -33.77 75.85 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.521 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 62.0 mt -99.14 14.64 28.66 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.425 2.29 . . . . 0.0 116.951 -177.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.353 0.2 OUTLIER 54.48 19.33 2.31 Favored 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 127.127 2.171 . . . . 0.0 116.776 176.309 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -82.99 95.4 8.0 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 172.509 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.331 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 117.505 -1.236 . . . . 0.0 108.795 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.5 p -75.85 120.63 21.47 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-N 120.878 1.672 . . . . 0.0 109.246 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.8 mt -31.35 -28.82 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.88 0 N-CA-C 121.27 3.804 . . . . 0.0 121.27 -178.215 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -54.2 -37.06 64.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.414 0.686 . . . . 0.0 109.152 173.353 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.58 -41.32 94.41 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 118.555 -0.736 . . . . 0.0 111.791 177.005 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.0 t -62.45 -50.82 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 170.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -48.75 -48.89 40.46 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.986 1.315 . . . . 0.0 112.19 175.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.54 -44.42 70.98 Favored 'General case' 0 C--N 1.316 -0.861 1 C-N-CA 132.539 4.335 . . . . 0.0 113.49 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.97 -34.59 78.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.022 0.929 . . . . 0.0 110.538 174.031 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.02 -12.5 38.39 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.522 -177.282 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.58 28.87 66.63 Favored Glycine 0 N--CA 1.495 2.599 0 C-N-CA 125.981 1.753 . . . . 0.0 113.82 177.115 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.3 p -124.85 142.22 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 122.49 1.138 . . . . 0.0 110.167 -170.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -55.82 128.69 36.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 129.328 3.051 . . . . 0.0 107.442 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -53.2 -31.67 44.19 Favored 'General case' 0 N--CA 1.509 2.487 0 N-CA-C 118.125 2.639 . . . . 0.0 118.125 -167.035 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -49.2 -44.56 43.25 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.354 -1.307 . . . . 0.0 113.827 175.626 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.7 p -52.59 -48.82 66.01 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 124.018 0.824 . . . . 0.0 112.548 178.376 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 85.4 t -68.46 -52.1 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 113.802 -1.545 . . . . 0.0 110.187 -174.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.8 m -59.05 -32.01 69.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.9 mtp85 -65.53 -46.98 77.47 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 111.26 -2.7 . . . . 0.0 113.937 170.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.7 t -58.59 -43.88 88.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.595 1.558 . . . . 0.0 108.018 -178.574 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.1 t -55.45 -47.76 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 CA-C-N 111.951 -2.386 . . . . 0.0 111.54 -173.336 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -95.67 13.88 24.89 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 176.159 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 62.23 16.9 8.8 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 116.605 2.076 . . . . 0.0 116.605 179.027 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 36.48 22.77 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 110.582 -3.008 . . . . 0.0 118.22 178.685 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 t 63.69 -51.76 0.24 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 125.121 1.369 . . . . 0.0 112.346 -160.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -138.16 109.67 7.0 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 178.323 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.6 p -124.06 144.03 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.34 0 O-C-N 120.309 -1.494 . . . . 0.0 113.243 179.53 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.4 p -71.02 137.74 49.29 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 177.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -50.79 72.36 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.187 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.302 0.0 OUTLIER -59.57 -28.62 67.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 118.164 2.654 . . . . 0.0 118.164 177.545 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.7 m -67.24 -50.28 61.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 112.585 -2.098 . . . . 0.0 107.567 174.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.6 mtp85 -59.06 -42.68 90.9 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.58 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -58.98 -35.23 72.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 113.659 -1.609 . . . . 0.0 113.956 -177.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -76.95 -44.23 32.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 110.991 -2.822 . . . . 0.0 112.529 -176.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 42.7 t -64.66 -46.34 92.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 112.305 -2.225 . . . . 0.0 108.967 177.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -56.54 -42.18 78.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.824 2.85 . . . . 0.0 111.272 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.0 69.29 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.513 -1.676 . . . . 0.0 111.47 174.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.47 91.88 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 113.432 -1.713 . . . . 0.0 115.203 176.958 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.82 -44.53 93.99 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -178.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.3 -46.4 88.92 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.495 1.122 . . . . 0.0 112.446 178.661 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -61.99 -39.55 92.6 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.592 -2.094 . . . . 0.0 113.803 177.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.2 mt -90.21 15.83 9.65 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.601 1.56 . . . . 0.0 114.201 178.225 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 49.62 31.56 4.34 Favored 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 127.189 2.196 . . . . 0.0 112.6 176.895 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -97.52 139.91 32.74 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 122.863 1.316 . . . . 0.0 108.773 -165.657 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.327 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.971 0 CA-C-N 110.807 -2.906 . . . . 0.0 114.5 176.277 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.442 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.294 1.3 p -68.62 100.48 1.13 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 -179.261 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -43.86 -14.26 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.73 0 N-CA-C 117.602 2.445 . . . . 0.0 117.602 -176.449 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -55.93 -35.45 66.65 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.019 0.527 . . . . 0.0 110.334 165.909 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.0 -47.64 84.46 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.8 0.84 . . . . 0.0 113.08 174.395 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.8 t -59.31 -45.86 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 172.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -48.07 81.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.348 -2.205 . . . . 0.0 112.123 -177.358 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.53 -42.2 83.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.221 2.208 . . . . 0.0 115.453 177.038 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.79 -33.05 75.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 124.017 0.823 . . . . 0.0 110.712 177.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.12 -16.43 24.93 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.397 -179.768 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.36 25.35 68.48 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 126.747 2.118 . . . . 0.0 113.479 173.558 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.4 p -126.0 111.32 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.445 0.698 . . . . 0.0 110.197 -167.264 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 91.7 p -16.83 135.65 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.19 0 C-N-CA 127.889 2.476 . . . . 0.0 111.724 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.309 31.6 t80 -47.83 -53.29 16.0 Favored 'General case' 0 N--CA 1.521 3.086 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 -175.763 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.366 0.0 OUTLIER -58.44 -24.77 61.1 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 179.593 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.6 m -56.1 -50.21 71.67 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.233 165.255 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.297 79.9 t -65.5 -43.65 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-O 118.542 -0.742 . . . . 0.0 110.733 -177.126 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.89 81.58 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.034 0.834 . . . . 0.0 112.446 -177.54 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -61.37 -45.97 92.13 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.013 1.857 . . . . 0.0 116.013 169.168 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.86 -41.25 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 125.019 1.328 . . . . 0.0 108.458 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.3 t -53.27 -49.87 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 113.687 -1.597 . . . . 0.0 112.665 -171.115 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -92.09 14.34 16.26 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 171.61 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 60.02 21.08 10.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.971 2.508 . . . . 0.0 113.823 178.072 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.17 45.16 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 111.674 -2.512 . . . . 0.0 116.574 -175.192 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.2 t 64.09 -57.36 0.22 Allowed 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 125.959 1.704 . . . . 0.0 111.929 -163.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -146.08 104.86 3.86 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 125.858 1.663 . . . . 0.0 107.646 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 p -113.51 157.61 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 120.891 1.678 . . . . 0.0 114.453 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -60.81 121.01 11.24 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.647 0.737 . . . . 0.0 112.913 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -41.24 -62.62 0.81 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -43.3 -43.13 4.78 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 179.529 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -59.85 -52.42 65.53 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 179.05 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.2 mtm105 -54.43 -47.67 72.56 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.575 1.695 . . . . 0.0 115.575 177.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.46 -36.5 69.12 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -176.635 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -76.72 -42.12 42.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 111.354 -2.657 . . . . 0.0 111.364 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.98 -49.53 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 C-N-CA 125.892 1.677 . . . . 0.0 108.029 176.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -52.54 -40.4 62.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 128.54 2.736 . . . . 0.0 112.875 179.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.51 -52.98 55.04 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.3 -2.227 . . . . 0.0 111.663 173.544 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.98 86.04 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 113.404 -1.725 . . . . 0.0 114.254 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.97 -45.48 86.66 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.501 1.92 . . . . 0.0 115.947 -177.985 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.83 -46.39 82.15 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 112.721 -2.036 . . . . 0.0 112.563 177.135 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.84 -35.44 80.67 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 111.964 -2.38 . . . . 0.0 113.926 -174.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 46.4 mt -91.56 18.39 7.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.528 1.931 . . . . 0.0 113.96 179.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.42 0.2 OUTLIER 52.03 36.96 20.03 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.789 1.235 . . . . 0.0 113.876 178.537 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -100.41 175.64 5.63 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -172.443 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -176.578 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.36 0.5 OUTLIER . . . . . 0 N--CA 1.497 1.898 0 CA-C-O 121.377 0.608 . . . . 0.0 109.866 . . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.301 2.8 p -73.07 99.22 2.72 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.6 mt -41.0 -14.4 0.01 OUTLIER 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 118.546 2.795 . . . . 0.0 118.546 -176.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -54.62 -33.17 60.06 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 119.096 0.862 . . . . 0.0 111.071 165.338 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -59.13 -48.82 80.2 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 118.408 -0.806 . . . . 0.0 113.09 173.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -58.05 -44.26 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 173.358 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.22 70.62 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 112.029 -2.351 . . . . 0.0 111.531 -177.261 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.1 -39.57 86.77 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.515 1.926 . . . . 0.0 114.282 176.894 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -66.34 -36.35 82.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-O 122.236 1.017 . . . . 0.0 110.881 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.61 -15.15 40.67 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.198 -1.819 . . . . 0.0 110.856 178.694 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 26.65 60.89 Favored Glycine 0 CA--C 1.544 1.888 0 C-N-CA 126.936 2.208 . . . . 0.0 113.128 170.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -124.36 128.75 73.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.25 0.62 . . . . 0.0 110.655 -167.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.7 p -33.08 122.14 0.38 Allowed 'General case' 0 N--CA 1.514 2.725 0 C-N-CA 127.445 2.298 . . . . 0.0 109.13 175.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.317 41.8 t80 -40.92 -47.8 3.04 Favored 'General case' 0 N--CA 1.522 3.147 0 N-CA-C 117.628 2.455 . . . . 0.0 117.628 -175.873 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.403 0.0 OUTLIER -57.53 -16.99 11.52 Favored 'General case' 0 C--N 1.32 -0.681 1 N-CA-C 122.073 4.101 . . . . 0.0 122.073 179.108 . . . . . . . . 4 3 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 69.0 p -64.96 -52.61 55.34 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 114.203 -1.362 . . . . 0.0 112.866 162.014 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.27 73.7 t -60.99 -47.6 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.204 -171.39 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 p -57.12 -42.58 81.13 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 122.775 1.274 . . . . 0.0 112.411 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.1 mtt85 -67.7 -38.97 84.37 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 119.773 3.249 . . . . 0.0 119.773 173.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.7 t -55.11 -46.62 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 127.237 2.215 . . . . 0.0 107.979 173.132 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.2 t -55.7 -46.81 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 110.974 -2.83 . . . . 0.0 111.239 -168.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.282 13.8 m120 -99.07 26.81 5.52 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.87 -1.513 . . . . 0.0 114.437 176.65 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 49.29 44.54 23.52 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-O 123.809 1.766 . . . . 0.0 112.905 171.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.296 . . -72.87 36.15 0.08 Allowed 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 110.211 -3.177 . . . . 0.0 118.858 -176.501 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.7 m 4.83 93.99 0.01 OUTLIER 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 108.854 -3.794 . . . . 0.0 117.902 176.617 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.7 m80 171.89 -68.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 102.67 -3.085 . . . . 0.0 102.67 -167.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -25.16 101.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 129.1 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 86.1 p -100.6 156.29 17.39 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 112.234 -2.257 . . . . 0.0 114.811 -177.048 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -15.21 -63.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.403 1.881 . . . . 0.0 115.28 167.646 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.82 -51.85 12.19 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 176.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.3 m -59.56 -51.45 69.77 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.481 1.512 . . . . 0.0 107.012 175.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -43.3 73.02 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.762 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.86 -39.4 85.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.309 -1.769 . . . . 0.0 114.744 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -79.11 -40.84 30.06 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 113.079 -1.873 . . . . 0.0 112.072 -177.487 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.7 t -61.17 -47.56 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.74 1.616 . . . . 0.0 106.771 172.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -55.73 -44.68 77.76 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.344 2.258 . . . . 0.0 111.499 -178.585 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -51.7 65.83 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.658 -2.065 . . . . 0.0 110.925 177.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.68 -40.7 80.01 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 113.205 -1.816 . . . . 0.0 113.603 176.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 mtt -58.25 -48.97 78.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -176.0 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.4 94.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.101 -2.318 . . . . 0.0 112.875 177.599 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -64.13 -34.47 78.12 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-N 112.332 -2.213 . . . . 0.0 113.684 -177.533 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.0 mt -94.48 18.0 12.08 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.867 1.667 . . . . 0.0 113.042 -178.486 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.69 21.41 5.85 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.693 2.397 . . . . 0.0 113.043 178.341 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -89.79 157.43 17.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -170.294 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.429 24.5 mm . . . . . 0 CA--C 1.535 0.396 1 N-CA-C 121.921 4.045 . . . . 0.0 121.921 178.112 . . . . . . . . 2 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.415 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 118.962 -0.542 . . . . 0.0 109.669 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.3 p -91.54 145.66 24.43 Favored 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.3 -165.521 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mt -45.71 -27.88 0.9 Allowed 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -170.384 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -59.58 -39.61 84.7 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.816 0.735 . . . . 0.0 111.744 176.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.5 -48.31 74.81 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 171.121 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.0 t -60.0 -40.62 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 174.317 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.15 -50.54 73.29 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.643 -1.617 . . . . 0.0 113.201 177.563 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.69 -39.35 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.993 1.717 . . . . 0.0 113.72 177.212 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -67.27 -34.97 78.53 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.572 0.749 . . . . 0.0 111.212 177.479 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.42 -14.91 44.76 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.104 177.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.91 29.46 54.38 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 126.124 1.821 . . . . 0.0 112.655 170.831 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -132.4 134.37 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.981 0 CA-C-O 122.202 1.001 . . . . 0.0 109.651 -168.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.5 p -41.21 130.88 2.79 Favored 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 128.135 2.574 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -51.95 -29.54 20.88 Favored 'General case' 0 N--CA 1.51 2.528 0 N-CA-C 119.586 3.18 . . . . 0.0 119.586 -174.524 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -49.31 -41.52 38.59 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 116.479 -1.724 . . . . 0.0 113.374 172.889 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 43.5 p -63.22 -53.85 46.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 82.4 t -62.38 -48.18 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.831 0.852 . . . . 0.0 110.207 -173.079 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.0 p -57.81 -42.45 84.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 116.609 2.078 . . . . 0.0 116.609 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.2 mtp85 -62.01 -45.59 92.91 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 109.995 -3.275 . . . . 0.0 115.157 171.212 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.3 t -54.92 -48.31 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 127.405 2.282 . . . . 0.0 109.657 179.253 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.3 t -57.26 -48.68 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 CA-C-N 109.945 -3.298 . . . . 0.0 112.937 -166.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.301 21.2 m120 -108.54 33.44 4.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.756 -1.565 . . . . 0.0 114.9 176.364 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 73.51 -5.49 1.97 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.902 2.881 . . . . 0.0 118.619 167.053 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.15 30.02 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.814 2.446 . . . . 0.0 115.266 -175.785 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.6 p 55.21 -44.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 -148.448 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.272 77.9 m80 -153.8 131.96 11.85 Favored 'General case' 0 CA--C 1.556 1.189 0 CA-C-O 117.64 -1.171 . . . . 0.0 109.875 -175.986 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.9 t -150.98 143.19 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.847 1.658 . . . . 0.0 113.887 159.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 p -23.34 131.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 119.387 3.106 . . . . 0.0 119.387 166.123 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.45 -47.43 73.17 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.945 0.898 . . . . 0.0 112.791 -176.61 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.93 15.76 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 176.226 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -61.78 -49.61 75.65 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.931 1.692 . . . . 0.0 107.653 175.995 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -58.18 -46.77 85.17 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.688 1.995 . . . . 0.0 113.054 -178.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.26 -37.92 75.92 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 179.506 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -73.3 -43.26 61.26 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 112.27 -2.241 . . . . 0.0 111.87 178.695 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 85.8 t -63.6 -48.84 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 114.396 -1.275 . . . . 0.0 108.699 177.393 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -49.17 -46.81 45.95 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 128.981 2.912 . . . . 0.0 108.995 178.464 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.45 -54.23 31.41 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 112.706 -2.043 . . . . 0.0 111.359 -178.475 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.13 -42.41 69.48 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.275 -1.784 . . . . 0.0 114.23 174.332 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.0 mmt -59.62 -50.37 74.14 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 125.88 1.672 . . . . 0.0 111.587 -179.087 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.98 -42.77 94.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.292 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.52 -32.93 74.59 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.501 179.566 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.6 mt -92.76 11.53 26.59 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 125.683 1.593 . . . . 0.0 113.727 177.576 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.408 0.2 OUTLIER 46.47 29.76 0.96 Allowed 'General case' 0 CA--C 1.564 1.487 0 C-N-CA 127.298 2.239 . . . . 0.0 113.715 -175.791 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -93.8 103.48 15.61 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.03 -1.044 . . . . 0.0 108.59 -168.037 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.764 0 CA-C-N 113.534 -1.666 . . . . 0.0 113.799 169.395 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.465 1.1 t . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 103.474 -2.787 . . . . 0.0 103.474 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 19.1 p -101.05 141.46 33.91 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.616 -0.677 . . . . 0.0 110.371 -176.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.6 mt -47.02 -23.84 0.53 Allowed 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 119.563 3.171 . . . . 0.0 119.563 -164.863 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -62.28 -35.59 79.47 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.14 0.882 . . . . 0.0 111.727 175.2 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -59.55 -46.92 87.49 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 118.383 -0.818 . . . . 0.0 112.885 171.283 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.9 t -58.61 -45.46 90.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 172.765 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.01 71.34 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.288 1.435 . . . . 0.0 112.598 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.58 -38.81 84.58 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.184 1.794 . . . . 0.0 115.766 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -64.82 -35.64 81.76 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.97 0.908 . . . . 0.0 110.346 176.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.38 -14.9 44.91 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.149 -1.387 . . . . 0.0 110.241 179.311 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.31 24.96 69.55 Favored Glycine 0 N--CA 1.48 1.582 0 C-N-CA 127.23 2.347 . . . . 0.0 113.275 172.443 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -121.02 124.72 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 124.188 0.995 . . . . 0.0 109.749 -167.812 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.4 p -31.12 123.27 0.22 Allowed 'General case' 0 N--CA 1.513 2.715 0 C-N-CA 127.207 2.203 . . . . 0.0 108.534 175.214 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -39.47 -33.18 0.15 Allowed 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 115.863 1.801 . . . . 0.0 115.863 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -48.11 -42.4 29.02 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 117.745 -1.121 . . . . 0.0 112.733 176.986 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.3 p -60.83 -55.77 29.08 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 175.764 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.326 94.7 t -60.45 -44.61 96.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 C-N-CA 124.666 1.186 . . . . 0.0 110.092 -165.05 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.5 p -59.61 -49.35 78.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.198 0.999 . . . . 0.0 113.056 178.885 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -56.75 -44.53 81.83 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 111.998 -2.364 . . . . 0.0 113.857 173.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.57 -47.83 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.522 1.529 . . . . 0.0 109.069 -178.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.02 -41.38 86.05 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 112.982 -1.917 . . . . 0.0 112.042 -167.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.26 14.0 m120 -100.05 23.48 9.85 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 113.697 -1.592 . . . . 0.0 114.867 173.518 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.34 5.91 4.54 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 170.647 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.96 43.36 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 111.566 -2.561 . . . . 0.0 115.147 -167.904 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.0 p 57.34 -59.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 113.155 -1.839 . . . . 0.0 114.485 -160.261 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -140.16 108.41 5.8 Favored 'General case' 0 CA--C 1.559 1.297 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.145 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.3 p -121.51 157.66 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 171.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 p -68.96 131.44 45.09 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 116.462 2.023 . . . . 0.0 116.462 -175.13 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -24.65 -67.06 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 128.004 2.522 . . . . 0.0 117.026 176.053 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -53.36 -40.54 65.02 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -172.346 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -50.45 70.09 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 113.056 -1.884 . . . . 0.0 107.31 -178.108 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -40.13 96.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -179.645 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.76 -36.56 83.45 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.744 -176.743 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.74 -41.45 53.29 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 112.883 -1.962 . . . . 0.0 110.965 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.7 t -64.83 -47.4 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.294 1.438 . . . . 0.0 109.099 176.075 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -52.48 -43.97 65.33 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 130.066 3.347 . . . . 0.0 109.693 179.095 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.76 -51.35 67.48 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.005 -1.907 . . . . 0.0 111.28 177.738 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.85 93.22 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 113.837 -1.529 . . . . 0.0 113.55 176.261 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 mtt -56.59 -45.78 81.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 127.573 2.349 . . . . 0.0 113.537 -178.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.52 -47.96 76.93 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 113.077 -1.874 . . . . 0.0 112.628 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -63.04 -39.34 94.46 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 112.348 -2.205 . . . . 0.0 113.142 -177.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.9 mt -84.76 7.81 19.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.32 2.248 . . . . 0.0 113.902 -177.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.403 0.5 OUTLIER 49.22 45.21 23.43 Favored 'General case' 0 CA--C 1.573 1.849 0 C-N-CA 125.304 1.442 . . . . 0.0 112.852 179.679 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -95.39 -167.29 1.59 Allowed 'General case' 0 CA--C 1.558 1.254 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.26 -167.519 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 117.708 -1.139 . . . . 0.0 109.571 179.977 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.445 1.1 t . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 102.906 -2.998 . . . . 0.0 102.906 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.9 p -93.94 134.94 35.8 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.197 -174.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.4 mt -51.36 -22.37 2.87 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 120.188 3.403 . . . . 0.0 120.188 -163.591 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -58.37 -32.36 68.49 Favored 'General case' 0 CA--C 1.551 1.0 0 O-C-N 123.406 0.441 . . . . 0.0 109.951 175.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -61.59 -52.33 64.83 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 118.01 -0.995 . . . . 0.0 113.26 171.406 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.6 t -56.59 -44.71 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 174.205 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.11 -51.9 67.79 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.353 2.661 . . . . 0.0 112.998 -178.118 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.77 -39.85 84.09 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.86 1.664 . . . . 0.0 113.909 177.456 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -67.17 -34.01 76.63 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.414 1.086 . . . . 0.0 111.155 177.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.86 -11.25 42.51 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.73 1.212 . . . . 0.0 111.291 178.357 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.49 17.57 77.91 Favored Glycine 0 N--CA 1.48 1.602 0 C-N-CA 126.511 2.005 . . . . 0.0 114.15 169.187 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -117.98 136.64 54.5 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 124.828 1.251 . . . . 0.0 110.07 -170.427 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -36.29 123.59 0.77 Allowed 'General case' 0 N--CA 1.52 3.029 0 C-N-CA 127.414 2.286 . . . . 0.0 108.872 -179.485 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -34.21 -46.75 0.26 Allowed 'General case' 0 N--CA 1.53 3.543 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 175.044 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.572 0.0 OUTLIER -59.6 -29.97 68.36 Favored 'General case' 0 C--N 1.322 -0.613 1 N-CA-C 124.455 4.983 . . . . 0.0 124.455 176.642 . . . . . . . . 4 3 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 70.1 p -59.18 -46.14 89.19 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.416 -1.266 . . . . 0.0 112.763 165.047 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.5 t -66.06 -47.5 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.686 0.794 . . . . 0.0 110.275 -175.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.292 2.7 m -61.55 -34.67 75.96 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -177.836 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.3 mtt85 -60.81 -49.02 79.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 111.385 -2.643 . . . . 0.0 114.603 166.423 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.8 t -61.52 -45.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.113 -175.778 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 t -57.97 -45.09 87.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 O-C-N 124.938 1.399 . . . . 0.0 111.477 -168.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -90.81 24.24 2.81 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 113.846 -1.525 . . . . 0.0 113.958 175.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.292 0.0 OUTLIER 62.98 1.85 0.92 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 129.953 3.301 . . . . 0.0 117.741 173.668 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.76 40.02 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 111.811 -2.45 . . . . 0.0 116.141 -170.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.25 98.4 p 61.23 -49.61 0.12 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -164.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -153.33 104.59 2.78 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -174.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 p -125.74 150.99 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 N-CA-C 116.495 2.035 . . . . 0.0 116.495 -179.595 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -59.65 137.48 58.02 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 116.977 2.214 . . . . 0.0 116.977 -176.009 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.24 -61.52 1.95 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.521 1.929 . . . . 0.0 114.868 177.102 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.72 -35.83 56.52 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.7 m -69.27 -58.14 4.42 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.549 1.54 . . . . 0.0 107.346 174.661 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.9 mtm105 -53.5 -48.09 69.28 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -179.157 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -56.3 -36.84 69.1 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.735 2.014 . . . . 0.0 113.695 -174.108 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -77.62 -44.64 27.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 109.698 -3.41 . . . . 0.0 110.518 -176.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 42.0 t -65.34 -48.46 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.125 1.77 . . . . 0.0 108.234 179.082 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.15 -40.04 84.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 128.64 2.776 . . . . 0.0 115.645 179.123 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.9 58.12 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 111.98 -2.373 . . . . 0.0 110.029 172.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.54 -37.57 73.29 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 112.988 -1.914 . . . . 0.0 113.29 176.986 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 34.3 mtt -58.09 -55.98 27.96 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 -174.699 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -42.32 99.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.613 179.024 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.86 -37.07 85.41 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.307 -2.224 . . . . 0.0 112.501 -176.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -94.0 16.84 13.49 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.966 1.306 . . . . 0.0 114.269 -178.165 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.343 1.5 p-10 54.73 48.9 19.17 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-O 123.948 1.832 . . . . 0.0 113.745 178.871 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -105.86 157.87 17.16 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.368 -1.287 . . . . 0.0 112.462 -173.166 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.496 0 CA-C-N 114.008 -1.451 . . . . 0.0 111.601 -173.827 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.4 OUTLIER . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 103.354 -2.832 . . . . 0.0 103.354 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 p -85.41 150.56 24.64 Favored 'General case' 0 CA--C 1.552 1.033 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 175.891 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.0 mt -46.41 -25.11 0.6 Allowed 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 119.996 3.332 . . . . 0.0 119.996 -166.811 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -60.54 -40.17 90.6 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 119.665 1.12 . . . . 0.0 112.155 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.57 -31.04 71.86 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.72 179.328 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.69 -50.31 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 168.238 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.68 -53.78 35.3 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.544 1.938 . . . . 0.0 112.249 176.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.39 -39.03 88.8 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.559 1.543 . . . . 0.0 112.298 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -65.1 -34.4 78.32 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 121.755 0.788 . . . . 0.0 109.906 177.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.53 -11.91 44.35 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.094 178.616 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 31.29 66.83 Favored Glycine 0 N--CA 1.483 1.818 0 C-N-CA 126.891 2.186 . . . . 0.0 112.24 171.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.12 128.49 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-O 121.78 0.8 . . . . 0.0 111.354 -168.579 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.4 p -34.57 122.22 0.52 Allowed 'General case' 0 N--CA 1.516 2.826 0 C-N-CA 128.095 2.558 . . . . 0.0 107.462 174.294 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -42.18 -43.3 3.3 Favored 'General case' 0 N--CA 1.538 3.931 0 N-CA-C 117.849 2.537 . . . . 0.0 117.849 -166.509 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.413 0.0 OUTLIER -57.43 -24.83 57.91 Favored 'General case' 0 C--N 1.318 -0.795 1 N-CA-C 123.437 4.606 . . . . 0.0 123.437 -178.214 . . . . . . . . 4 3 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.7 p -55.77 -54.71 41.09 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.801 0.688 . . . . 0.0 111.707 164.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 82.1 t -59.74 -49.79 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.31 1.844 . . . . 0.0 108.623 -172.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 m -59.81 -37.53 79.4 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.239 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.0 mtt85 -67.29 -41.16 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 118.953 2.946 . . . . 0.0 118.953 170.27 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 74.4 t -59.35 -41.44 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 126.379 1.872 . . . . 0.0 107.368 179.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -59.28 -45.0 93.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 113.182 -1.826 . . . . 0.0 112.579 -169.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -83.84 4.4 29.44 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 170.3 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 66.31 14.18 9.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.016 2.127 . . . . 0.0 115.832 -177.047 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 24.02 40.46 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.834 2.454 . . . . 0.0 117.557 -171.41 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.258 96.0 p 58.46 -53.7 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -162.576 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -140.34 79.56 1.71 Allowed 'General case' 0 CA--C 1.571 1.776 0 C-N-CA 124.101 0.961 . . . . 0.0 109.909 -175.124 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -102.24 140.2 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 119.836 -1.79 . . . . 0.0 114.699 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.1 t -58.2 150.55 21.29 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -176.604 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.69 0.24 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.747 2.019 . . . . 0.0 113.491 -175.834 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -56.32 -30.93 63.21 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 120.401 3.482 . . . . 0.0 120.401 -178.807 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 36.6 m -62.73 -52.0 64.94 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 174.579 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -57.01 -44.3 82.68 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 176.608 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -36.63 72.56 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.769 1.627 . . . . 0.0 115.157 -176.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.6 ttpt -76.07 -42.31 47.82 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 110.934 -2.848 . . . . 0.0 110.987 -178.453 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 74.9 t -65.67 -51.25 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.861 179.595 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -53.57 -46.73 70.4 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 129.825 3.25 . . . . 0.0 110.999 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.85 -49.65 71.92 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.439 -2.164 . . . . 0.0 111.879 176.532 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.18 -49.64 77.07 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.578 -1.647 . . . . 0.0 113.178 176.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.6 mtt -54.2 -45.54 72.22 Favored 'General case' 0 N--CA 1.497 1.903 0 C-N-CA 127.0 2.12 . . . . 0.0 111.061 -179.437 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.61 -47.77 82.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 125.843 1.964 . . . . 0.0 111.507 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -64.41 -40.55 95.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 113.044 -1.889 . . . . 0.0 113.584 177.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.6 mt -84.89 9.24 14.88 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 127.632 2.373 . . . . 0.0 115.103 179.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.274 0.6 OUTLIER 49.1 34.66 6.04 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 126.29 1.836 . . . . 0.0 114.048 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -80.34 161.29 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.461 -0.774 . . . . 0.0 111.077 -171.338 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.31 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.123 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.863 177.985 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.405 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.5 p -71.96 144.44 48.89 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 -169.559 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.7 mt -55.5 -23.7 27.55 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -162.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -51.82 -39.87 59.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.766 1.626 . . . . 0.0 109.322 177.156 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -62.63 -45.23 93.79 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.706 174.644 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.4 t -57.88 -47.86 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 169.222 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.49 -51.02 66.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.316 1.846 . . . . 0.0 113.547 177.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.43 90.98 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.24 1.816 . . . . 0.0 113.558 179.215 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -64.88 -31.82 73.24 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 121.909 0.862 . . . . 0.0 110.582 176.341 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.36 -20.62 25.09 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.295 178.998 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 28.2 55.32 Favored Glycine 0 CA--C 1.545 1.909 0 C-N-CA 126.339 1.923 . . . . 0.0 112.82 173.719 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -127.93 128.25 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -173.128 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 p -52.48 139.88 24.02 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 124.516 1.126 . . . . 0.0 111.407 -173.198 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -46.63 -43.56 17.58 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 119.871 3.286 . . . . 0.0 119.871 -165.559 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.403 0.0 OUTLIER -55.37 -25.07 33.13 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 121.748 3.981 . . . . 0.0 121.748 -179.362 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 55.8 p -60.74 -55.17 36.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 114.009 -1.451 . . . . 0.0 112.951 166.461 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 97.1 t -60.08 -48.59 87.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.153 1.781 . . . . 0.0 109.469 -176.285 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.341 3.6 m -56.21 -36.8 68.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 115.551 1.685 . . . . 0.0 115.551 177.38 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.3 mtt85 -67.81 -45.95 73.27 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 111.727 -2.488 . . . . 0.0 115.98 171.745 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 66.0 t -60.4 -43.33 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 125.372 1.469 . . . . 0.0 109.673 -179.538 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.0 t -54.58 -50.74 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.382 0 CA-C-N 112.441 -2.163 . . . . 0.0 110.521 -173.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.21 18.12 14.34 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.655 -1.611 . . . . 0.0 113.952 177.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.3 17.4 mt-30 68.19 11.09 8.22 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 119.768 3.247 . . . . 0.0 119.768 173.657 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.41 -36.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 121.12 3.748 . . . . 0.0 121.12 176.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.0 p 125.38 -73.32 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.871 1 C-N-CA 133.571 4.748 . . . . 0.0 107.647 -166.425 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -141.08 128.2 20.8 Favored 'General case' 0 CA--C 1.556 1.183 0 CA-C-O 116.546 -1.693 . . . . 0.0 112.238 173.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 0.3 OUTLIER -139.52 158.86 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 118.137 2.643 . . . . 0.0 118.137 167.72 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -45.27 135.38 5.9 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -176.105 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.71 -63.35 1.2 Allowed 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -172.568 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.265 13.4 tptp -49.08 -34.73 14.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.734 2.124 . . . . 0.0 116.734 179.018 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.8 m -54.17 -56.26 19.91 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 174.215 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 19.2 mtt180 -58.64 -45.85 88.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.353 1.461 . . . . 0.0 113.72 -175.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -34.47 75.44 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 179.995 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.36 -45.77 37.26 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.889 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.8 t -58.48 -48.26 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.288 177.474 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -60.12 -44.79 94.61 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.561 2.344 . . . . 0.0 114.569 -178.641 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.88 65.43 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.617 176.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.25 -40.98 75.02 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 112.686 -2.052 . . . . 0.0 113.024 176.596 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.6 mtt -60.58 -51.47 69.26 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 125.818 1.647 . . . . 0.0 115.196 -176.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.85 98.54 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 113.189 -1.823 . . . . 0.0 111.835 179.585 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -65.03 -40.97 95.61 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 112.523 -2.126 . . . . 0.0 113.954 -176.83 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.5 mt -86.25 22.55 1.76 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.827 1.651 . . . . 0.0 115.251 -178.271 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.3 29.55 3.85 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 126.019 1.728 . . . . 0.0 113.376 177.528 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 61.4 t80 -87.27 -176.22 5.57 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.859 -1.518 . . . . 0.0 110.228 -170.978 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.422 ' N ' ' CG ' ' A' ' 47' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.804 0 CA-C-O 117.941 -1.028 . . . . 0.0 109.388 -173.207 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.469 0.7 OUTLIER . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 . . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.339 2.0 p -67.94 105.11 1.9 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.7 mt -43.56 -21.96 0.04 OUTLIER 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -177.453 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -57.28 -31.43 65.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 120.851 0.358 . . . . 0.0 111.931 169.908 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -58.82 -51.09 71.49 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.873 0.869 . . . . 0.0 110.895 170.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.8 t -59.14 -43.35 89.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 176.218 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.22 -55.45 31.16 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.944 1.697 . . . . 0.0 112.707 175.619 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -42.21 92.66 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.952 2.101 . . . . 0.0 114.229 -179.536 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -66.23 -34.27 77.63 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.119 0.887 . . . . 0.0 110.515 179.248 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.21 34.84 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 113.822 -1.536 . . . . 0.0 110.571 179.374 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.63 29.0 60.24 Favored Glycine 0 CA--C 1.546 1.99 0 C-N-CA 127.192 2.329 . . . . 0.0 112.71 172.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.32 138.71 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 123.636 0.774 . . . . 0.0 110.483 -167.843 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -46.2 130.26 10.32 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 127.101 2.161 . . . . 0.0 107.139 178.768 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -50.01 -31.63 13.29 Favored 'General case' 0 N--CA 1.503 2.208 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -50.81 -44.8 59.13 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 124.642 1.214 . . . . 0.0 112.377 177.231 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.756 0.6 OUTLIER -67.79 -40.45 83.92 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.868 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 71.6 t -60.98 -50.47 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.221 0.608 . . . . 0.0 110.861 -176.09 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 56.2 p -58.73 -43.44 90.18 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.422 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -59.48 -46.13 89.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 110.621 -2.99 . . . . 0.0 115.861 168.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 63.0 t -59.0 -43.47 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.658 1.183 . . . . 0.0 108.869 -178.175 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.9 t -50.54 -48.07 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 112.901 -1.954 . . . . 0.0 112.977 -171.228 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.272 10.7 m120 -99.9 25.82 6.94 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 172.149 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 65.91 5.12 3.28 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 127.51 2.324 . . . . 0.0 116.964 173.837 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 37.94 37.05 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.489 2.716 . . . . 0.0 115.719 -176.049 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.5 p 60.29 -49.54 0.09 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 126.486 1.915 . . . . 0.0 115.774 -163.252 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.266 74.3 m80 -147.83 101.01 3.27 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -175.635 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.43 158.07 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 O-C-N 119.877 -1.764 . . . . 0.0 114.222 170.005 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -57.7 133.31 55.24 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.22 -54.88 42.04 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -177.155 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.98 -38.74 8.06 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 118.553 2.797 . . . . 0.0 118.553 175.798 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 49.5 m -62.57 -49.02 76.93 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.45 -1.704 . . . . 0.0 107.282 177.987 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.57 -46.2 84.26 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 178.076 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.94 -37.09 71.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -178.44 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -77.24 -47.28 20.6 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 112.435 -2.166 . . . . 0.0 111.373 -179.365 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.79 -47.47 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 124.682 1.193 . . . . 0.0 108.009 178.308 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -54.58 -42.06 70.59 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 128.796 2.838 . . . . 0.0 111.73 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.53 66.68 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 112.005 -2.361 . . . . 0.0 110.815 176.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.61 -39.03 79.3 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 112.93 -1.941 . . . . 0.0 112.18 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 31.2 mtt -61.04 -49.07 78.89 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.638 -1.164 . . . . 0.0 114.031 -173.044 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.78 98.09 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 112.336 -2.211 . . . . 0.0 111.687 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.97 -37.78 88.46 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 112.292 -2.231 . . . . 0.0 112.785 -178.706 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.8 mt -102.03 22.84 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.605 1.962 . . . . 0.0 113.822 -174.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 55.16 28.46 11.07 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 174.393 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -99.44 167.49 10.59 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 113.594 -1.639 . . . . 0.0 110.159 -173.053 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.555 1.146 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.421 -168.394 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.386 0.4 OUTLIER . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 . . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.9 p -90.31 120.77 31.73 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.776 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.8 mt -35.64 -22.19 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.978 0 C-N-CA 129.444 3.098 . . . . 0.0 118.666 -174.529 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -56.27 -36.17 68.27 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.026 0.53 . . . . 0.0 110.793 170.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.75 -49.88 75.7 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 117.946 -1.026 . . . . 0.0 113.194 173.619 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.6 t -56.96 -41.9 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.079 0.952 . . . . 0.0 113.335 172.168 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.02 -53.67 54.28 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 112.836 -1.984 . . . . 0.0 112.349 -179.244 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.62 -38.64 84.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.718 2.007 . . . . 0.0 114.031 178.164 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -66.14 -35.56 80.8 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.192 0.997 . . . . 0.0 110.763 176.58 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.47 -10.62 51.35 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.262 178.292 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.73 25.94 74.98 Favored Glycine 0 N--CA 1.479 1.514 0 C-N-CA 126.795 2.14 . . . . 0.0 112.204 174.109 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.6 p -119.56 132.02 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 123.785 0.834 . . . . 0.0 109.909 -168.683 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.7 p -38.7 124.64 1.37 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 128.933 2.893 . . . . 0.0 107.204 177.626 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.255 36.5 t80 -46.08 -37.45 6.83 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 116.661 2.097 . . . . 0.0 116.661 -171.517 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -52.3 -40.0 61.25 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -178.142 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 73.2 p -53.44 -50.15 65.85 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.436 1.094 . . . . 0.0 112.802 175.537 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.5 t -64.17 -55.44 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.657 -170.588 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.323 13.6 m -62.73 -33.3 74.85 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -43.44 98.81 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 117.225 2.306 . . . . 0.0 117.225 167.697 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.9 t -58.01 -49.01 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 127.157 2.183 . . . . 0.0 108.836 177.656 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.65 -44.61 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 CA-C-N 110.849 -2.887 . . . . 0.0 111.528 -169.678 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -96.62 11.4 35.42 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 113.444 -1.707 . . . . 0.0 114.178 176.857 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.279 24.5 tt0 60.11 20.74 9.97 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.272 2.629 . . . . 0.0 115.859 177.244 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.8 37.91 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 110.456 -3.065 . . . . 0.0 117.815 -176.639 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.4 t 65.78 -54.3 0.37 Allowed 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.667 1.587 . . . . 0.0 112.233 -163.751 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.256 69.6 m80 -144.82 89.95 2.02 Favored 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.442 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.9 p -100.67 146.82 8.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 119.985 -1.697 . . . . 0.0 114.028 174.296 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.05 138.51 58.19 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 174.929 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.98 -55.69 29.91 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -172.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.01 -36.01 16.7 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 117.694 2.479 . . . . 0.0 117.694 178.525 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.5 m -60.76 -48.69 80.66 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.417 176.811 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.49 -39.82 92.35 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 177.797 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -34.41 69.62 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -178.254 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -77.78 -47.68 18.4 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 111.783 -2.462 . . . . 0.0 110.824 -179.941 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.7 t -63.26 -35.87 73.81 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.03 179.958 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -61.5 -45.58 93.61 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 130.495 3.518 . . . . 0.0 113.394 -176.643 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.21 82.85 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.007 174.988 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.45 -44.72 76.65 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 112.009 -2.36 . . . . 0.0 113.156 175.959 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.9 mtt -59.36 -50.54 73.58 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.4 1.88 . . . . 0.0 114.892 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.62 89.07 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 112.892 -1.958 . . . . 0.0 112.584 179.866 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -66.54 -36.81 83.59 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 113.021 -1.9 . . . . 0.0 113.058 -179.931 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.6 mt -92.15 7.09 44.09 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 114.257 177.265 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.337 2.4 p-10 62.42 -49.68 0.17 Allowed 'General case' 0 C--N 1.346 0.428 0 C-N-CA 130.656 3.582 . . . . 0.0 117.374 -173.822 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . 0.268 7.4 t80 29.93 -91.23 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 110.565 -3.016 . . . . 0.0 116.597 -179.271 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.259 0.0 OUTLIER . . . . . 0 N--CA 1.509 2.517 0 C-N-CA 129.362 3.065 . . . . 0.0 111.779 -155.486 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.512 1.2 t . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 103.875 -2.639 . . . . 0.0 103.875 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 p -94.6 141.13 28.96 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-O 118.65 -0.69 . . . . 0.0 109.232 -173.685 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.61 -13.48 3.96 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 120.499 3.518 . . . . 0.0 120.499 -158.023 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -57.85 -33.43 68.64 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 119.881 1.219 . . . . 0.0 111.622 175.561 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -65.9 -47.61 74.23 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.457 176.978 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.3 t -59.23 -43.84 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.577 0.751 . . . . 0.0 112.207 175.17 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.38 -50.55 73.25 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.07 1.348 . . . . 0.0 113.213 179.101 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -37.68 81.24 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 127.558 2.343 . . . . 0.0 114.196 177.424 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -63.94 -36.21 83.21 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.237 1.015 . . . . 0.0 109.767 175.751 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.12 -15.81 30.86 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.541 -179.142 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.23 19.05 78.85 Favored Glycine 0 N--CA 1.485 1.926 0 C-N-CA 127.451 2.453 . . . . 0.0 113.711 173.899 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -127.43 121.27 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 C-N-CA 124.08 0.952 . . . . 0.0 109.717 -166.536 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -17.06 138.22 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.846 0 C-N-CA 129.533 3.133 . . . . 0.0 112.02 -178.861 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -55.74 -27.8 52.56 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 118.527 -2.608 . . . . 0.0 115.177 170.423 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -54.29 -51.28 65.09 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 116.994 -1.479 . . . . 0.0 111.822 171.646 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.0 -50.45 73.36 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 179.275 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.293 71.8 t -63.19 -47.39 92.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.493 -173.58 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.6 p -59.2 -42.77 91.72 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -177.93 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 55.0 mtp85 -59.13 -50.77 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 110.007 -3.27 . . . . 0.0 115.004 168.647 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 88.6 t -59.28 -44.61 92.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 124.299 1.04 . . . . 0.0 109.281 -176.442 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.2 t -54.13 -50.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.006 -165.271 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.399 3.0 m120 -105.31 42.0 1.29 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 172.34 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.424 17.7 tt0 73.01 -3.28 2.47 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 121.346 3.832 . . . . 0.0 121.346 165.702 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.31 30.72 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 112.077 -2.329 . . . . 0.0 115.372 -176.546 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.8 p 60.96 -53.41 0.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.36 1.864 . . . . 0.0 114.322 -158.648 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -150.99 141.8 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 117.631 -1.175 . . . . 0.0 108.73 -178.964 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -150.33 159.79 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 121.08 1.764 . . . . 0.0 113.713 164.346 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -51.32 139.29 19.46 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 175.569 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.86 -57.56 11.56 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.568 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -41.94 -41.19 2.4 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 177.684 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.6 m -58.5 -48.89 79.3 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 114.256 -1.338 . . . . 0.0 108.676 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 40.2 mtt-85 -60.47 -46.4 90.22 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 125.539 1.536 . . . . 0.0 113.964 -179.956 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -32.04 70.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -178.318 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ttpt -80.46 -41.62 24.08 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 111.338 -2.665 . . . . 0.0 112.516 -178.904 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.4 t -61.79 -51.32 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 126.326 1.85 . . . . 0.0 107.611 172.315 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.08 -41.06 91.63 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.54 1.936 . . . . 0.0 115.133 -175.955 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.3 -51.1 62.91 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 112.329 -2.214 . . . . 0.0 110.751 174.063 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.19 -41.53 84.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.297 -1.774 . . . . 0.0 113.559 176.554 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 mtt -62.58 -44.59 95.94 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -179.894 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.62 98.31 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.875 178.411 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -64.57 -37.86 89.03 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.006 -1.906 . . . . 0.0 112.925 179.855 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 40.8 mt -95.91 16.21 18.35 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.082 2.553 . . . . 0.0 115.135 178.612 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.328 0.1 OUTLIER 45.63 30.11 0.75 Allowed 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.588 2.811 . . . . 0.0 118.588 -178.199 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -93.7 88.26 5.76 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 112.25 -2.25 . . . . 0.0 111.422 -163.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.509 2.482 0 CA-C-N 111.378 -2.646 . . . . 0.0 113.278 153.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.3 tpt . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 159.49 162.71 0.03 OUTLIER Pre-proline 0 CA--C 1.566 1.575 0 C-N-CA 128.024 2.53 . . . . 0.0 113.21 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . 0.266 24.7 Cg_exo -53.98 -28.4 49.54 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 N-CA-C 120.25 3.135 . . . . 0.0 120.25 -176.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.423 0.8 OUTLIER -161.43 141.08 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 105.465 -2.05 . . . . 0.0 105.465 -179.371 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 1.1 p -60.0 97.02 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 127.053 2.141 . . . . 0.0 107.415 174.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.3 mt -39.95 -19.96 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 119.085 2.994 . . . . 0.0 119.085 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -54.85 -35.22 63.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.228 0.611 . . . . 0.0 111.353 166.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -58.01 -48.87 78.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.071 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -58.25 -46.35 88.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 173.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.64 -50.73 69.42 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 112.629 -2.078 . . . . 0.0 111.917 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -43.39 75.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.83 2.452 . . . . 0.0 113.844 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -66.98 -33.7 76.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.266 1.026 . . . . 0.0 110.384 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.08 -9.26 57.03 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.081 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.54 24.45 76.2 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 126.821 2.153 . . . . 0.0 112.477 170.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.9 p -122.77 134.19 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 124.183 0.993 . . . . 0.0 110.665 -170.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.4 p -41.08 128.54 2.8 Favored 'General case' 0 N--CA 1.51 2.558 0 C-N-CA 127.648 2.379 . . . . 0.0 107.751 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -42.98 -31.31 0.5 Allowed 'General case' 0 N--CA 1.523 3.186 0 N-CA-C 116.658 2.096 . . . . 0.0 116.658 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -48.25 -45.16 34.06 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 125.175 1.547 . . . . 0.0 112.149 177.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.7 p -59.88 -53.98 51.5 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.329 79.3 t -59.86 -50.97 78.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.705 0.802 . . . . 0.0 111.25 -163.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.508 49.4 m -66.3 -29.01 69.14 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -44.4 92.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 112.429 -2.169 . . . . 0.0 115.736 164.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.4 t -60.94 -43.9 96.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.564 1.545 . . . . 0.0 108.4 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.1 t -53.8 -49.07 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.334 -172.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -90.94 14.81 12.78 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 171.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 63.3 14.7 8.05 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.196 2.599 . . . . 0.0 117.819 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 29.06 40.96 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 110.53 -3.032 . . . . 0.0 116.326 -172.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p 56.59 -52.96 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.62 1.968 . . . . 0.0 115.919 -165.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -137.27 117.03 13.08 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 170.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -133.73 154.39 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 120.18 1.355 . . . . 0.0 113.215 169.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 p -59.94 128.62 37.77 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.706 0.802 . . . . 0.0 112.757 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.79 -53.79 36.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -174.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.87 -36.95 8.08 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 42.1 m -60.63 -49.25 78.29 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.509 1.524 . . . . 0.0 108.142 175.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.3 mtp-105 -60.41 -43.49 96.67 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.214 1.806 . . . . 0.0 113.182 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -35.06 70.84 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -77.89 -46.23 21.92 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 112.071 -2.331 . . . . 0.0 111.604 -179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 51.1 t -62.52 -47.29 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 C-N-CA 126.169 1.788 . . . . 0.0 108.039 177.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.24 -43.8 79.03 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 128.888 2.875 . . . . 0.0 111.57 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -52.63 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 112.235 -2.257 . . . . 0.0 110.673 176.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.58 -39.68 68.05 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 112.903 -1.953 . . . . 0.0 113.174 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.1 mtt -59.87 -52.81 63.85 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 117.428 2.381 . . . . 0.0 117.428 -173.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.04 96.52 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 112.412 -2.176 . . . . 0.0 112.866 178.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.92 -33.1 75.04 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 111.324 -2.671 . . . . 0.0 113.987 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 65.2 mt -98.78 21.11 11.9 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.996 1.718 . . . . 0.0 113.878 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.17 24.14 7.73 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -99.74 157.26 16.61 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -172.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.358 7.2 mm -127.34 119.64 21.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 N-CA-C 118.806 2.891 . . . . 0.0 118.806 -177.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.367 0.1 OUTLIER -14.54 -62.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.881 2 C-N-CA 126.819 5.013 . . . . 0.0 123.011 -162.334 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -112.84 45.13 1.38 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 117.887 2.551 . . . . 0.0 117.887 -172.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -88.78 79.01 7.53 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.925 -172.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 1.9 m -74.65 166.57 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 114.196 -1.365 . . . . 0.0 111.571 167.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.52 73.28 1.93 Allowed 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 123.159 1.457 . . . . 0.0 113.126 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -144.58 92.94 2.35 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 112.58 -2.1 . . . . 0.0 111.199 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.75 -50.42 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 109.566 -3.47 . . . . 0.0 109.994 174.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.6 mt . . . . . 0 N--CA 1.492 1.661 0 CA-C-N 114.275 -1.329 . . . . 0.0 113.827 175.881 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.839 0 N-CA-C 117.206 2.298 . . . . 0.0 117.206 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.331 22.7 tptm -111.52 -60.24 0.04 OUTLIER Pre-proline 0 N--CA 1.486 1.33 0 CA-C-O 115.984 -1.96 . . . . 0.0 113.838 -177.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -74.76 -29.95 8.13 Favored 'Trans proline' 0 N--CA 1.488 1.162 0 CA-C-N 121.986 1.745 . . . . 0.0 115.736 -177.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.443 0.5 OUTLIER -159.33 153.23 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 O-C-N 124.758 1.286 . . . . 0.0 107.699 -170.139 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 p -78.56 114.75 17.75 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 102.706 -3.072 . . . . 0.0 102.706 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.3 mt -48.69 -19.91 0.41 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -54.74 -35.52 63.81 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.382 0.673 . . . . 0.0 111.318 167.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -60.76 -47.69 85.19 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.992 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.7 t -59.26 -43.06 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.83 -52.84 61.59 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 111.582 -2.553 . . . . 0.0 111.877 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.39 -39.47 92.26 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.387 1.875 . . . . 0.0 113.868 178.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -66.97 -34.32 77.5 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.156 0.91 . . . . 0.0 110.829 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.45 -13.46 34.77 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 125.018 1.327 . . . . 0.0 112.099 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.39 26.3 72.27 Favored Glycine 0 CA--C 1.546 2.002 0 C-N-CA 126.674 2.083 . . . . 0.0 112.985 173.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -125.96 136.14 61.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 121.448 0.642 . . . . 0.0 109.865 -171.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.8 p -36.65 128.65 0.82 Allowed 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 128.694 2.798 . . . . 0.0 108.131 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -49.23 -36.55 20.48 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.522 0.0 OUTLIER -59.48 -27.19 65.9 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 121.734 3.975 . . . . 0.0 121.734 172.695 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.3 p -62.58 -52.82 61.88 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.457 1.098 . . . . 0.0 111.796 163.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.28 -50.29 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.969 1.308 . . . . 0.0 108.532 -173.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.7 p -55.69 -42.47 75.25 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.683 1.193 . . . . 0.0 113.901 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 40.8 mtt85 -62.06 -47.41 84.8 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 111.817 -2.447 . . . . 0.0 116.328 170.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.1 t -58.28 -41.38 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 C-N-CA 127.048 2.139 . . . . 0.0 107.556 178.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.5 t -56.8 -42.55 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.286 -170.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.284 15.1 m120 -101.31 22.99 11.61 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 168.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.389 9.3 pt20 58.47 -0.36 0.12 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 130.988 3.715 . . . . 0.0 119.404 -177.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.09 33.08 0.14 Allowed 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 112.14 -2.3 . . . . 0.0 114.716 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p 59.96 -54.04 0.07 Allowed 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 126.999 2.12 . . . . 0.0 114.432 -159.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -144.41 116.37 8.32 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-N 113.606 -1.634 . . . . 0.0 111.985 -172.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.2 t -146.43 156.49 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 120.254 1.388 . . . . 0.0 113.083 168.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -45.57 133.82 7.55 Favored 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.89 -53.44 52.61 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -49.11 -35.59 16.73 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 117.827 2.529 . . . . 0.0 117.827 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.7 m -60.05 -50.24 74.5 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -58.48 -42.5 87.69 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.81 -39.78 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -74.34 -43.79 55.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.531 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 45.7 t -63.08 -49.1 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 125.83 1.652 . . . . 0.0 108.052 177.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.87 -41.38 82.35 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.251 2.62 . . . . 0.0 114.886 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -49.31 75.1 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 111.311 -2.677 . . . . 0.0 110.325 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.61 -39.86 85.65 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 112.638 -2.074 . . . . 0.0 113.308 175.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.7 mtt -58.89 -51.59 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.68 97.68 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 112.248 -2.251 . . . . 0.0 111.88 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -62.85 -42.51 99.77 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 111.534 -2.575 . . . . 0.0 112.249 -178.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.8 mt -93.09 23.21 4.44 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.355 1.862 . . . . 0.0 114.02 -177.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 50.4 34.15 8.73 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.955 2.206 . . . . 0.0 116.955 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -96.17 160.69 14.31 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 113.986 -1.461 . . . . 0.0 112.754 -173.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -136.38 115.43 10.77 Favored Pre-proline 0 CA--C 1.548 0.898 0 CA-C-N 112.556 -2.111 . . . . 0.0 109.048 -176.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -44.77 87.64 0.02 OUTLIER 'Trans proline' 0 CA--C 1.559 1.745 1 C-N-CA 126.427 4.751 . . . . 0.0 110.746 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.28 0.1 OUTLIER -163.97 -61.88 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.261 1 N-CA-C 123.144 4.498 . . . . 0.0 123.144 -173.092 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.293 0.0 OUTLIER 54.57 104.41 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 117.2 2.296 . . . . 0.0 117.2 -172.718 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -136.03 90.59 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 O-C-N 119.886 -1.759 . . . . 0.0 109.307 165.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.49 80.69 1.45 Allowed 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 123.538 1.637 . . . . 0.0 110.878 174.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.09 49.75 1.23 Allowed 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 124.411 2.053 . . . . 0.0 112.718 -174.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.02 -50.08 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 110.481 -3.054 . . . . 0.0 110.414 -177.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.8 mp . . . . . 0 N--CA 1.481 1.085 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 163.27 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.4 tpp . . . . . 0 CA--C 1.555 1.14 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.18 151.93 79.25 Favored Pre-proline 0 CA--C 1.562 1.418 0 CA-C-O 115.57 -2.157 . . . . 0.0 107.367 174.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -62.74 -12.7 30.05 Favored 'Trans proline' 0 N--CA 1.487 1.128 0 CA-C-N 124.457 2.627 . . . . 0.0 118.596 -174.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER -154.81 150.33 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 N-CA-C 103.448 -2.797 . . . . 0.0 103.448 174.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.257 80.3 m -61.86 110.46 1.55 Allowed 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 105.202 -2.148 . . . . 0.0 105.202 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -51.85 -17.46 0.97 Allowed 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.373 23.1 m-85 -57.78 -29.38 64.8 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 120.28 1.4 . . . . 0.0 112.687 165.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -63.43 -50.96 67.72 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.399 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -56.89 -43.04 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 CA-C-O 121.302 0.572 . . . . 0.0 112.418 175.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.12 -50.77 71.86 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 112.436 -2.165 . . . . 0.0 111.847 -176.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.78 -40.65 79.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.624 1.97 . . . . 0.0 115.182 175.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -62.79 -33.93 76.21 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.048 1.339 . . . . 0.0 110.079 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.68 -22.64 17.43 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 113.891 -1.504 . . . . 0.0 111.663 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.53 25.35 56.91 Favored Glycine 0 CA--C 1.554 2.524 0 C-N-CA 125.699 1.619 . . . . 0.0 113.18 173.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.9 p -126.25 94.5 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.222 0 C-N-CA 122.992 0.517 . . . . 0.0 110.066 -167.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.6 p -7.62 127.11 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.734 0 C-N-CA 127.334 2.254 . . . . 0.0 113.672 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -50.17 -38.89 41.88 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 117.924 2.565 . . . . 0.0 117.924 -171.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -51.2 -40.11 57.98 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 118.906 0.775 . . . . 0.0 112.472 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 20.4 m -55.39 -53.26 58.48 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.835 2.054 . . . . 0.0 112.169 171.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 73.6 t -63.73 -53.42 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-O 118.675 -0.679 . . . . 0.0 109.698 -173.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.413 3.2 m -60.22 -34.09 73.17 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 117.198 2.295 . . . . 0.0 117.198 -177.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 mtp85 -59.06 -49.54 77.51 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.249 -1.796 . . . . 0.0 115.36 166.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.5 t -57.82 -47.24 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 126.533 1.933 . . . . 0.0 108.749 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.3 t -57.35 -42.07 79.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 O-C-N 126.594 2.434 . . . . 0.0 112.299 -166.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -94.54 15.01 19.04 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 125.209 1.568 . . . . 0.0 112.773 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 69.03 9.63 7.51 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.15 2.18 . . . . 0.0 116.571 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.66 38.63 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.789 -2.46 . . . . 0.0 117.197 -173.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.4 p 58.88 -50.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 126.343 1.857 . . . . 0.0 115.758 -164.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -146.86 93.8 2.33 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -116.63 155.34 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.58 124.87 21.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.82 -63.56 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.362 0.1 OUTLIER -42.6 -35.63 1.15 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 119.652 3.204 . . . . 0.0 119.652 173.078 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 m -65.46 -50.55 64.95 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 112.879 -1.964 . . . . 0.0 108.178 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -57.16 -45.79 83.32 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.59 -36.43 73.99 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.5 ttmt -76.06 -44.32 39.6 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 112.266 -2.243 . . . . 0.0 111.186 -177.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.91 -47.94 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 126.463 1.905 . . . . 0.0 108.18 177.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -54.55 -44.84 73.21 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.452 2.701 . . . . 0.0 111.405 -178.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.89 69.53 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.142 -2.299 . . . . 0.0 111.0 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.52 -41.37 89.83 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 113.206 -1.816 . . . . 0.0 114.019 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.5 mtt -62.07 -44.83 95.82 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 119.949 -1.719 . . . . 0.0 112.962 -174.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.52 93.49 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 126.271 2.232 . . . . 0.0 111.496 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -65.91 -34.18 77.53 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.914 -2.403 . . . . 0.0 113.351 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.5 mt -97.24 13.92 27.8 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.294 2.237 . . . . 0.0 114.486 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.37 33.75 21.48 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 117.573 2.435 . . . . 0.0 117.573 175.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -92.1 152.68 19.81 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.925 -171.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.294 0.0 OUTLIER -126.65 109.65 22.85 Favored Pre-proline 0 N--CA 1.474 0.74 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.694 -179.217 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -50.61 85.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.982 3.788 . . . . 0.0 116.103 -169.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -179.92 -110.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.944 2.498 . . . . 0.0 110.697 158.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.493 52.2 mtp85 39.24 -10.26 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 121.51 3.893 . . . . 0.0 121.51 -171.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.7 m -77.36 8.84 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 CA-C-N 113.714 -1.584 . . . . 0.0 115.123 145.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -118.77 87.97 2.84 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 140.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -48.86 114.16 0.93 Allowed 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 111.438 -2.619 . . . . 0.0 116.467 -171.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 56.18 42.67 27.86 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 112.918 -1.946 . . . . 0.0 113.954 175.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 117.188 2.292 . . . . 0.0 117.188 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 N--CA 1.48 1.042 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.33 168.57 9.04 Favored Pre-proline 0 CA--C 1.567 1.612 0 CA-C-O 116.205 -1.855 . . . . 0.0 110.907 169.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -105.05 -11.81 0.09 OUTLIER 'Trans proline' 0 CA--C 1.543 0.957 0 N-CA-C 117.035 1.898 . . . . 0.0 117.035 175.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.53 1.1 t -164.79 153.0 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 -164.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 40.0 p -95.32 145.33 25.18 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.262 0.937 . . . . 0.0 109.556 -175.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mt -59.94 -14.9 17.94 Favored 'General case' 0 N--CA 1.506 2.343 0 N-CA-C 117.095 2.258 . . . . 0.0 117.095 -163.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -55.87 -38.42 70.1 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.468 1.485 . . . . 0.0 111.448 174.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -64.73 -44.51 89.94 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.767 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 81.1 t -59.64 -43.61 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-N 118.747 0.703 . . . . 0.0 112.886 172.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.9 69.94 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 113.173 -1.83 . . . . 0.0 113.394 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.75 -39.55 87.94 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.473 1.909 . . . . 0.0 114.274 174.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -63.43 -33.7 76.13 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.414 1.086 . . . . 0.0 110.31 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.28 -19.58 19.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.106 1.362 . . . . 0.0 112.216 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.83 25.1 56.92 Favored Glycine 0 CA--C 1.549 2.216 0 C-N-CA 126.613 2.054 . . . . 0.0 113.399 174.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.268 3.9 p -129.83 119.16 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.33 0 C-N-CA 124.914 1.285 . . . . 0.0 108.24 -166.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.7 p -27.47 143.55 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.344 0 C-N-CA 128.647 2.779 . . . . 0.0 111.849 -174.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -57.62 -34.33 69.19 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 119.238 -2.164 . . . . 0.0 114.665 175.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.266 14.8 tp60 -56.41 -45.95 80.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 117.434 -1.27 . . . . 0.0 112.596 173.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.4 m -53.31 -54.17 40.35 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.885 1.274 . . . . 0.0 111.388 175.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.6 t -64.18 -49.26 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.837 -176.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.281 69.6 p -57.42 -39.38 76.07 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 119.196 3.036 . . . . 0.0 119.196 -174.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.6 mtp85 -61.58 -51.18 69.6 Favored 'General case' 0 C--N 1.319 -0.72 1 CA-C-N 106.857 -4.701 . . . . 0.0 114.198 167.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.1 t -58.58 -43.01 86.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.861 1.265 . . . . 0.0 109.764 -176.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.9 t -49.14 -53.22 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 112.705 -2.043 . . . . 0.0 111.816 -171.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.331 16.4 m120 -107.37 37.43 2.4 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 113.67 -1.605 . . . . 0.0 114.589 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.253 2.2 tp60 73.92 -5.46 2.03 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 129.289 3.036 . . . . 0.0 117.873 166.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 36.69 36.32 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 113.302 -1.772 . . . . 0.0 115.256 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.0 p 55.31 -48.37 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -151.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.262 71.7 m80 -157.57 130.91 7.77 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -170.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -145.5 150.68 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 116.967 2.21 . . . . 0.0 116.967 162.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.3 p -51.47 139.47 19.88 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -57.48 9.34 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -173.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.2 -43.22 1.63 Allowed 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 176.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.8 m -57.79 -48.79 78.69 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 126.528 1.931 . . . . 0.0 108.577 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtt-85 -65.33 -44.8 86.63 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 117.475 2.398 . . . . 0.0 117.475 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.21 -29.94 64.15 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -80.31 -42.28 23.31 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 111.381 -2.645 . . . . 0.0 112.048 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.54 -49.7 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 125.686 1.595 . . . . 0.0 109.204 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -55.63 -46.84 77.34 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.605 3.162 . . . . 0.0 111.757 -176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -51.17 64.02 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.339 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.97 -42.05 84.23 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 112.974 -1.921 . . . . 0.0 114.598 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -56.09 -45.2 79.49 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 178.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.09 -43.74 91.1 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.646 -2.07 . . . . 0.0 113.071 177.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -66.1 -38.46 88.27 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 112.759 -2.019 . . . . 0.0 113.014 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.3 mt -85.3 13.66 6.25 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 127.089 2.156 . . . . 0.0 113.842 177.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.401 0.2 OUTLIER 44.99 31.5 0.71 Allowed 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 115.98 1.844 . . . . 0.0 115.98 -176.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -98.59 101.14 12.47 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.058 -160.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -28.1 117.82 0.26 Allowed Pre-proline 0 N--CA 1.502 2.173 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 167.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -65.86 64.99 0.43 Allowed 'Trans proline' 0 CA--C 1.549 1.235 0 C-N-CA 122.75 2.3 . . . . 0.0 116.529 170.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -167.83 164.04 14.09 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 112.087 -2.324 . . . . 0.0 109.134 161.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -124.1 74.23 1.28 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 168.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -90.88 103.13 14.12 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.331 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 -176.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 53.67 82.83 0.08 Allowed 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 122.787 1.28 . . . . 0.0 111.927 -177.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -81.69 117.23 21.86 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 113.932 -1.486 . . . . 0.0 108.632 174.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.48 75.3 7.61 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 111.477 -2.601 . . . . 0.0 112.046 -178.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 N--CA 1.489 1.496 0 CA-C-N 109.66 -3.427 . . . . 0.0 115.507 -174.69 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -129.9 157.7 76.03 Favored Pre-proline 0 CA--C 1.551 0.985 0 N-CA-C 117.956 2.576 . . . . 0.0 117.956 -175.028 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -67.7 -36.84 17.79 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 CA-C-N 121.038 1.406 . . . . 0.0 115.467 167.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.434 0.5 OUTLIER -155.74 153.26 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.685 -170.726 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -77.56 107.0 9.71 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 101.388 -3.56 . . . . 0.0 101.388 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -51.14 -10.24 0.07 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 120.161 3.393 . . . . 0.0 120.161 -175.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -53.75 -31.9 50.23 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.644 0.656 . . . . 0.0 112.221 162.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.76 -52.74 62.99 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 176.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.15 -43.23 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 172.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.05 -51.09 71.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 113.119 -1.855 . . . . 0.0 111.876 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -39.5 91.24 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.219 2.207 . . . . 0.0 114.146 174.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -65.79 -34.05 77.28 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.141 0.977 . . . . 0.0 110.909 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.39 -13.63 37.31 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.829 1.251 . . . . 0.0 111.332 177.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.9 23.12 64.67 Favored Glycine 0 N--CA 1.491 2.32 0 C-N-CA 127.199 2.333 . . . . 0.0 113.387 172.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.49 124.28 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.514 1.126 . . . . 0.0 111.331 -168.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -32.2 129.63 0.18 Allowed 'General case' 0 N--CA 1.526 3.336 0 C-N-CA 125.347 1.459 . . . . 0.0 109.631 175.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -45.26 -34.57 2.93 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 118.318 2.711 . . . . 0.0 118.318 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.58 -30.2 12.66 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 13.9 p -66.77 -56.67 9.43 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 168.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 78.5 t -57.47 -53.48 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 C-N-CA 123.901 0.88 . . . . 0.0 110.237 -164.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 2.0 m -60.93 -35.04 75.68 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -64.51 -47.33 79.3 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.0 t -59.56 -40.9 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.207 1.403 . . . . 0.0 108.851 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 91.9 t -51.14 -46.18 31.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 O-C-N 125.461 1.726 . . . . 0.0 111.492 -171.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.303 20.3 m120 -107.42 32.4 4.69 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 173.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 64.52 0.34 1.08 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 130.089 3.355 . . . . 0.0 118.95 175.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.59 35.25 0.18 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 113.064 -1.88 . . . . 0.0 114.698 -173.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.9 p 62.52 -44.95 0.18 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -158.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.298 69.1 m80 -165.51 116.75 1.09 Allowed 'General case' 0 CA--C 1.561 1.395 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 -168.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.4 162.67 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 159.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 p -45.94 135.61 7.13 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.67 -61.1 2.3 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -171.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.3 pptp? -39.69 -37.47 0.52 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 117.82 2.526 . . . . 0.0 117.82 176.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -61.41 -50.03 74.5 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.447 1.499 . . . . 0.0 108.866 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -43.84 97.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.99 -35.46 76.88 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -80.18 -46.04 17.04 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 112.657 -2.065 . . . . 0.0 112.243 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.7 t -59.91 -49.93 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.527 1.131 . . . . 0.0 108.953 173.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -56.35 -41.54 76.27 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.816 2.046 . . . . 0.0 114.91 -178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.93 -53.28 52.72 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 111.679 -2.51 . . . . 0.0 110.469 175.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.55 -40.45 78.9 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 113.298 -1.773 . . . . 0.0 113.476 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.0 mtt -59.44 -48.55 81.2 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -176.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.88 -41.05 95.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 112.175 -2.284 . . . . 0.0 112.996 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -65.6 -37.18 85.89 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.292 -1.776 . . . . 0.0 113.286 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.9 mt -90.81 14.33 13.89 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.538 2.335 . . . . 0.0 112.878 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.275 3.7 p-10 53.92 19.05 1.82 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 120.029 3.344 . . . . 0.0 120.029 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -87.45 91.82 8.87 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 112.243 -2.253 . . . . 0.0 110.887 -169.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -22.2 118.85 0.15 Allowed Pre-proline 0 N--CA 1.51 2.557 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.236 153.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -52.96 36.48 0.02 OUTLIER 'Trans proline' 0 CA--C 1.54 0.789 1 N-CA-C 123.582 4.416 . . . . 0.0 123.582 173.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -178.53 123.75 0.1 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.124 1.37 . . . . 0.0 110.804 169.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.27 0.0 OUTLIER -76.25 35.85 0.14 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 120.386 3.476 . . . . 0.0 120.386 -176.141 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 13.8 m -116.58 53.81 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 CA-C-N 113.702 -1.59 . . . . 0.0 111.412 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -137.43 -11.85 1.61 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -171.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 44.42 -91.4 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 CA-C-O 117.1 -1.428 . . . . 0.0 113.537 -163.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.624 1.8 mp0 -108.47 69.72 0.73 Allowed 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 116.653 2.094 . . . . 0.0 116.653 -172.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 N--CA 1.491 1.622 1 CA-C-N 101.822 -6.99 . . . . 0.0 117.098 -177.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.284 0.0 OUTLIER -147.64 155.31 45.15 Favored Pre-proline 0 CA--C 1.55 0.963 0 N-CA-C 117.36 2.356 . . . . 0.0 117.36 -178.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -68.87 -50.7 0.54 Allowed 'Trans proline' 0 N--CA 1.486 1.033 0 CA-C-N 121.469 1.56 . . . . 0.0 111.744 161.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.378 1.2 t -156.51 146.99 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 CA-C-O 122.134 0.969 . . . . 0.0 108.606 -177.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.417 1.2 m -51.85 109.17 0.34 Allowed 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 131.014 3.725 . . . . 0.0 107.701 175.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -48.71 -24.46 1.39 Allowed 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 117.726 2.491 . . . . 0.0 117.726 171.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.262 54.0 m-85 -61.62 -31.57 71.66 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 168.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.66 -46.56 87.64 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 118.154 -0.927 . . . . 0.0 110.464 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.9 t -56.94 -42.74 79.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 174.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.59 -54.9 39.85 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.809 1.644 . . . . 0.0 112.709 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -36.61 84.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.157 1.783 . . . . 0.0 113.387 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -64.93 -37.38 87.45 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.873 0.844 . . . . 0.0 109.859 177.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.66 -10.86 50.09 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.604 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.54 24.19 73.39 Favored Glycine 0 N--CA 1.487 2.061 0 C-N-CA 127.528 2.49 . . . . 0.0 113.431 172.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -125.98 122.49 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.026 0.93 . . . . 0.0 111.879 -167.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.7 p -29.41 121.42 0.15 Allowed 'General case' 0 N--CA 1.524 3.249 0 C-N-CA 127.929 2.491 . . . . 0.0 107.95 171.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -49.85 -27.47 5.14 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.8 tp60 -46.1 -40.51 11.0 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.94 1.4 . . . . 0.0 112.133 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.4 p -61.07 -55.24 34.92 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 173.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.255 74.2 t -59.96 -46.65 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.617 1.167 . . . . 0.0 109.648 -169.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.9 p -59.77 -45.87 90.93 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.5 mtp85 -57.5 -46.47 83.73 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.595 -2.093 . . . . 0.0 114.843 170.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.0 t -60.18 -44.94 96.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.724 1.209 . . . . 0.0 109.089 -176.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.2 t -52.92 -46.17 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 O-C-N 126.213 2.196 . . . . 0.0 111.269 -169.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.251 16.6 m120 -106.57 27.68 8.58 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 65.7 9.08 5.66 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 118.518 2.785 . . . . 0.0 118.518 171.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 34.25 33.68 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 128.266 2.626 . . . . 0.0 116.423 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 58.84 -42.75 0.07 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 -160.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -149.0 92.78 2.01 Favored 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.7 p -110.18 151.92 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 N-CA-C 117.223 2.305 . . . . 0.0 117.223 171.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -65.07 136.41 56.71 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 176.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.64 -43.38 96.96 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -175.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.85 -45.14 50.12 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 173.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.9 m -64.34 -47.47 79.25 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 112.658 -2.064 . . . . 0.0 108.386 177.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.45 -42.46 78.2 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.126 1.37 . . . . 0.0 114.631 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -60.96 -39.83 91.01 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 113.394 -1.73 . . . . 0.0 113.733 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -72.99 -43.59 62.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.661 1.985 . . . . 0.0 111.031 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.8 t -66.08 -48.98 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.087 179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -52.49 -45.07 66.03 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 130.913 3.685 . . . . 0.0 110.354 -178.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.71 -51.14 66.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.172 176.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -46.15 87.16 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.339 -1.755 . . . . 0.0 113.306 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.41 -45.38 80.69 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.679 1.592 . . . . 0.0 112.972 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.57 -46.45 88.3 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 112.903 -1.953 . . . . 0.0 112.34 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -64.43 -38.49 91.2 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.034 -2.348 . . . . 0.0 112.837 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 11.4 mt -87.32 11.92 13.2 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.939 2.496 . . . . 0.0 114.185 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.41 0.2 OUTLIER 52.47 23.58 2.6 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.196 2.598 . . . . 0.0 113.388 -176.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -96.56 87.63 4.44 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.386 -1.446 . . . . 0.0 110.52 -159.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -10.08 110.89 0.04 OUTLIER Pre-proline 0 N--CA 1.519 2.987 0 CA-C-N 113.178 -1.828 . . . . 0.0 113.509 153.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -63.48 50.71 0.14 Allowed 'Trans proline' 0 CA--C 1.542 0.878 0 N-CA-C 119.764 2.948 . . . . 0.0 119.764 175.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -179.75 148.02 0.31 Allowed 'General case' 0 CA--C 1.564 1.491 0 C-N-CA 127.368 2.267 . . . . 0.0 111.321 163.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.261 0.0 OUTLIER -68.77 95.66 0.69 Allowed 'General case' 0 N--CA 1.487 1.375 0 CA-C-N 119.588 1.085 . . . . 0.0 113.795 175.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.6 m -83.98 54.96 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 CA-C-O 122.547 1.165 . . . . 0.0 111.235 -177.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.15 148.31 51.99 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 114.064 -1.425 . . . . 0.0 110.55 176.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 51.99 76.8 0.16 Allowed 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 123.343 1.544 . . . . 0.0 113.185 -175.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -81.24 31.03 0.33 Allowed 'General case' 0 N--CA 1.49 1.563 0 CA-C-N 109.413 -3.54 . . . . 0.0 113.567 178.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.5 mt . . . . . 0 N--CA 1.481 1.121 0 CA-C-N 113.14 -1.845 . . . . 0.0 113.939 -175.295 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 116.629 2.085 . . . . 0.0 116.629 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.29 146.07 10.35 Favored Pre-proline 0 CA--C 1.581 2.151 0 CA-C-O 115.745 -2.074 . . . . 0.0 114.171 -163.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -70.49 -2.2 10.32 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 N-CA-C 121.239 3.515 . . . . 0.0 121.239 -171.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.5 OUTLIER -156.11 147.33 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 179.527 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.308 4.2 p -70.39 97.6 1.29 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -177.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.4 mt -41.49 -14.27 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 -175.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -53.74 -33.3 55.28 Favored 'General case' 0 CA--C 1.561 1.368 0 O-C-N 123.514 0.508 . . . . 0.0 110.913 165.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -59.07 -52.4 65.89 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 118.474 -0.774 . . . . 0.0 113.024 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 66.5 t -57.99 -45.04 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.506 0.722 . . . . 0.0 112.855 174.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.93 -49.18 78.81 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 113.444 -1.707 . . . . 0.0 112.016 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -43.61 79.2 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.139 1.776 . . . . 0.0 115.198 176.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -32.38 74.03 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.792 0.837 . . . . 0.0 111.311 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.7 -17.39 26.84 Favored 'General case' 0 CA--C 1.562 1.408 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.062 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.03 23.42 69.03 Favored Glycine 0 N--CA 1.49 2.264 0 C-N-CA 125.721 1.629 . . . . 0.0 113.524 173.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.253 4.5 p -123.28 126.07 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.426 0 C-N-CA 124.627 1.171 . . . . 0.0 107.929 -170.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 83.2 p -33.24 139.48 0.05 Allowed 'General case' 0 N--CA 1.528 3.432 0 C-N-CA 126.21 1.804 . . . . 0.0 111.269 -177.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.365 55.2 t80 -40.45 -65.87 0.37 Allowed 'General case' 0 N--CA 1.519 3.019 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.401 0.0 OUTLIER -58.0 -23.47 54.18 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 121.785 3.994 . . . . 0.0 121.785 -177.39 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 83.4 m -53.64 -48.43 69.38 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.595 163.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.9 t -65.57 -51.31 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.199 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.253 1.3 m -57.26 -36.03 70.47 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -178.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.8 mtt85 -59.21 -49.24 78.6 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 166.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 77.3 t -59.41 -41.0 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.454 -176.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.1 t -54.68 -50.23 61.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.319 0 CA-C-N 112.974 -1.921 . . . . 0.0 112.409 -167.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.398 3.9 m120 -100.6 29.74 4.31 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 170.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.81 14.65 7.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 129.16 2.984 . . . . 0.0 118.445 169.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.04 47.46 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 111.036 -2.802 . . . . 0.0 115.413 -173.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.254 91.5 p 57.32 -59.86 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 126.288 1.835 . . . . 0.0 115.214 -161.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -141.16 94.6 2.72 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -177.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.28 150.68 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 p -60.89 142.06 56.63 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -38.58 -79.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.125 2.17 . . . . 0.0 115.682 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -34.37 55.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.8 m -61.74 -49.28 77.04 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.618 178.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtm105 -58.39 -53.37 59.02 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.305 1.594 . . . . 0.0 115.305 173.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -50.85 -38.57 49.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -76.82 -47.88 20.13 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 111.242 -2.708 . . . . 0.0 113.127 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 43.2 t -61.18 -48.54 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.377 176.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -57.46 -45.83 84.32 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 128.161 2.584 . . . . 0.0 114.973 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.12 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 112.855 -1.975 . . . . 0.0 110.665 176.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.42 -36.94 74.38 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 112.763 -2.017 . . . . 0.0 115.081 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 20.5 mtt -60.65 -53.33 58.72 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -171.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.31 97.31 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 113.499 -1.682 . . . . 0.0 113.311 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.63 -39.29 93.44 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.264 -2.244 . . . . 0.0 113.693 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.2 mt -94.3 25.3 3.91 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.933 1.693 . . . . 0.0 112.682 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 59.54 21.57 10.12 Favored 'General case' 0 CA--C 1.57 1.741 0 C-N-CA 125.473 1.509 . . . . 0.0 114.32 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -93.19 166.57 12.26 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.956 0.902 . . . . 0.0 110.009 -175.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -145.56 124.78 6.77 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.702 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER -38.66 177.7 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 124.606 3.538 . . . . 0.0 117.85 178.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 58.91 -46.2 0.06 Allowed 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 130.037 3.335 . . . . 0.0 116.63 -165.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.285 22.2 mtp85 -45.6 73.56 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 119.072 2.99 . . . . 0.0 119.072 -170.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.0 m -124.6 40.11 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-N 111.633 -2.53 . . . . 0.0 112.851 154.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -176.42 -146.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 112.82 -1.991 . . . . 0.0 109.596 -162.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 57.74 -76.94 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.169 2.188 . . . . 0.0 116.257 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.265 0.0 OUTLIER -97.7 72.77 2.31 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 124.468 2.08 . . . . 0.0 110.494 171.027 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.1 mt . . . . . 0 N--CA 1.479 0.986 0 CA-C-N 111.536 -2.574 . . . . 0.0 114.868 -162.895 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.7 mtm . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 116.785 2.142 . . . . 0.0 116.785 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.5 tttt -21.63 98.22 0.06 OUTLIER Pre-proline 0 CA--C 1.573 1.849 0 C-N-CA 127.184 2.194 . . . . 0.0 112.997 -165.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -97.69 29.53 0.16 Allowed 'Trans proline' 0 CA--C 1.54 0.782 0 N-CA-C 119.776 2.952 . . . . 0.0 119.776 -148.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.457 1.1 t 173.11 150.99 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 129.564 3.146 . . . . 0.0 103.374 -166.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.8 p -101.99 145.44 29.28 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 117.57 -1.652 . . . . 0.0 108.944 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.24 -9.58 1.01 Allowed 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -165.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -58.82 -37.56 76.67 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.926 0.784 . . . . 0.0 111.514 170.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -62.31 -48.43 79.9 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 118.062 -0.971 . . . . 0.0 111.603 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.21 -40.89 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 N-CA-C 112.235 0.458 . . . . 0.0 112.235 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.47 -55.26 36.9 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 125.827 1.651 . . . . 0.0 114.716 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -41.68 94.36 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 127.153 2.181 . . . . 0.0 113.841 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -65.91 -31.47 72.43 Favored 'General case' 0 CA--C 1.551 0.981 0 O-C-N 124.411 1.07 . . . . 0.0 110.592 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.84 -16.86 22.59 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.111 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.94 23.2 59.92 Favored Glycine 0 CA--C 1.547 2.04 0 C-N-CA 126.496 1.998 . . . . 0.0 113.459 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.272 9.9 p -128.54 129.0 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -167.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.8 p -35.44 146.86 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 128.283 2.633 . . . . 0.0 112.181 -172.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -59.37 -32.8 70.46 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 119.192 -2.192 . . . . 0.0 114.648 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.271 27.2 tp60 -55.28 -38.93 69.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 117.473 -1.251 . . . . 0.0 113.01 171.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 20.3 m -59.9 -53.39 58.49 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.469 0.708 . . . . 0.0 110.917 174.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.377 62.7 t -65.52 -43.11 94.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.826 -171.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.9 p -58.31 -48.1 81.6 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -53.6 53.82 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 110.932 -2.849 . . . . 0.0 113.491 170.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 76.4 t -62.24 -44.81 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.991 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.9 t -64.28 -41.64 93.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 CA-C-N 113.771 -1.558 . . . . 0.0 111.23 -168.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -77.22 5.07 9.1 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 113.787 -1.551 . . . . 0.0 113.832 169.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 69.97 3.68 4.45 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.895 2.478 . . . . 0.0 114.653 177.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.61 42.35 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 128.745 2.818 . . . . 0.0 116.898 -173.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.259 84.8 p 65.41 -62.19 0.23 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.584 1.954 . . . . 0.0 112.266 -164.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.8 m170 -138.2 137.57 37.7 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 124.2 0.938 . . . . 0.0 109.357 172.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.253 1.4 p -138.21 153.84 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 120.278 1.399 . . . . 0.0 113.671 175.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -55.66 126.41 25.31 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.01 -60.88 1.27 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.1 -31.82 69.26 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.7 m -60.5 -48.17 82.92 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.145 1.378 . . . . 0.0 107.506 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -61.14 -44.66 96.98 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 116.773 2.138 . . . . 0.0 116.773 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.61 -34.36 71.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.864 178.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -80.28 -43.52 21.17 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.534 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.1 t -60.82 -48.28 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.549 1.54 . . . . 0.0 107.778 173.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.57 -40.76 88.4 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.916 2.086 . . . . 0.0 112.623 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.29 -49.66 70.94 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 113.783 -1.553 . . . . 0.0 111.137 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.01 -40.85 77.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 112.055 -2.339 . . . . 0.0 113.432 169.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 28.6 ttm -61.78 -46.24 90.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.632 1.573 . . . . 0.0 112.189 -172.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.44 -48.55 79.17 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.097 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.98 -39.15 93.83 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 113.19 -1.823 . . . . 0.0 113.561 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.6 mt -92.03 22.79 4.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -176.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 p30 57.03 19.35 4.6 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 117.624 2.453 . . . . 0.0 117.624 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -85.12 100.11 11.5 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.136 -1.393 . . . . 0.0 112.325 -163.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -31.21 112.3 0.32 Allowed Pre-proline 0 N--CA 1.491 1.594 0 CA-C-O 116.41 -1.757 . . . . 0.0 113.024 160.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.259 44.3 Cg_exo -57.86 32.39 0.04 OUTLIER 'Trans proline' 0 N--CA 1.487 1.112 1 N-CA-C 124.801 4.885 . . . . 0.0 124.801 -166.884 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 177.9 104.97 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 175.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 9.61 88.32 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 115.702 1.742 . . . . 0.0 115.702 144.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 1.5 m -119.99 -169.85 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 113.703 -1.59 . . . . 0.0 109.545 174.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -36.58 134.62 0.46 Allowed 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.475 -0.765 . . . . 0.0 111.694 164.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -113.45 158.52 20.57 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.659 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -40.19 98.29 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.336 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.806 149.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 73.1 mt . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -173.731 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ttp . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 115.549 1.685 . . . . 0.0 115.549 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -131.56 -174.24 0.38 Allowed Pre-proline 0 CA--C 1.556 1.186 0 CA-C-O 114.735 -2.555 . . . . 0.0 110.234 -175.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -52.81 -38.09 77.49 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 CA-C-N 124.92 2.793 . . . . 0.0 114.983 177.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.481 1.1 t -165.21 129.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 100.523 -3.88 . . . . 0.0 100.523 173.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.7 p -81.31 139.05 35.62 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.895 -1.128 . . . . 0.0 108.491 -162.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 53.8 mt -62.09 -6.2 2.8 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 120.909 3.67 . . . . 0.0 120.909 -155.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.257 70.4 m-85 -57.69 -37.91 74.26 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.319 1.418 . . . . 0.0 111.611 173.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.94 -53.29 58.58 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 171.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.1 t -59.95 -44.32 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.129 0.572 . . . . 0.0 111.818 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.07 77.7 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.058 1.343 . . . . 0.0 112.818 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.42 -41.71 76.01 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.91 2.084 . . . . 0.0 114.185 178.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -63.96 -35.11 79.61 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.539 1.136 . . . . 0.0 110.003 177.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.81 -19.77 24.28 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.298 1.439 . . . . 0.0 111.528 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.72 28.21 61.53 Favored Glycine 0 N--CA 1.488 2.153 0 C-N-CA 125.721 1.629 . . . . 0.0 112.772 174.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.27 5.1 p -132.31 123.4 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.191 0 C-N-CA 124.82 1.248 . . . . 0.0 107.707 -170.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.7 p -32.46 145.09 0.02 OUTLIER 'General case' 0 N--CA 1.528 3.431 0 C-N-CA 128.005 2.522 . . . . 0.0 111.803 -171.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -57.89 -35.92 71.68 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 119.067 -2.27 . . . . 0.0 115.313 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -57.32 -40.23 77.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 118.772 -0.632 . . . . 0.0 112.187 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 57.4 m -55.24 -50.2 70.06 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.685 0.794 . . . . 0.0 110.122 173.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.332 74.2 t -66.54 -42.39 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.174 0.59 . . . . 0.0 112.459 -174.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.6 p -63.28 -47.38 82.59 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.4 mtp85 -51.61 -47.19 63.72 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.395 -2.184 . . . . 0.0 112.996 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.18 -48.41 88.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-O 122.035 0.921 . . . . 0.0 110.076 -176.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.9 t -59.76 -47.98 89.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 112.859 -1.973 . . . . 0.0 111.222 -172.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -84.99 23.13 1.26 Allowed 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.914 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.271 0.0 OUTLIER 59.22 7.79 0.96 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.382 2.673 . . . . 0.0 116.249 174.047 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 29.47 36.25 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 128.548 2.739 . . . . 0.0 116.075 -167.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p 59.33 -46.88 0.07 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 126.639 1.975 . . . . 0.0 115.759 -162.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -144.1 95.57 2.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.4 p -111.93 150.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -65.77 142.22 58.05 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.25 -69.47 0.11 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -49.62 -36.65 25.1 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 117.779 2.511 . . . . 0.0 117.779 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.2 m -58.82 -52.27 66.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.603 -1.635 . . . . 0.0 108.333 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.0 mtm105 -56.6 -47.52 79.42 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 175.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.09 -34.38 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -178.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.73 -42.95 57.34 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 112.542 -2.117 . . . . 0.0 112.02 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.4 t -64.62 -48.9 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 112.897 -1.956 . . . . 0.0 109.56 178.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -57.32 -47.15 82.28 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.655 2.782 . . . . 0.0 112.368 -178.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.34 -48.3 80.43 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 112.749 -2.023 . . . . 0.0 110.892 177.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.26 -43.63 88.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.527 -2.124 . . . . 0.0 114.703 175.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.9 mtt -59.28 -46.31 88.87 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.21 -44.35 95.55 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.881 -1.509 . . . . 0.0 112.437 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -61.54 -34.52 75.68 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.107 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.5 mt -99.79 13.08 34.94 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.625 2.37 . . . . 0.0 115.269 -177.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.378 0.2 OUTLIER 54.74 18.41 2.1 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 126.778 2.031 . . . . 0.0 115.763 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -83.83 102.29 12.24 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.428 -1.42 . . . . 0.0 108.467 -171.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -42.75 125.82 3.1 Favored Pre-proline 0 N--CA 1.5 2.048 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.459 168.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -54.81 56.17 0.03 OUTLIER 'Trans proline' 0 CA--C 1.552 1.376 0 C-N-CA 124.581 3.521 . . . . 0.0 119.001 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 177.34 148.61 0.14 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 128.259 2.623 . . . . 0.0 115.807 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.1 mtm105 -78.91 92.35 4.9 Favored 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 5.5 m -76.33 66.35 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 176.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -41.12 -57.21 2.13 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 119.188 3.033 . . . . 0.0 119.188 -159.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -85.1 58.01 4.78 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 121.861 0.838 . . . . 0.0 112.476 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 52.02 33.8 12.62 Favored 'General case' 0 N--CA 1.518 2.927 0 CA-C-N 113.768 -1.56 . . . . 0.0 111.147 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.5 mt . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -158.694 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.7 mtm . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? 65.04 166.98 0.11 Allowed Pre-proline 0 CA--C 1.567 1.629 0 CA-C-N 113.792 -1.549 . . . . 0.0 112.996 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -79.83 -19.57 9.65 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 N-CA-C 116.458 1.676 . . . . 0.0 116.458 163.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.47 0.5 OUTLIER -160.4 138.77 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 178.462 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.4 p -87.38 142.25 28.02 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.919 -168.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mt -58.94 -12.04 4.07 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 121.511 3.893 . . . . 0.0 121.511 -158.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -60.64 -34.14 73.83 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.557 0.617 . . . . 0.0 110.544 173.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -59.4 -50.55 73.51 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 170.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.49 -42.59 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 174.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.93 51.69 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 112.934 -1.939 . . . . 0.0 112.992 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -39.53 93.24 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.57 1.948 . . . . 0.0 114.309 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -64.44 -36.12 83.13 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.184 0.994 . . . . 0.0 110.39 176.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.98 -13.94 37.73 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.645 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.75 25.42 69.74 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 127.753 2.597 . . . . 0.0 113.31 172.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.25 128.62 71.73 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 CA-C-O 121.08 0.467 . . . . 0.0 111.894 -167.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.8 p -28.74 124.25 0.12 Allowed 'General case' 0 N--CA 1.52 3.053 0 C-N-CA 128.639 2.775 . . . . 0.0 109.323 174.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -45.31 -39.38 6.57 Favored 'General case' 0 N--CA 1.529 3.476 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.344 0.0 OUTLIER -54.05 -34.7 60.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 118.734 2.864 . . . . 0.0 118.734 -178.912 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 69.4 p -59.06 -47.11 86.42 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.755 1.222 . . . . 0.0 112.044 174.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.6 t -66.02 -54.31 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.546 1.139 . . . . 0.0 109.675 -177.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.511 20.1 m -64.11 -26.89 68.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -61.27 -48.43 81.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 110.542 -3.026 . . . . 0.0 115.273 163.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.65 -46.5 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.417 178.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.9 t -55.4 -48.04 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.852 -172.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -104.93 19.7 20.11 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.26 2.9 mp0 64.92 14.8 9.53 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 174.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 44.36 6.28 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 110.524 -3.035 . . . . 0.0 119.066 175.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.2 t 65.04 -51.76 0.34 Allowed 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 124.224 1.01 . . . . 0.0 110.867 -155.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -130.1 101.94 6.03 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.159 175.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -108.7 134.61 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 176.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.0 p -72.43 133.95 45.14 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.9 -63.38 1.11 Allowed 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.375 0.0 OUTLIER -45.38 -33.38 2.52 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 117.492 2.404 . . . . 0.0 117.492 178.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.8 m -62.56 -49.73 74.1 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -56.64 -45.16 81.76 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.202 1.801 . . . . 0.0 112.884 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.44 -38.21 83.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 113.759 -1.564 . . . . 0.0 113.844 -175.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 ttpt -78.19 -44.96 24.35 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 126.93 2.092 . . . . 0.0 110.415 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 49.0 t -62.05 -45.71 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.647 1.579 . . . . 0.0 108.233 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.01 -43.12 69.82 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.228 3.011 . . . . 0.0 113.058 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.43 -50.02 71.43 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 111.548 -2.569 . . . . 0.0 110.96 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.92 -45.7 86.14 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.758 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.69 -47.53 84.22 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.069 2.148 . . . . 0.0 113.885 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.33 85.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 113.145 -1.843 . . . . 0.0 111.527 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -66.54 -37.4 84.91 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.317 -178.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.5 mt -88.83 14.28 10.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 178.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 53.48 28.54 7.76 Favored 'General case' 0 CA--C 1.57 1.725 0 C-N-CA 126.602 1.961 . . . . 0.0 113.62 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -89.51 169.27 11.5 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.543 -168.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.384 0.0 OUTLIER -126.46 100.23 29.28 Favored Pre-proline 0 N--CA 1.476 0.828 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.389 0.0 OUTLIER -4.2 -83.59 0.0 OUTLIER 'Trans proline' 0 N--CA 1.485 1.027 1 C-N-CA 126.829 5.019 . . . . 0.0 121.016 -175.277 . . . . . . . . 4 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -86.25 42.59 1.0 Allowed 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 -167.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 47.1 ptt85 46.29 109.36 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 127.46 2.304 . . . . 0.0 116.669 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.5 m -83.84 71.0 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 119.703 -1.873 . . . . 0.0 106.781 169.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -119.67 25.85 9.74 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 113.498 -1.683 . . . . 0.0 114.606 -174.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -111.25 25.45 11.72 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 122.215 1.007 . . . . 0.0 112.31 -175.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.25 61.75 1.52 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 124.345 2.021 . . . . 0.0 110.444 -176.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 N--CA 1.486 1.37 0 CA-C-N 111.21 -2.723 . . . . 0.0 114.273 -172.252 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.304 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 116.833 2.16 . . . . 0.0 116.833 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.91 152.35 2.96 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-O 115.662 -2.113 . . . . 0.0 116.379 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -56.91 -22.55 46.62 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 C-N-CA 123.376 2.718 . . . . 0.0 118.65 -169.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.5 OUTLIER -150.5 143.76 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 104.886 -2.265 . . . . 0.0 104.886 177.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.274 1.1 p -66.96 97.08 0.46 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.4 mt -36.35 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.623 0 N-CA-C 118.882 2.919 . . . . 0.0 118.882 -176.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -54.94 -33.46 62.27 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.574 1.079 . . . . 0.0 110.863 167.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -56.44 -52.79 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.939 172.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.53 -44.89 90.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.652 0.66 . . . . 0.0 112.003 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.11 -50.03 74.9 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.37 -178.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.76 -43.23 80.34 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.339 1.856 . . . . 0.0 115.497 174.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -65.47 -34.63 78.73 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.468 1.107 . . . . 0.0 111.131 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -17.95 25.36 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.801 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.46 26.02 68.9 Favored Glycine 0 N--CA 1.485 1.935 0 C-N-CA 125.822 1.677 . . . . 0.0 113.038 174.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.4 p -129.64 108.38 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -169.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.8 p -17.27 145.93 0.0 OUTLIER 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 127.051 2.14 . . . . 0.0 114.516 -174.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -52.32 -46.67 66.1 Favored 'General case' 0 N--CA 1.52 3.042 0 O-C-N 119.758 -1.839 . . . . 0.0 114.129 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.54 -41.94 61.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.435 1.084 . . . . 0.0 112.516 177.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.2 m -57.33 -50.7 72.1 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.296 1.039 . . . . 0.0 111.998 177.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.5 t -65.16 -51.0 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.044 -176.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m -58.02 -32.79 68.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.385 1.074 . . . . 0.0 112.645 -177.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.9 mtp85 -65.28 -49.44 69.54 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 168.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.3 t -62.08 -38.11 80.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.707 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.3 t -48.65 -54.33 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.578 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -87.37 16.15 5.67 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.175 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.375 0.2 OUTLIER 69.19 -1.42 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 130.212 3.405 . . . . 0.0 118.494 177.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 5.83 51.32 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 109.738 -3.392 . . . . 0.0 118.086 -164.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t 63.58 -57.29 0.19 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 110.95 -2.841 . . . . 0.0 115.427 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -130.59 21.64 5.1 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -163.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.321 93.6 t -74.06 111.68 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 N-CA-C 119.509 3.152 . . . . 0.0 119.509 -160.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 m -13.16 132.34 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.27 -2.241 . . . . 0.0 116.074 -174.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.64 -55.43 11.29 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -172.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.16 -49.48 42.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 117.936 2.569 . . . . 0.0 117.936 173.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 61.6 m -55.96 -49.53 73.3 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.254 1.021 . . . . 0.0 108.609 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -47.68 83.15 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 176.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.05 79.83 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -79.65 -42.21 25.29 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 112.662 -2.063 . . . . 0.0 112.534 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.9 t -60.84 -50.81 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 174.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -55.9 -44.24 78.01 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.631 2.773 . . . . 0.0 112.738 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.8 -51.27 65.54 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.673 -2.058 . . . . 0.0 110.83 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.46 84.37 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 112.935 -1.939 . . . . 0.0 113.356 175.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 4.9 mtt -59.17 -49.32 78.3 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -174.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.87 98.12 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 111.865 -2.425 . . . . 0.0 113.131 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.12 -38.15 87.48 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 112.525 -2.125 . . . . 0.0 114.022 -176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.2 mt -94.91 21.82 7.17 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 126.717 2.007 . . . . 0.0 113.314 -174.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.59 25.98 13.86 Favored 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -98.48 166.45 11.35 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.075 -1.42 . . . . 0.0 108.311 -171.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.22 119.63 10.44 Favored Pre-proline 0 CA--C 1.55 0.952 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.995 -174.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -41.46 138.85 2.07 Favored 'Trans proline' 0 CA--C 1.554 1.514 0 C-N-CA 124.43 3.42 . . . . 0.0 113.932 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 41.11 66.31 0.68 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -165.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.98 81.42 1.73 Allowed 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 169.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 1.1 m -106.16 176.4 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.545 170.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.72 82.25 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 123.209 1.481 . . . . 0.0 113.777 175.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -125.82 14.36 8.01 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 113.535 -1.666 . . . . 0.0 112.464 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -90.08 64.97 6.36 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 124.42 2.057 . . . . 0.0 111.544 -178.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.7 mp . . . . . 0 N--CA 1.483 1.204 0 CA-C-N 111.625 -2.534 . . . . 0.0 113.737 -176.776 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 115.867 1.803 . . . . 0.0 115.867 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -166.55 114.32 0.72 Allowed Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 116.198 -1.858 . . . . 0.0 106.333 177.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -75.13 26.27 0.37 Allowed 'Trans proline' 0 C--N 1.355 0.875 0 N-CA-C 120.947 3.403 . . . . 0.0 120.947 -161.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.387 0.5 OUTLIER -178.11 151.47 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.123 0 CA-C-N 111.115 -2.766 . . . . 0.0 106.705 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 5.0 p -80.93 102.97 10.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 102.636 -3.098 . . . . 0.0 102.636 177.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -46.36 -13.79 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.829 0 N-CA-C 118.681 2.845 . . . . 0.0 118.681 -174.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -53.99 -32.75 55.04 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 118.44 0.564 . . . . 0.0 111.2 165.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -57.9 -50.27 73.92 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.2 t -59.27 -43.32 89.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 118.492 0.587 . . . . 0.0 111.771 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.19 -49.94 75.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.638 -175.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.79 -41.77 78.3 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.894 2.078 . . . . 0.0 114.718 175.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -63.9 -33.66 76.21 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.975 0.91 . . . . 0.0 110.88 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.89 -18.73 22.44 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-N 113.497 -1.683 . . . . 0.0 111.037 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.24 26.78 56.96 Favored Glycine 0 N--CA 1.487 2.088 0 C-N-CA 126.383 1.945 . . . . 0.0 113.703 173.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.1 p -125.6 114.84 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 124.326 1.051 . . . . 0.0 110.932 -170.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -21.73 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 128.636 2.774 . . . . 0.0 110.989 175.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -42.23 -40.55 2.44 Favored 'General case' 0 N--CA 1.52 3.052 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -50.35 -38.91 44.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.582 1.176 . . . . 0.0 113.611 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.256 24.3 p -62.7 -51.23 68.03 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 173.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.411 76.5 t -59.54 -41.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.867 0.867 . . . . 0.0 112.53 -167.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.72 -38.12 89.91 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.2 mtp85 -62.97 -38.54 91.51 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 172.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 97.2 t -56.97 -47.82 82.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 126.717 2.007 . . . . 0.0 108.824 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.37 -55.96 20.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 109.285 -3.598 . . . . 0.0 114.303 -169.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -82.92 0.5 44.09 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 125.464 1.728 . . . . 0.0 114.336 175.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 55.0 36.93 28.05 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 124.744 2.212 . . . . 0.0 110.184 -170.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.381 . . -68.79 84.14 0.3 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 118.821 2.897 . . . . 0.0 118.821 -165.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 57.8 p 80.43 -88.76 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.728 169.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -112.36 44.05 1.51 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.3 p -34.07 135.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 111.931 -2.395 . . . . 0.0 113.246 151.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.4 t -111.23 126.43 54.86 Favored 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -170.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.03 -59.66 1.67 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -47.37 83.41 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.6 m -58.4 -48.26 81.22 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 112.605 -2.088 . . . . 0.0 105.599 179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -39.42 76.07 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 113.798 -1.546 . . . . 0.0 115.06 -174.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -62.58 -40.82 98.12 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.453 -1.703 . . . . 0.0 114.269 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -75.56 -40.97 56.02 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.47 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.6 t -62.2 -48.92 86.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 127.486 2.314 . . . . 0.0 106.638 176.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -55.6 -43.31 75.93 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 128.409 2.683 . . . . 0.0 113.786 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.19 -51.65 62.71 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 110.73 -2.941 . . . . 0.0 110.4 172.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.87 -54.77 40.63 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.36 0.0 OUTLIER -64.29 -25.55 68.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 -174.66 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.17 -47.62 73.39 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.82 172.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.95 -34.2 75.68 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.588 1.555 . . . . 0.0 112.558 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.6 mt -95.68 7.24 46.84 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.304 2.642 . . . . 0.0 115.344 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.416 0.2 OUTLIER 60.4 14.57 4.83 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 178.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -73.44 105.37 4.78 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -52.0 119.58 14.54 Favored Pre-proline 0 N--CA 1.495 1.78 0 C-N-CA 118.484 -1.286 . . . . 0.0 112.741 163.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -47.52 139.0 18.24 Favored 'Trans proline' 0 CA--C 1.556 1.612 0 C-N-CA 123.127 2.551 . . . . 0.0 112.773 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.44 53.15 5.33 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 118.091 2.626 . . . . 0.0 118.091 -177.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.8 53.7 1.44 Allowed 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 161.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.9 t -135.99 84.69 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 N-CA-C 102.482 -3.155 . . . . 0.0 102.482 161.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -161.93 -63.83 0.05 Allowed 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 110.999 -2.819 . . . . 0.0 107.895 -167.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -92.68 43.6 1.13 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 124.141 1.924 . . . . 0.0 115.181 -169.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.52 -55.44 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 111.024 -2.807 . . . . 0.0 110.05 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 76.4 mt . . . . . 0 N--CA 1.493 1.692 0 CA-C-N 114.813 -1.085 . . . . 0.0 112.529 166.636 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 ppp? . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 77.4 tttt 61.36 61.95 2.73 Favored Pre-proline 0 CA--C 1.568 1.662 0 C-N-CA 122.639 0.376 . . . . 0.0 111.45 156.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -84.2 -21.02 3.93 Favored 'Trans proline' 0 N--CA 1.485 0.986 0 C-N-CA 117.521 -1.186 . . . . 0.0 114.438 141.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.416 0.4 OUTLIER -159.18 154.53 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 174.044 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -90.83 135.68 33.57 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 103.324 -2.843 . . . . 0.0 103.324 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.1 mt -54.91 -18.55 5.1 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 128.945 2.898 . . . . 0.0 116.053 -162.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -55.03 -33.57 62.78 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 119.566 1.076 . . . . 0.0 111.142 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -65.55 -47.83 74.52 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.169 176.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.5 t -55.79 -45.9 79.66 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 124.516 1.126 . . . . 0.0 112.625 173.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.05 -54.98 36.18 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 126.172 1.789 . . . . 0.0 112.671 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -38.07 89.75 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.123 1.769 . . . . 0.0 113.728 177.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.23 -34.8 78.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.022 1.329 . . . . 0.0 110.7 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.62 -4.57 55.11 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.13 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 70.15 23.45 77.21 Favored Glycine 0 N--CA 1.492 2.374 0 C-N-CA 127.274 2.368 . . . . 0.0 113.089 172.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.252 8.8 p -123.73 137.02 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -166.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 p -55.03 138.12 44.73 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.842 1.257 . . . . 0.0 109.013 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -49.95 -28.56 6.95 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -172.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 -46.96 -47.38 21.8 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 124.853 1.345 . . . . 0.0 112.292 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 65.3 p -58.78 -51.81 68.4 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.1 t -62.96 -51.82 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.817 1.647 . . . . 0.0 109.549 -173.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.8 t -59.13 -41.23 87.73 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.6 mtp85 -60.25 -45.2 94.08 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 113.804 -1.543 . . . . 0.0 114.854 173.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.6 t -57.56 -44.04 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.631 1.972 . . . . 0.0 109.277 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.0 t -58.07 -42.05 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 CA-C-N 111.315 -2.675 . . . . 0.0 112.491 -171.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -91.38 4.22 52.97 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 113.529 -1.668 . . . . 0.0 113.354 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? 58.1 17.18 4.31 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 128.852 2.861 . . . . 0.0 114.63 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.59 38.55 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 110.615 -2.993 . . . . 0.0 116.307 -174.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 97.6 p 55.36 -28.86 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 119.246 3.054 . . . . 0.0 119.246 -160.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -161.85 80.04 0.56 Allowed 'General case' 0 CA--C 1.564 1.501 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 -161.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -117.27 147.26 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 120.452 -1.405 . . . . 0.0 114.674 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.4 p -63.06 135.11 57.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.042 0.937 . . . . 0.0 113.458 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.15 -66.23 0.43 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.309 1.6 pptp? -48.02 -33.22 7.64 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 120.299 3.444 . . . . 0.0 120.299 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -61.77 -49.67 75.45 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.608 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.2 mtm105 -57.83 -46.89 84.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 175.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.39 -36.09 70.84 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -75.54 -44.1 45.27 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.493 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -63.93 -45.24 97.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.415 176.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -55.39 -43.78 75.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 129.532 3.133 . . . . 0.0 111.784 -177.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.11 -50.93 66.36 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.469 -1.696 . . . . 0.0 111.583 175.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.36 89.02 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 113.547 -1.66 . . . . 0.0 114.137 176.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.61 -45.21 85.64 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.926 1.69 . . . . 0.0 114.356 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.98 -46.31 85.18 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 113.553 -1.658 . . . . 0.0 111.035 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -64.81 -37.27 87.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 113.122 -1.854 . . . . 0.0 113.726 -178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.9 mt -96.37 17.82 15.2 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.94 2.496 . . . . 0.0 114.391 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.383 0.2 OUTLIER 51.41 21.74 1.28 Allowed 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 127.402 2.281 . . . . 0.0 115.772 177.436 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -74.72 154.72 38.29 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.436 -0.79 . . . . 0.0 110.54 -168.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -110.68 93.56 17.09 Favored Pre-proline 0 N--CA 1.473 0.718 0 CA-C-N 112.181 -2.282 . . . . 0.0 111.813 -179.023 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.267 0.1 OUTLIER -9.57 -73.49 0.0 OUTLIER 'Trans proline' 0 N--CA 1.482 0.843 1 C-N-CA 126.797 4.998 . . . . 0.0 117.059 -169.259 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.265 0.2 OUTLIER -80.42 120.48 24.49 Favored 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 174.687 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.367 0.0 OUTLIER -72.36 89.15 1.21 Allowed 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 172.478 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.5 m -85.86 40.21 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 118.072 2.619 . . . . 0.0 118.072 -160.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -167.51 28.53 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 112.647 -2.07 . . . . 0.0 111.774 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 49.07 -95.75 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.475 1.51 . . . . 0.0 111.267 -167.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 66.26 -45.03 0.41 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.939 1.696 . . . . 0.0 111.604 -173.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.484 1.236 0 C-N-CA 125.605 1.562 . . . . 0.0 114.041 -177.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 CA--C 1.565 1.555 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt 175.55 142.77 0.22 Allowed Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.927 2.091 . . . . 0.0 107.928 165.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -64.21 -26.94 64.43 Favored 'Trans proline' 0 C--N 1.357 0.978 0 CA-C-N 122.772 2.026 . . . . 0.0 116.905 -153.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.487 0.8 OUTLIER -167.77 145.16 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 102.121 -3.289 . . . . 0.0 102.121 -175.324 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -93.85 134.16 36.51 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.079 -1.013 . . . . 0.0 108.39 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.6 mt -48.45 -17.69 0.18 Allowed 'General case' 0 N--CA 1.511 2.603 0 N-CA-C 118.454 2.761 . . . . 0.0 118.454 -163.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -58.1 -35.38 71.35 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.78 0.718 . . . . 0.0 111.316 172.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -64.18 -45.77 86.92 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 117.525 -1.226 . . . . 0.0 111.339 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 71.2 t -57.61 -42.22 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 CA-C-N 119.052 0.842 . . . . 0.0 112.987 174.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.18 -52.98 61.62 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 111.646 -2.525 . . . . 0.0 111.748 -176.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.67 -38.07 83.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.202 2.201 . . . . 0.0 113.204 177.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -64.35 -35.39 80.73 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.417 1.487 . . . . 0.0 109.521 177.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.15 -18.32 24.67 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.876 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.44 29.54 57.95 Favored Glycine 0 N--CA 1.49 2.24 0 C-N-CA 126.391 1.948 . . . . 0.0 113.003 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.1 p -125.36 137.9 56.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 123.908 0.883 . . . . 0.0 109.028 -170.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.0 p -43.41 122.07 2.48 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 127.038 2.135 . . . . 0.0 107.852 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -33.05 -48.76 0.22 Allowed 'General case' 0 N--CA 1.524 3.241 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.554 0.0 OUTLIER -57.84 -20.98 40.11 Favored 'General case' 0 C--N 1.314 -0.963 1 N-CA-C 124.232 4.901 . . . . 0.0 124.232 -179.956 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.696 0.7 OUTLIER -76.56 -43.56 38.43 Favored 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 160.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.4 t -59.72 -49.39 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.635 -176.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.3 p -58.01 -44.43 87.26 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -173.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -60.36 -47.39 86.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 108.695 -3.866 . . . . 0.0 114.852 168.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.19 -40.66 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 68.5 t -53.62 -50.0 52.89 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 CA-C-N 113.914 -1.493 . . . . 0.0 112.966 -172.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.308 3.7 m120 -99.34 27.78 4.98 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 123.103 1.43 . . . . 0.0 114.706 170.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 71.31 -16.58 0.36 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 131.589 3.956 . . . . 0.0 116.583 173.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 45.18 37.93 2.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.113 2.165 . . . . 0.0 111.781 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.2 p 57.55 -46.34 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.751 -2.022 . . . . 0.0 115.821 -150.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -154.73 109.82 3.07 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.192 -165.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.3 t -132.97 132.55 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 120.628 1.558 . . . . 0.0 114.763 157.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -16.16 135.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 175.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.93 -49.08 79.08 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.559 1.144 . . . . 0.0 113.416 -173.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -44.2 43.65 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 175.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.0 m -62.03 -51.27 68.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 113.068 -1.878 . . . . 0.0 108.273 175.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.3 mtt-85 -53.87 -46.81 71.42 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.386 1.074 . . . . 0.0 113.856 178.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.88 -37.42 76.52 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.792 -1.095 . . . . 0.0 113.539 -176.274 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -76.44 -45.3 32.02 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.741 -2.027 . . . . 0.0 111.908 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.4 t -61.29 -47.91 91.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-N 113.884 -1.507 . . . . 0.0 108.513 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -58.53 -46.12 87.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.009 3.324 . . . . 0.0 111.503 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.54 -48.98 73.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 113.434 -1.712 . . . . 0.0 110.873 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.8 -43.94 86.01 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 112.95 -1.932 . . . . 0.0 112.661 173.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 9.9 mtt -55.04 -46.65 75.33 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 125.436 1.495 . . . . 0.0 112.169 -178.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -47.45 83.26 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 112.951 -1.931 . . . . 0.0 111.731 -175.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -61.03 -40.31 93.09 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 112.413 -2.176 . . . . 0.0 112.916 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 19.4 mt -87.13 6.23 33.81 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 128.393 2.677 . . . . 0.0 116.645 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.43 0.2 OUTLIER 52.6 23.1 2.45 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 128.09 2.556 . . . . 0.0 113.792 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.8 t80 -82.05 97.96 8.4 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 118.614 -2.554 . . . . 0.0 110.824 -172.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -32.91 121.7 0.43 Allowed Pre-proline 0 N--CA 1.494 1.726 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.633 155.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -65.54 48.17 0.2 Allowed 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.073 2.515 . . . . 0.0 118.0 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -171.73 93.33 0.15 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.046 -1.888 . . . . 0.0 114.341 176.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.0 ttp-105 -9.4 96.91 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.357 0 CA-C-N 113.779 -1.555 . . . . 0.0 111.417 146.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 16.1 m -107.31 39.39 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 174.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -86.39 16.16 4.75 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 111.921 -2.4 . . . . 0.0 113.232 -175.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -94.94 64.11 2.8 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 124.467 2.08 . . . . 0.0 114.116 -169.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -171.71 -24.75 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.705 1 CA-C-N 107.9 -4.227 . . . . 0.0 113.727 178.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 N--CA 1.484 1.261 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 169.945 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.8 mtt . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.5 mtpt -166.08 54.44 0.33 Allowed Pre-proline 0 N--CA 1.488 1.429 0 C-N-CA 126.793 2.037 . . . . 0.0 107.301 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.86 -28.86 79.13 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 122.463 2.109 . . . . 0.0 116.724 -165.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.327 0.5 OUTLIER -150.53 118.89 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 113.901 -1.5 . . . . 0.0 109.665 175.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 p -67.81 147.15 52.96 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -152.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.8 mt -48.89 -17.54 0.2 Allowed 'General case' 0 N--CA 1.517 2.889 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 -162.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -60.83 -40.58 93.32 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 118.596 0.635 . . . . 0.0 111.241 179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -51.81 -55.86 17.37 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.299 1.04 . . . . 0.0 112.057 166.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.6 t -58.94 -39.72 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.07 -55.57 33.18 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 126.384 1.873 . . . . 0.0 112.701 172.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -38.37 89.3 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.52 1.928 . . . . 0.0 114.237 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -64.57 -37.28 87.02 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.466 1.107 . . . . 0.0 109.808 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.17 -12.33 44.23 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.829 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 26.61 67.57 Favored Glycine 0 CA--C 1.549 2.169 0 C-N-CA 127.533 2.492 . . . . 0.0 113.337 172.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.0 p -124.06 132.08 71.9 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 123.909 0.883 . . . . 0.0 110.663 -171.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -36.79 127.76 0.86 Allowed 'General case' 0 N--CA 1.522 3.137 0 C-N-CA 126.638 1.975 . . . . 0.0 108.952 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -48.05 -33.0 7.41 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 115.848 1.795 . . . . 0.0 115.848 176.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -52.38 -46.19 66.11 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-O 117.115 -1.421 . . . . 0.0 111.315 175.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.905 0.6 OUTLIER -67.86 -40.01 83.68 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.963 2.209 . . . . 0.0 116.963 176.544 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.278 78.2 t -59.61 -46.79 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 117.294 -1.336 . . . . 0.0 110.279 -177.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.347 3.5 m -68.08 -29.7 68.71 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 120.358 3.466 . . . . 0.0 120.358 -174.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -63.91 -52.18 61.08 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 110.808 -2.905 . . . . 0.0 113.184 162.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 62.8 t -62.39 -42.27 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 C-N-CA 124.488 1.115 . . . . 0.0 110.255 -172.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 52.3 t -51.65 -54.87 10.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 O-C-N 125.418 1.699 . . . . 0.0 111.112 -162.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.289 17.7 m120 -105.89 42.01 1.32 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 113.948 -1.478 . . . . 0.0 112.858 176.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.384 10.6 pt20 80.97 -9.97 1.27 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.546 3.539 . . . . 0.0 118.417 163.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.36 30.55 0.08 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.717 2.007 . . . . 0.0 115.075 -168.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.9 p 61.02 -44.82 0.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 115.98 1.845 . . . . 0.0 115.98 -155.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.276 78.4 m80 -152.53 126.4 9.0 Favored 'General case' 0 CA--C 1.558 1.275 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -170.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.7 p -141.53 162.75 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.568 0 CA-C-N 120.157 1.344 . . . . 0.0 112.656 170.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -59.45 130.03 44.88 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 170.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.93 -59.53 4.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -175.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.6 tptp -41.41 -41.3 1.98 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.7 m -58.51 -47.0 85.59 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 113.639 -1.619 . . . . 0.0 109.173 -178.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.6 mmt85 -55.34 -45.19 76.43 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -35.13 76.05 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -78.55 -42.3 29.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 112.477 -2.147 . . . . 0.0 112.217 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.3 t -60.83 -50.8 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.007 1.723 . . . . 0.0 108.059 173.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -54.95 -44.9 74.77 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 125.327 1.451 . . . . 0.0 112.922 -178.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.89 -49.26 71.18 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 112.479 -2.146 . . . . 0.0 111.213 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.17 -45.59 83.52 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 113.581 -1.645 . . . . 0.0 113.249 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.1 mmt -60.11 -47.39 86.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.667 -1.151 . . . . 0.0 114.019 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 113.27 -1.786 . . . . 0.0 111.449 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -64.78 -40.62 95.56 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.027 -2.351 . . . . 0.0 112.358 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.78 6.67 26.93 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 127.81 2.444 . . . . 0.0 112.517 -178.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.474 0.2 OUTLIER 44.16 34.05 0.92 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -171.257 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -98.34 88.46 4.16 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 111.324 -2.671 . . . . 0.0 108.778 -166.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -6.64 114.56 0.03 OUTLIER Pre-proline 0 N--CA 1.496 1.853 0 CA-C-N 111.65 -2.523 . . . . 0.0 114.219 155.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -68.29 57.92 0.94 Allowed 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 122.339 2.026 . . . . 0.0 116.668 173.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -169.96 -177.28 2.55 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.636 1.974 . . . . 0.0 110.786 168.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -132.92 96.48 3.79 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.362 1.065 . . . . 0.0 108.538 177.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.84 135.79 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 N-CA-C 104.211 -2.515 . . . . 0.0 104.211 163.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.85 100.61 0.96 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 119.298 0.954 . . . . 0.0 110.962 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -74.02 -38.16 64.13 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 113.115 -1.857 . . . . 0.0 110.834 171.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.58 77.76 7.15 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 113.136 -1.847 . . . . 0.0 106.118 173.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 N--CA 1.483 1.215 0 CA-C-N 111.577 -2.556 . . . . 0.0 115.165 173.082 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptt? . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 115.646 1.721 . . . . 0.0 115.646 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.349 0.2 OUTLIER 49.33 127.63 0.0 OUTLIER Pre-proline 0 CA--C 1.577 2.005 0 N-CA-C 118.965 2.95 . . . . 0.0 118.965 159.942 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -76.0 24.45 0.43 Allowed 'Trans proline' 0 C--N 1.361 1.197 0 N-CA-C 120.331 3.166 . . . . 0.0 120.331 -176.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.5 OUTLIER -176.7 148.12 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 N-CA-C 102.578 -3.119 . . . . 0.0 102.578 -176.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.337 0.8 OUTLIER -71.09 106.09 3.6 Favored 'General case' 0 CA--C 1.563 1.475 0 N-CA-C 101.75 -3.426 . . . . 0.0 101.75 -179.392 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.7 mt -45.48 -16.3 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.894 0 N-CA-C 118.341 2.719 . . . . 0.0 118.341 -179.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.314 56.4 m-85 -54.54 -32.5 58.37 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.621 1.555 . . . . 0.0 111.447 166.395 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -60.19 -49.67 76.71 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.327 175.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.98 -46.25 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 174.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.75 -49.51 77.44 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 111.67 -2.513 . . . . 0.0 111.66 -176.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.89 -43.09 80.14 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.629 2.372 . . . . 0.0 114.678 177.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -63.24 -32.89 74.41 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.864 0.728 . . . . 0.0 110.601 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.75 -16.44 25.43 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 113.94 -1.482 . . . . 0.0 111.723 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.77 25.78 66.5 Favored Glycine 0 CA--C 1.55 2.24 0 C-N-CA 126.56 2.028 . . . . 0.0 113.618 173.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.276 4.3 p -129.94 125.12 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.511 0 C-N-CA 124.115 0.966 . . . . 0.0 108.394 -167.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -32.96 139.26 0.05 Allowed 'General case' 0 N--CA 1.526 3.37 0 C-N-CA 127.507 2.323 . . . . 0.0 111.274 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -52.52 -41.73 63.71 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-N 121.117 1.78 . . . . 0.0 115.047 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.529 0.0 OUTLIER -61.77 -30.51 70.84 Favored 'General case' 0 C--N 1.318 -0.77 1 N-CA-C 122.718 4.34 . . . . 0.0 122.718 175.331 . . . . . . . . 4 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.4 m -55.19 -49.34 72.16 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 112.801 -2.0 . . . . 0.0 109.581 162.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.284 73.9 t -64.67 -48.06 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.772 -178.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.338 3.3 m -63.37 -33.24 75.12 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 20.7 mtt85 -60.9 -48.84 79.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.085 -1.87 . . . . 0.0 114.354 167.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.07 -39.98 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.695 1.198 . . . . 0.0 108.954 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.1 t -55.28 -42.53 66.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-N 113.53 -1.668 . . . . 0.0 112.996 -170.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.12 19.4 19.62 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 171.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.28 0.7 OUTLIER 65.47 11.65 7.56 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 129.459 3.104 . . . . 0.0 118.731 176.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.73 42.08 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 110.57 -3.014 . . . . 0.0 116.096 -173.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.275 69.7 m 58.14 -44.45 0.05 Allowed 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 117.906 2.558 . . . . 0.0 117.906 -165.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -152.68 101.32 2.62 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.276 4.2 p -132.04 147.82 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -57.21 143.09 40.53 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -172.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.35 -67.16 0.31 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -40.63 66.77 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -177.123 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 36.8 m -56.95 -52.47 65.09 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 113.058 -1.883 . . . . 0.0 106.938 177.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm105 -61.39 -48.55 80.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.792 1.237 . . . . 0.0 114.265 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.11 86.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.294 1.837 . . . . 0.0 114.826 -176.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -75.43 -42.84 52.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 112.059 -2.337 . . . . 0.0 110.761 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.78 -49.83 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 CA-C-N 114.187 -1.37 . . . . 0.0 107.76 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.39 -46.42 73.08 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 126.661 1.985 . . . . 0.0 112.599 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.61 80.75 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 112.361 -2.2 . . . . 0.0 111.134 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.23 -39.97 80.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.584 -2.098 . . . . 0.0 113.293 173.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 30.5 mtt -61.01 -52.11 66.39 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -172.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.28 -41.33 85.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.254 -1.793 . . . . 0.0 113.673 174.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -59.46 -37.83 79.2 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 113.402 -1.726 . . . . 0.0 113.45 -178.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.9 mt -91.99 26.06 2.6 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 52.38 33.6 13.28 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.82 1.772 . . . . 0.0 114.139 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 66.3 t80 -101.45 -177.49 3.45 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.423 1.489 . . . . 0.0 109.751 -174.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 47' ' ' TYR 0.258 0.0 OUTLIER -145.39 113.37 4.76 Favored Pre-proline 0 N--CA 1.485 1.31 0 CA-C-O 117.374 -1.298 . . . . 0.0 108.683 -177.24 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -54.38 34.79 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.454 2 N-CA-C 124.685 4.84 . . . . 0.0 124.685 -170.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.28 16.09 2.05 Favored 'General case' 0 N--CA 1.489 1.513 1 N-CA-C 121.998 4.073 . . . . 0.0 121.998 176.626 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 33.31 74.96 0.05 Allowed 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 122.605 1.193 . . . . 0.0 111.247 -169.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.79 107.1 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 -170.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -40.06 125.45 1.97 Allowed 'General case' 0 N--CA 1.506 2.358 0 CA-C-O 123.695 1.712 . . . . 0.0 111.846 167.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 4.84 70.2 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 119.218 3.044 . . . . 0.0 119.218 -155.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.298 1.7 mp0 69.71 -25.01 0.15 Allowed 'General case' 0 N--CA 1.498 1.958 0 CA-C-N 110.785 -2.916 . . . . 0.0 115.757 172.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.0 tp . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 152.336 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.3 mtt . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -174.27 156.21 2.35 Favored Pre-proline 0 CA--C 1.563 1.452 0 C-N-CA 127.398 2.279 . . . . 0.0 108.583 179.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -95.97 -25.58 0.11 Allowed 'Trans proline' 0 N--CA 1.488 1.178 0 CA-C-N 123.797 2.392 . . . . 0.0 115.426 -170.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER -155.02 137.78 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 -167.544 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.2 p -61.45 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 174.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.7 mt -35.17 -16.89 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.347 0 N-CA-C 119.596 3.184 . . . . 0.0 119.596 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -53.34 -33.89 55.35 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.407 0.683 . . . . 0.0 110.899 164.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -57.23 -50.6 72.37 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 172.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.6 t -59.95 -43.12 91.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 123.252 0.621 . . . . 0.0 112.592 173.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.78 -55.11 39.4 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 112.065 -2.334 . . . . 0.0 112.175 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.24 -40.59 90.33 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.717 2.007 . . . . 0.0 115.049 177.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -65.22 -35.76 82.05 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.964 0.887 . . . . 0.0 110.73 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.11 -19.33 27.17 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 113.632 -1.622 . . . . 0.0 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 26.19 57.93 Favored Glycine 0 CA--C 1.545 1.951 0 C-N-CA 126.793 2.139 . . . . 0.0 113.001 172.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.6 p -119.56 126.4 75.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 125.325 1.45 . . . . 0.0 110.605 -171.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.2 p -28.3 121.4 0.12 Allowed 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 129.154 2.982 . . . . 0.0 110.476 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -44.46 -45.1 8.97 Favored 'General case' 0 N--CA 1.521 3.091 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.665 0.6 OUTLIER -56.56 -18.63 12.4 Favored 'General case' 0 C--N 1.321 -0.643 1 N-CA-C 125.265 5.283 . . . . 0.0 125.265 176.22 . . . . . . . . 4 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 71.0 p -64.66 -53.01 54.13 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 113.714 -1.584 . . . . 0.0 113.65 159.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.25 80.1 t -60.99 -50.86 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 O-C-N 121.106 -0.996 . . . . 0.0 110.87 -164.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.29 13.8 m -59.76 -35.18 74.08 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -179.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.2 mtt85 -67.23 -42.73 83.54 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 112.055 -2.339 . . . . 0.0 117.103 170.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.63 -43.13 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 125.813 1.645 . . . . 0.0 108.161 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.2 t -49.04 -49.45 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.289 0 O-C-N 125.708 1.88 . . . . 0.0 111.416 -171.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.377 14.3 m120 -106.46 29.85 6.51 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 18.3 tt0 61.05 17.76 8.3 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 129.493 3.117 . . . . 0.0 115.604 170.372 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.58 39.88 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 111.735 -2.484 . . . . 0.0 116.998 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.257 86.1 p 61.01 -56.72 0.09 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 126.313 1.845 . . . . 0.0 113.663 -163.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.288 98.8 m-70 -138.26 115.49 11.04 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.969 167.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 p -127.17 156.11 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 172.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.9 p -54.63 134.71 47.01 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 174.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.99 -53.28 57.83 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -175.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -48.4 -41.71 29.79 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -56.46 -48.72 76.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 114.271 -1.331 . . . . 0.0 107.881 176.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -59.22 -42.64 91.46 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 117.72 2.489 . . . . 0.0 117.72 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -36.07 76.13 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 113.479 -1.691 . . . . 0.0 115.445 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -77.99 -44.56 26.3 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 111.949 -2.387 . . . . 0.0 111.283 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.6 t -64.25 -45.36 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 113.803 -1.544 . . . . 0.0 108.636 177.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -58.44 -42.09 86.53 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.565 3.146 . . . . 0.0 112.985 -177.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -52.03 65.06 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 112.585 -2.098 . . . . 0.0 109.843 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.66 -38.15 74.6 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 113.285 -1.78 . . . . 0.0 114.999 175.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 36.3 mtt -59.81 -53.21 60.61 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.04 94.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 113.07 -1.877 . . . . 0.0 112.386 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.42 -37.29 86.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 112.619 -2.082 . . . . 0.0 113.732 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.5 mt -98.75 20.76 12.46 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 126.455 1.902 . . . . 0.0 113.539 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 56.72 25.24 9.91 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 116.52 2.045 . . . . 0.0 116.52 175.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -86.82 170.83 11.35 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.294 -172.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.25 113.41 3.84 Favored Pre-proline 0 CA--C 1.547 0.836 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.861 -170.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -68.6 57.77 1.03 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.615 2.21 . . . . 0.0 117.39 -171.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -175.46 83.75 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 113.737 -1.574 . . . . 0.0 110.419 175.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.461 0.0 OUTLIER -124.91 87.57 2.74 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.848 -1.157 . . . . 0.0 110.824 -174.711 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.385 9.9 m -50.28 -48.43 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 N-CA-C 117.843 2.534 . . . . 0.0 117.843 -170.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -104.92 58.84 0.69 Allowed 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 124.339 2.018 . . . . 0.0 107.972 -175.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . 0.29 0.1 OUTLIER -55.04 113.34 1.32 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 111.224 -2.717 . . . . 0.0 113.674 -175.393 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 58.92 30.44 20.17 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 110.962 -2.835 . . . . 0.0 113.632 -178.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.3 mt . . . . . 0 N--CA 1.474 0.727 0 CA-C-N 112.775 -2.012 . . . . 0.0 114.281 172.293 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.303 15.3 ptt? . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -155.41 146.81 16.79 Favored Pre-proline 0 CA--C 1.554 1.102 0 CA-C-O 118.14 -0.933 . . . . 0.0 111.367 175.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -46.63 140.2 12.61 Favored 'Trans proline' 0 CA--C 1.551 1.34 0 C-N-CA 124.012 3.141 . . . . 0.0 117.146 -135.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 52.22 -6.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.728 1 N-CA-C 122.388 4.218 . . . . 0.0 122.388 171.011 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.31 7.0 t 71.82 149.59 0.09 Allowed 'General case' 0 N--CA 1.491 1.602 1 C-N-CA 133.92 4.888 . . . . 0.0 117.587 -177.862 . . . . . . . . 3 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.9 mt -62.55 -27.85 69.45 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -58.1 -37.54 74.71 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.876 0.871 . . . . 0.0 109.695 172.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -64.94 -49.51 70.08 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.885 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -43.34 90.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.1 -46.53 82.5 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.415 1.886 . . . . 0.0 113.214 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.54 -43.96 71.9 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 126.315 1.846 . . . . 0.0 115.673 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -64.55 -33.22 75.4 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.559 0.695 . . . . 0.0 110.546 177.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.38 -20.64 23.73 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.555 -1.657 . . . . 0.0 111.568 -179.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.18 27.9 61.18 Favored Glycine 0 N--CA 1.489 2.229 0 C-N-CA 125.524 1.535 . . . . 0.0 112.773 171.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.255 8.6 p -132.28 120.94 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.476 0.71 . . . . 0.0 109.727 -167.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.6 p -26.35 139.67 0.01 OUTLIER 'General case' 0 N--CA 1.524 3.27 0 C-N-CA 128.233 2.613 . . . . 0.0 110.623 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -54.51 -34.8 62.31 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 119.483 -2.011 . . . . 0.0 114.728 178.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -53.51 -44.69 69.29 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.909 0.756 . . . . 0.0 111.62 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 36.6 m -55.13 -52.53 62.98 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.958 1.303 . . . . 0.0 111.127 176.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 76.9 t -65.33 -50.83 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.393 -0.813 . . . . 0.0 110.911 -175.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.384 7.6 m -63.15 -31.15 72.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 118.453 2.76 . . . . 0.0 118.453 -178.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.6 mtp85 -60.01 -48.85 80.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.356 -2.657 . . . . 0.0 115.121 164.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.8 t -59.72 -45.11 94.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 124.949 1.3 . . . . 0.0 108.797 -179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.8 t -53.14 -44.69 52.64 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 112.753 -2.021 . . . . 0.0 112.108 -171.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.285 11.1 m120 -104.22 25.82 9.6 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 173.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.87 19.99 7.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.668 2.787 . . . . 0.0 115.997 172.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.79 45.64 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 111.371 -2.65 . . . . 0.0 116.699 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 88.5 p 59.44 -52.93 0.06 Allowed 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 126.129 1.772 . . . . 0.0 114.802 -162.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.8 m170 -138.44 117.15 12.25 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.3 p -118.18 147.56 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 172.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 p -61.92 139.43 58.39 Favored 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.43 -66.53 0.39 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.271 0.0 OUTLIER -52.94 -34.07 53.74 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -62.48 -50.89 69.65 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -57.69 -46.91 83.7 Favored 'General case' 0 N--CA 1.434 -1.254 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 175.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.03 -36.35 65.42 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -175.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -74.56 -44.61 50.18 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.748 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.1 t -66.6 -50.01 70.03 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 113.677 -1.602 . . . . 0.0 109.606 177.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -49.77 -45.59 49.82 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.648 3.179 . . . . 0.0 111.394 178.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.15 77.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 111.404 -2.634 . . . . 0.0 110.887 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.61 -46.67 88.82 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 113.356 -1.747 . . . . 0.0 114.965 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.55 -45.41 81.26 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.342 1.857 . . . . 0.0 113.662 -177.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.42 78.58 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.177 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.42 -43.28 94.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 112.612 -2.085 . . . . 0.0 113.104 -177.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 mt -81.15 14.09 2.5 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.333 1.2 p-10 50.28 41.85 24.88 Favored 'General case' 0 CA--C 1.574 1.893 0 CA-C-O 122.777 1.275 . . . . 0.0 113.338 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -105.11 179.41 4.28 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 114.83 -1.077 . . . . 0.0 108.916 -173.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.272 0.0 OUTLIER -148.73 108.65 3.53 Favored Pre-proline 0 N--CA 1.481 1.082 0 O-C-N 121.36 -0.838 . . . . 0.0 112.1 -174.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -47.82 104.04 0.07 OUTLIER 'Trans proline' 0 CA--C 1.555 1.534 1 C-N-CA 125.408 4.072 . . . . 0.0 111.321 -176.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.404 ' ND2' ' N ' ' A' ' 51' ' ' ARG . 0.1 OUTLIER 172.15 -57.31 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 125.59 1.556 . . . . 0.0 114.061 168.007 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.404 ' N ' ' ND2' ' A' ' 50' ' ' ASN 0.352 13.0 tpp85 71.72 -28.18 0.18 Allowed 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 126.912 2.085 . . . . 0.0 115.388 -173.781 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 9.5 p -66.08 -31.12 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 1 N-CA-C 123.365 4.58 . . . . 0.0 123.365 -179.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -86.23 65.14 8.93 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-O 122.974 1.368 . . . . 0.0 110.412 -178.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -74.78 107.5 6.91 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 112.484 -2.143 . . . . 0.0 114.519 -173.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 56.82 20.25 5.06 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 125.635 1.835 . . . . 0.0 113.7 -164.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.9 tp . . . . . 0 N--CA 1.479 1.02 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.869 -171.564 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.0 mtt . . . . . 0 N--CA 1.485 1.295 0 N-CA-C 116.633 2.086 . . . . 0.0 116.633 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.51 155.5 8.51 Favored Pre-proline 0 CA--C 1.563 1.456 0 CA-C-O 115.991 -1.957 . . . . 0.0 110.584 -179.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -45.73 -43.7 18.57 Favored 'Trans proline' 0 N--CA 1.488 1.172 0 C-N-CA 123.435 2.756 . . . . 0.0 117.612 -157.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.8 OUTLIER -152.06 140.44 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 -177.716 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.307 2.7 p -71.07 94.14 1.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 105.616 -1.994 . . . . 0.0 105.616 -175.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.9 mt -27.87 -16.66 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 1 N-CA-C 123.028 4.455 . . . . 0.0 123.028 177.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -56.5 -36.45 69.17 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 118.97 0.805 . . . . 0.0 111.158 165.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.02 -52.25 59.06 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 172.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.22 -45.93 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.166 0.987 . . . . 0.0 112.387 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.45 79.4 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.238 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -44.48 76.67 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 115.296 175.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -63.59 -33.53 75.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.993 1.317 . . . . 0.0 111.248 178.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.63 -15.35 25.44 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.92 -1.491 . . . . 0.0 111.21 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.95 26.69 68.32 Favored Glycine 0 N--CA 1.494 2.504 0 C-N-CA 125.949 1.738 . . . . 0.0 112.6 171.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.5 p -131.78 117.68 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.478 1.111 . . . . 0.0 108.441 -168.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.7 p -22.24 142.87 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.984 0 C-N-CA 127.066 2.146 . . . . 0.0 112.73 -174.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.25 83.3 t80 -50.73 -42.89 57.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 119.919 -1.738 . . . . 0.0 114.295 171.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -52.52 -41.9 63.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 123.872 0.733 . . . . 0.0 112.754 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.4 m -56.55 -51.86 66.97 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.75 175.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.328 86.9 t -64.91 -45.39 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 118.085 -0.959 . . . . 0.0 112.4 -173.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 3.7 m -63.57 -36.0 82.36 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -178.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -60.17 -47.45 85.89 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 167.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.3 t -59.98 -39.59 80.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.668 -178.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.9 t -53.06 -50.94 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 CA-C-N 113.898 -1.501 . . . . 0.0 112.293 -171.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -84.45 7.46 19.68 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 171.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 62.66 14.24 7.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 128.091 2.557 . . . . 0.0 113.781 -177.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.05 42.53 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 111.937 -2.392 . . . . 0.0 115.967 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.4 m 56.25 -36.1 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -165.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.281 79.1 m80 -157.29 103.25 1.97 Allowed 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 -178.14 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.98 156.88 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 120.093 -1.629 . . . . 0.0 114.53 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -60.57 136.26 58.0 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.21 -53.84 50.96 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -175.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.32 -38.97 66.59 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 177.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.7 m -62.07 -52.02 65.63 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 mtm105 -56.82 -45.07 82.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 178.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -61.38 -35.71 78.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.141 -1.845 . . . . 0.0 114.039 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -75.63 -42.12 52.44 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 111.712 -2.494 . . . . 0.0 111.046 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.3 t -61.77 -48.37 88.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 125.347 1.459 . . . . 0.0 107.399 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -55.02 -41.33 71.18 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 128.105 2.562 . . . . 0.0 113.78 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.42 -51.04 61.08 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 111.698 -2.501 . . . . 0.0 111.447 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.29 -43.41 88.02 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 113.689 -1.596 . . . . 0.0 113.936 178.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -47.55 82.74 Favored 'General case' 0 CA--C 1.598 2.805 0 C-N-CA 128.805 2.842 . . . . 0.0 111.297 -176.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.01 82.9 Favored 'General case' 0 C--N 1.318 -0.767 0 O-C-N 126.439 2.337 . . . . 0.0 111.771 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -65.99 -41.41 91.15 Favored 'General case' 0 CA--C 1.586 2.346 0 C-N-CA 126.447 1.899 . . . . 0.0 111.94 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.4 mt -88.54 13.21 12.54 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.689 1.996 . . . . 0.0 114.649 -178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.267 2.2 p-10 56.76 32.33 21.05 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-N 114.202 -1.363 . . . . 0.0 114.535 176.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -94.79 174.28 7.18 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -175.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -147.92 115.76 4.08 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-O 118.367 -0.825 . . . . 0.0 109.138 -178.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -37.76 145.68 0.13 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 124.275 3.317 . . . . 0.0 114.402 -177.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 m120 36.79 37.68 0.07 Allowed 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 121.335 3.828 . . . . 0.0 121.335 -168.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -92.16 69.35 5.24 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.97 171.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.5 m -64.98 167.56 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.515 2.776 0 CA-C-N 112.517 -2.129 . . . . 0.0 111.005 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.65 113.8 1.98 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.994 -1.066 . . . . 0.0 113.307 171.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -127.17 -50.7 1.42 Allowed 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 113.287 -1.779 . . . . 0.0 110.549 -174.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.265 7.0 mp0 -69.37 115.21 8.38 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 122.79 1.281 . . . . 0.0 114.37 166.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.4 tp . . . . . 0 CA--C 1.551 0.988 0 CA-C-N 112.859 -1.973 . . . . 0.0 114.608 -168.828 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.357 0 N-CA-C 118.312 2.708 . . . . 0.0 118.312 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 5.51 0.0 OUTLIER Pre-proline 0 CA--C 1.562 1.408 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -174.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . 0.399 0.2 OUTLIER -1.73 -23.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.95 2 N-CA-C 126.923 5.701 . . . . 0.0 126.923 -130.266 . . . . . . . . 4 3 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.466 0.4 OUTLIER -143.84 148.83 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 127.052 2.141 . . . . 0.0 106.517 -172.228 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.258 1.6 p -68.94 90.71 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.9 mt -34.99 -14.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 -175.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -56.24 -29.94 61.72 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.183 0.901 . . . . 0.0 112.826 164.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -54.86 -50.56 68.36 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 168.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.41 -44.21 95.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 123.09 0.556 . . . . 0.0 111.889 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.1 -48.7 80.63 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.17 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -42.41 88.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.519 1.928 . . . . 0.0 114.902 176.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -66.52 -32.68 74.19 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.913 1.285 . . . . 0.0 111.434 177.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.63 -8.24 47.77 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.686 1.194 . . . . 0.0 111.674 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.59 20.53 79.83 Favored Glycine 0 N--CA 1.496 2.7 0 C-N-CA 126.92 2.2 . . . . 0.0 113.04 171.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.23 127.19 65.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.239 0.616 . . . . 0.0 112.253 -164.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -27.95 128.72 0.06 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 127.717 2.407 . . . . 0.0 110.53 176.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -42.81 -36.0 1.34 Allowed 'General case' 0 N--CA 1.521 3.111 0 C-N-CA 124.998 1.319 . . . . 0.0 114.111 177.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -51.18 -43.67 61.37 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.247 177.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.9 p -59.19 -54.31 48.34 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 176.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.5 t -61.33 -49.64 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 125.248 1.419 . . . . 0.0 109.951 -172.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.0 p -53.54 -47.06 70.33 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.381 1.473 . . . . 0.0 113.674 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -60.37 -45.66 92.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 110.754 -2.93 . . . . 0.0 116.985 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.4 t -62.55 -39.88 86.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.242 -178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 78.2 t -51.55 -55.09 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 113.312 -1.767 . . . . 0.0 112.486 -175.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.291 34.3 m120 -92.29 22.87 4.19 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 175.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 20.4 tt0 67.09 1.2 2.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 128.349 2.66 . . . . 0.0 117.433 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.21 35.81 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 111.675 -2.511 . . . . 0.0 116.827 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 59.24 -43.95 0.07 Allowed 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 117.97 2.582 . . . . 0.0 117.97 -167.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.274 69.3 m80 -152.49 103.59 2.83 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -174.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -123.29 151.7 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 171.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 p -67.48 145.93 54.48 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 -175.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.1 -73.87 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.292 0.0 OUTLIER -51.21 -28.9 12.56 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 119.832 3.271 . . . . 0.0 119.832 179.564 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.7 m -65.05 -56.97 9.96 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 175.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtm105 -55.35 -51.35 67.07 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.65 -34.64 62.48 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -175.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.19 -51.06 11.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.806 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.5 t -58.8 -46.39 90.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 125.86 1.664 . . . . 0.0 108.177 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.0 -44.11 91.61 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.147 2.179 . . . . 0.0 116.208 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.9 -50.01 70.41 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.626 -2.079 . . . . 0.0 110.511 174.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.15 -37.88 75.53 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 112.283 -2.235 . . . . 0.0 114.866 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 35.0 mtt -59.56 -51.29 70.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.21 -40.38 95.91 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 112.43 -2.168 . . . . 0.0 111.818 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.13 -41.07 95.15 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.783 -2.008 . . . . 0.0 113.495 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.1 mt -98.94 25.14 6.93 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 127.031 2.132 . . . . 0.0 112.24 -175.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.41 21.12 10.75 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 117.698 2.481 . . . . 0.0 117.698 173.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -87.93 159.64 18.26 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.518 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.21 104.9 7.21 Favored Pre-proline 0 N--CA 1.478 0.944 0 CA-C-N 112.347 -2.206 . . . . 0.0 108.504 -171.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -36.14 109.61 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.68 1 C-N-CA 125.771 4.314 . . . . 0.0 113.499 -173.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 134.35 -53.28 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 C-N-CA 127.512 2.325 . . . . 0.0 113.904 157.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -4.82 89.68 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 127.129 2.172 . . . . 0.0 111.294 161.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.3 m -63.28 142.83 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -148.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.72 75.12 3.38 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 124.232 1.968 . . . . 0.0 113.627 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -119.12 -47.82 2.46 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 111.521 -2.581 . . . . 0.0 108.746 177.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.86 84.4 5.81 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 124.265 1.983 . . . . 0.0 110.655 172.236 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 N--CA 1.48 1.026 0 CA-C-N 110.535 -3.03 . . . . 0.0 115.461 -157.939 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.7 mtp . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 116.182 1.919 . . . . 0.0 116.182 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -164.51 -170.06 0.23 Allowed Pre-proline 0 CA--C 1.562 1.437 0 CA-C-O 116.44 -1.743 . . . . 0.0 110.244 175.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -58.13 94.49 0.07 OUTLIER 'Trans proline' 0 C--N 1.359 1.102 0 CA-C-N 122.674 1.991 . . . . 0.0 109.335 153.084 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.4 OUTLIER 68.96 112.61 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 127.403 2.281 . . . . 0.0 112.765 165.554 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -77.31 145.26 37.5 Favored 'General case' 0 CA--C 1.556 1.204 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 -169.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.2 mt -61.92 0.92 0.32 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 121.429 3.863 . . . . 0.0 121.429 -155.236 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -58.37 -38.18 76.76 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 119.539 1.063 . . . . 0.0 110.997 174.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -61.69 -46.96 87.48 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 114.935 -1.03 . . . . 0.0 113.14 173.566 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.23 -45.36 96.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.463 1.105 . . . . 0.0 112.827 174.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.12 -54.0 48.74 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.026 2.13 . . . . 0.0 112.35 176.247 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.28 -37.96 86.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.126 1.371 . . . . 0.0 114.266 177.855 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -67.98 -34.41 76.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 123.505 0.503 . . . . 0.0 110.317 179.34 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.57 -19.55 27.67 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.277 178.583 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.56 29.17 53.49 Favored Glycine 0 N--CA 1.486 2.016 0 C-N-CA 127.007 2.241 . . . . 0.0 113.704 174.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.296 8.5 p -130.21 130.58 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.623 0 C-N-CA 123.563 0.745 . . . . 0.0 109.12 -175.706 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.6 p -44.29 142.17 1.61 Allowed 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 128.658 2.783 . . . . 0.0 110.381 -173.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -48.84 -47.94 42.15 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 117.489 2.403 . . . . 0.0 117.489 -170.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.558 0.0 OUTLIER -56.57 -25.34 52.1 Favored 'General case' 0 C--N 1.322 -0.607 1 N-CA-C 124.359 4.948 . . . . 0.0 124.359 179.835 . . . . . . . . 4 3 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.1 m -58.13 -53.13 61.74 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 111.608 -2.542 . . . . 0.0 111.512 165.501 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.0 t -63.77 -49.57 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.46 -169.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.446 1.0 OUTLIER -58.32 -37.95 76.14 Favored 'General case' 0 CA--C 1.466 -2.278 0 N-CA-C 119.106 3.002 . . . . 0.0 119.106 176.247 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mtt85 -63.54 -44.38 94.35 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 110.412 -3.086 . . . . 0.0 114.78 169.012 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 99.4 t -61.19 -42.87 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.091 -1.413 . . . . 0.0 110.342 -176.6 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.88 -50.01 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 112.899 -1.955 . . . . 0.0 112.395 -168.292 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -91.72 17.48 8.89 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 171.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 67.49 11.74 8.53 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.99 2.916 . . . . 0.0 114.85 172.326 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.9 40.03 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 127.723 2.409 . . . . 0.0 116.441 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.6 p 57.91 -34.67 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -160.227 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -157.6 99.32 1.72 Allowed 'General case' 0 CA--C 1.564 1.487 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -168.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 4.6 p -137.96 152.88 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 175.551 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.5 p -61.29 145.32 51.8 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -173.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.36 -63.83 1.0 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.574 1.949 . . . . 0.0 113.359 -177.323 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.254 11.6 tptp -56.96 -42.01 79.35 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.6 m -57.82 -50.49 73.09 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 113.344 -1.753 . . . . 0.0 108.054 178.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.8 mtm105 -57.05 -48.88 77.47 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 174.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.47 -34.47 74.07 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 113.708 -1.587 . . . . 0.0 114.896 -176.199 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -78.47 -43.19 27.72 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.212 2.205 . . . . 0.0 111.001 -179.434 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.3 t -63.24 -46.79 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.095 174.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -52.76 -45.51 67.12 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 126.452 1.901 . . . . 0.0 111.966 179.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.56 -52.5 60.8 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 110.582 -3.008 . . . . 0.0 111.037 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.33 -52.16 65.82 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 112.85 -1.977 . . . . 0.0 115.674 178.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.264 0.0 OUTLIER -59.98 -33.32 71.8 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -178.111 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.91 -50.62 63.82 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.542 179.471 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -62.76 -33.77 75.85 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.521 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 62.0 mt -99.14 14.64 28.66 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.425 2.29 . . . . 0.0 116.951 -177.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.353 0.2 OUTLIER 54.48 19.33 2.31 Favored 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 127.127 2.171 . . . . 0.0 116.776 176.309 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -82.99 95.4 8.0 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -51.67 124.32 26.08 Favored Pre-proline 0 N--CA 1.484 1.273 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 172.509 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -68.43 71.35 0.95 Allowed 'Trans proline' 0 CA--C 1.55 1.316 0 C-N-CA 122.972 2.448 . . . . 0.0 112.832 176.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -160.51 58.42 0.33 Allowed 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 123.467 1.603 . . . . 0.0 115.239 170.847 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.8 96.46 0.13 Allowed 'General case' 0 C--O 1.242 0.693 0 O-C-N 119.619 -1.926 . . . . 0.0 115.65 -160.961 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.4 m -69.6 68.52 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 126.864 2.066 . . . . 0.0 108.456 -174.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 98.71 -175.32 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 C-N-CA 128.048 2.539 . . . . 0.0 106.2 -176.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -87.88 94.48 9.78 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 120.995 -1.066 . . . . 0.0 109.959 -175.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.337 21.7 mp0 -54.7 86.06 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 117.914 2.561 . . . . 0.0 117.914 165.921 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 CA--C 1.542 0.654 0 CA-C-N 110.876 -2.875 . . . . 0.0 114.561 -178.085 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.1 ptp . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.26 43.8 tptt -69.28 -48.42 26.13 Favored Pre-proline 0 N--CA 1.489 1.521 0 CA-C-O 117.484 -1.246 . . . . 0.0 113.743 -175.17 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -63.5 -27.18 70.09 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 C-N-CA 122.651 2.234 . . . . 0.0 117.13 173.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.331 0.3 OUTLIER -170.9 143.87 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.473 1.509 . . . . 0.0 108.795 -173.43 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.5 p -75.85 120.63 21.47 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-N 120.878 1.672 . . . . 0.0 109.246 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.8 mt -31.35 -28.82 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.88 0 N-CA-C 121.27 3.804 . . . . 0.0 121.27 -178.215 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -54.2 -37.06 64.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.414 0.686 . . . . 0.0 109.152 173.353 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.58 -41.32 94.41 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 118.555 -0.736 . . . . 0.0 111.791 177.005 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.0 t -62.45 -50.82 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 170.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -48.75 -48.89 40.46 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.986 1.315 . . . . 0.0 112.19 175.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.54 -44.42 70.98 Favored 'General case' 0 C--N 1.316 -0.861 1 C-N-CA 132.539 4.335 . . . . 0.0 113.49 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -63.97 -34.59 78.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.022 0.929 . . . . 0.0 110.538 174.031 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.02 -12.5 38.39 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.522 -177.282 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.58 28.87 66.63 Favored Glycine 0 N--CA 1.495 2.599 0 C-N-CA 125.981 1.753 . . . . 0.0 113.82 177.115 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.3 p -124.85 142.22 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 122.49 1.138 . . . . 0.0 110.167 -170.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -55.82 128.69 36.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 129.328 3.051 . . . . 0.0 107.442 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -53.2 -31.67 44.19 Favored 'General case' 0 N--CA 1.509 2.487 0 N-CA-C 118.125 2.639 . . . . 0.0 118.125 -167.035 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -49.2 -44.56 43.25 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.354 -1.307 . . . . 0.0 113.827 175.626 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.7 p -52.59 -48.82 66.01 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 124.018 0.824 . . . . 0.0 112.548 178.376 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 85.4 t -68.46 -52.1 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 113.802 -1.545 . . . . 0.0 110.187 -174.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.8 m -59.05 -32.01 69.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.9 mtp85 -65.53 -46.98 77.47 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 111.26 -2.7 . . . . 0.0 113.937 170.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.7 t -58.59 -43.88 88.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.595 1.558 . . . . 0.0 108.018 -178.574 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.1 t -55.45 -47.76 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 CA-C-N 111.951 -2.386 . . . . 0.0 111.54 -173.336 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -95.67 13.88 24.89 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 176.159 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 62.23 16.9 8.8 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 116.605 2.076 . . . . 0.0 116.605 179.027 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 36.48 22.77 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 110.582 -3.008 . . . . 0.0 118.22 178.685 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 t 63.69 -51.76 0.24 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 125.121 1.369 . . . . 0.0 112.346 -160.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -138.16 109.67 7.0 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 178.323 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.6 p -124.06 144.03 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.34 0 O-C-N 120.309 -1.494 . . . . 0.0 113.243 179.53 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.4 p -71.02 137.74 49.29 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 177.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -50.79 72.36 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.187 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.302 0.0 OUTLIER -59.57 -28.62 67.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 118.164 2.654 . . . . 0.0 118.164 177.545 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.7 m -67.24 -50.28 61.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 112.585 -2.098 . . . . 0.0 107.567 174.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.6 mtp85 -59.06 -42.68 90.9 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.58 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -58.98 -35.23 72.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 113.659 -1.609 . . . . 0.0 113.956 -177.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -76.95 -44.23 32.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 110.991 -2.822 . . . . 0.0 112.529 -176.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 42.7 t -64.66 -46.34 92.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 112.305 -2.225 . . . . 0.0 108.967 177.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -56.54 -42.18 78.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.824 2.85 . . . . 0.0 111.272 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.0 69.29 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.513 -1.676 . . . . 0.0 111.47 174.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.47 91.88 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 113.432 -1.713 . . . . 0.0 115.203 176.958 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.82 -44.53 93.99 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -178.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.3 -46.4 88.92 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.495 1.122 . . . . 0.0 112.446 178.661 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -61.99 -39.55 92.6 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.592 -2.094 . . . . 0.0 113.803 177.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.2 mt -90.21 15.83 9.65 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.601 1.56 . . . . 0.0 114.201 178.225 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 49.62 31.56 4.34 Favored 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 127.189 2.196 . . . . 0.0 112.6 176.895 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -97.52 139.91 32.74 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 122.863 1.316 . . . . 0.0 108.773 -165.657 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.327 0.0 OUTLIER -90.19 100.83 2.87 Favored Pre-proline 0 N--CA 1.478 0.971 0 CA-C-N 110.807 -2.906 . . . . 0.0 114.5 176.277 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -26.26 -73.21 0.03 OUTLIER 'Trans proline' 0 N--CA 1.484 0.962 1 C-N-CA 126.127 4.551 . . . . 0.0 116.966 -174.662 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -88.31 32.95 0.75 Allowed 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 118.763 2.875 . . . . 0.0 118.763 -168.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 15.9 ptt-85 26.2 89.65 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 127.57 2.348 . . . . 0.0 116.486 179.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.7 m -86.47 46.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.699 -1.25 . . . . 0.0 110.901 -174.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 134.64 143.87 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 C-N-CA 130.115 3.366 . . . . 0.0 106.855 -164.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 mp0 -127.07 145.77 50.61 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.31 175.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.276 5.0 pp0? -118.95 90.34 3.31 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 113.098 -1.865 . . . . 0.0 109.665 162.235 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 N--CA 1.491 1.612 0 CA-C-N 108.755 -3.839 . . . . 0.0 114.72 -171.149 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.2 mmt . . . . . 0 CA--C 1.548 0.895 0 N-CA-C 118.879 2.918 . . . . 0.0 118.879 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 43.7 mttp 177.71 143.23 0.27 Allowed Pre-proline 0 N--CA 1.491 1.61 0 C-N-CA 126.353 1.861 . . . . 0.0 108.272 -174.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -79.55 -16.88 11.6 Favored 'Trans proline' 0 N--CA 1.485 1.009 0 N-CA-C 118.599 2.499 . . . . 0.0 118.599 158.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.442 0.5 OUTLIER -153.59 146.36 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 -174.853 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.294 1.3 p -68.62 100.48 1.13 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 -179.261 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -43.86 -14.26 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.73 0 N-CA-C 117.602 2.445 . . . . 0.0 117.602 -176.449 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -55.93 -35.45 66.65 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.019 0.527 . . . . 0.0 110.334 165.909 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.0 -47.64 84.46 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.8 0.84 . . . . 0.0 113.08 174.395 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.8 t -59.31 -45.86 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 172.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -48.07 81.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.348 -2.205 . . . . 0.0 112.123 -177.358 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.53 -42.2 83.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.221 2.208 . . . . 0.0 115.453 177.038 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.79 -33.05 75.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 124.017 0.823 . . . . 0.0 110.712 177.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.12 -16.43 24.93 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.397 -179.768 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.36 25.35 68.48 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 126.747 2.118 . . . . 0.0 113.479 173.558 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.4 p -126.0 111.32 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.445 0.698 . . . . 0.0 110.197 -167.264 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 91.7 p -16.83 135.65 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.19 0 C-N-CA 127.889 2.476 . . . . 0.0 111.724 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.309 31.6 t80 -47.83 -53.29 16.0 Favored 'General case' 0 N--CA 1.521 3.086 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 -175.763 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.366 0.0 OUTLIER -58.44 -24.77 61.1 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 179.593 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.6 m -56.1 -50.21 71.67 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.233 165.255 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.297 79.9 t -65.5 -43.65 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-O 118.542 -0.742 . . . . 0.0 110.733 -177.126 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.89 81.58 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.034 0.834 . . . . 0.0 112.446 -177.54 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -61.37 -45.97 92.13 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.013 1.857 . . . . 0.0 116.013 169.168 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.86 -41.25 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 125.019 1.328 . . . . 0.0 108.458 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.3 t -53.27 -49.87 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 113.687 -1.597 . . . . 0.0 112.665 -171.115 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -92.09 14.34 16.26 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 171.61 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 60.02 21.08 10.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.971 2.508 . . . . 0.0 113.823 178.072 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.17 45.16 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 111.674 -2.512 . . . . 0.0 116.574 -175.192 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.2 t 64.09 -57.36 0.22 Allowed 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 125.959 1.704 . . . . 0.0 111.929 -163.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -146.08 104.86 3.86 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 125.858 1.663 . . . . 0.0 107.646 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 p -113.51 157.61 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 120.891 1.678 . . . . 0.0 114.453 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -60.81 121.01 11.24 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.647 0.737 . . . . 0.0 112.913 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -41.24 -62.62 0.81 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -43.3 -43.13 4.78 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 179.529 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -59.85 -52.42 65.53 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 179.05 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.2 mtm105 -54.43 -47.67 72.56 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.575 1.695 . . . . 0.0 115.575 177.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.46 -36.5 69.12 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -176.635 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -76.72 -42.12 42.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 111.354 -2.657 . . . . 0.0 111.364 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.98 -49.53 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 C-N-CA 125.892 1.677 . . . . 0.0 108.029 176.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -52.54 -40.4 62.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 128.54 2.736 . . . . 0.0 112.875 179.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.51 -52.98 55.04 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.3 -2.227 . . . . 0.0 111.663 173.544 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.98 86.04 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 113.404 -1.725 . . . . 0.0 114.254 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.97 -45.48 86.66 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.501 1.92 . . . . 0.0 115.947 -177.985 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.83 -46.39 82.15 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 112.721 -2.036 . . . . 0.0 112.563 177.135 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.84 -35.44 80.67 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 111.964 -2.38 . . . . 0.0 113.926 -174.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 46.4 mt -91.56 18.39 7.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.528 1.931 . . . . 0.0 113.96 179.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.42 0.2 OUTLIER 52.03 36.96 20.03 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.789 1.235 . . . . 0.0 113.876 178.537 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -100.41 175.64 5.63 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -172.443 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.75 107.53 4.67 Favored Pre-proline 0 N--CA 1.478 0.932 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -176.578 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.318 0.0 OUTLIER -5.12 -60.25 0.0 OUTLIER 'Trans proline' 0 N--CA 1.481 0.756 1 C-N-CA 126.362 4.708 . . . . 0.0 120.472 -173.805 . . . . . . . . 4 3 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -123.61 94.01 4.11 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 117.264 2.32 . . . . 0.0 117.264 -179.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.42 1.5 tmm_? 36.82 -155.96 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 116.215 -1.85 . . . . 0.0 110.489 126.882 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 9.8 p 97.49 126.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 117.495 -3.253 . . . . 0.0 111.486 145.62 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.08 70.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 123.843 1.782 . . . . 0.0 115.372 168.146 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -148.4 -39.27 0.17 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 128.742 2.817 . . . . 0.0 110.8 176.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.484 0.0 OUTLIER -79.8 98.19 6.95 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 122.599 1.19 . . . . 0.0 113.156 170.62 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt . . . . . 0 N--CA 1.482 1.168 0 CA-C-N 110.406 -3.088 . . . . 0.0 114.238 -173.764 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptt? . . . . . 0 N--CA 1.487 1.382 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.45 111.01 23.26 Favored Pre-proline 0 CA--C 1.556 1.201 0 CA-C-O 116.306 -1.807 . . . . 0.0 106.169 178.274 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -72.85 132.6 18.72 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 CA-C-N 121.907 1.717 . . . . 0.0 111.219 172.932 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.36 0.5 OUTLIER 63.34 144.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 C-N-CA 129.103 2.961 . . . . 0.0 109.866 175.498 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.301 2.8 p -73.07 99.22 2.72 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.6 mt -41.0 -14.4 0.01 OUTLIER 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 118.546 2.795 . . . . 0.0 118.546 -176.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -54.62 -33.17 60.06 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 119.096 0.862 . . . . 0.0 111.071 165.338 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -59.13 -48.82 80.2 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 118.408 -0.806 . . . . 0.0 113.09 173.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -58.05 -44.26 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 173.358 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.22 70.62 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 112.029 -2.351 . . . . 0.0 111.531 -177.261 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.1 -39.57 86.77 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.515 1.926 . . . . 0.0 114.282 176.894 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -66.34 -36.35 82.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-O 122.236 1.017 . . . . 0.0 110.881 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.61 -15.15 40.67 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.198 -1.819 . . . . 0.0 110.856 178.694 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 26.65 60.89 Favored Glycine 0 CA--C 1.544 1.888 0 C-N-CA 126.936 2.208 . . . . 0.0 113.128 170.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -124.36 128.75 73.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.25 0.62 . . . . 0.0 110.655 -167.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.7 p -33.08 122.14 0.38 Allowed 'General case' 0 N--CA 1.514 2.725 0 C-N-CA 127.445 2.298 . . . . 0.0 109.13 175.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.317 41.8 t80 -40.92 -47.8 3.04 Favored 'General case' 0 N--CA 1.522 3.147 0 N-CA-C 117.628 2.455 . . . . 0.0 117.628 -175.873 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.403 0.0 OUTLIER -57.53 -16.99 11.52 Favored 'General case' 0 C--N 1.32 -0.681 1 N-CA-C 122.073 4.101 . . . . 0.0 122.073 179.108 . . . . . . . . 4 3 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 69.0 p -64.96 -52.61 55.34 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 114.203 -1.362 . . . . 0.0 112.866 162.014 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.27 73.7 t -60.99 -47.6 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.204 -171.39 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 p -57.12 -42.58 81.13 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 122.775 1.274 . . . . 0.0 112.411 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.1 mtt85 -67.7 -38.97 84.37 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 119.773 3.249 . . . . 0.0 119.773 173.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.7 t -55.11 -46.62 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 127.237 2.215 . . . . 0.0 107.979 173.132 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.2 t -55.7 -46.81 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 110.974 -2.83 . . . . 0.0 111.239 -168.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.282 13.8 m120 -99.07 26.81 5.52 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.87 -1.513 . . . . 0.0 114.437 176.65 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 49.29 44.54 23.52 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-O 123.809 1.766 . . . . 0.0 112.905 171.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.296 . . -72.87 36.15 0.08 Allowed 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 110.211 -3.177 . . . . 0.0 118.858 -176.501 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.7 m 4.83 93.99 0.01 OUTLIER 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 108.854 -3.794 . . . . 0.0 117.902 176.617 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.7 m80 171.89 -68.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 102.67 -3.085 . . . . 0.0 102.67 -167.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -25.16 101.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 129.1 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 86.1 p -100.6 156.29 17.39 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 112.234 -2.257 . . . . 0.0 114.811 -177.048 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -15.21 -63.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.403 1.881 . . . . 0.0 115.28 167.646 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.82 -51.85 12.19 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 176.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 76.3 m -59.56 -51.45 69.77 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.481 1.512 . . . . 0.0 107.012 175.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -43.3 73.02 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.762 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.86 -39.4 85.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.309 -1.769 . . . . 0.0 114.744 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -79.11 -40.84 30.06 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 113.079 -1.873 . . . . 0.0 112.072 -177.487 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.7 t -61.17 -47.56 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.74 1.616 . . . . 0.0 106.771 172.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -55.73 -44.68 77.76 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.344 2.258 . . . . 0.0 111.499 -178.585 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -51.7 65.83 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.658 -2.065 . . . . 0.0 110.925 177.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.68 -40.7 80.01 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 113.205 -1.816 . . . . 0.0 113.603 176.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 mtt -58.25 -48.97 78.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -176.0 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.4 94.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.101 -2.318 . . . . 0.0 112.875 177.599 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -64.13 -34.47 78.12 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-N 112.332 -2.213 . . . . 0.0 113.684 -177.533 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.0 mt -94.48 18.0 12.08 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.867 1.667 . . . . 0.0 113.042 -178.486 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.69 21.41 5.85 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.693 2.397 . . . . 0.0 113.043 178.341 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -89.79 157.43 17.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -170.294 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.429 24.5 mm -118.86 113.84 35.78 Favored Pre-proline 0 CA--C 1.535 0.396 1 N-CA-C 121.921 4.045 . . . . 0.0 121.921 178.112 . . . . . . . . 3 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.375 0.1 OUTLIER -12.97 -55.91 0.01 OUTLIER 'Trans proline' 0 N--CA 1.481 0.76 1 C-N-CA 127.791 5.661 . . . . 0.0 121.733 -164.901 . . . . . . . . 4 3 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -112.81 36.1 3.61 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 120.266 3.432 . . . . 0.0 120.266 -169.295 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.6 mmp_? -114.12 104.73 12.41 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 114.656 -1.156 . . . . 0.0 113.152 -162.07 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.4 p -133.49 121.99 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 125.68 1.592 . . . . 0.0 111.288 1.59 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.62 83.24 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 CA-C-O 123.71 1.719 . . . . 0.0 112.111 166.859 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -176.85 -65.49 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 111.491 -2.595 . . . . 0.0 110.168 -169.55 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -139.82 86.45 2.1 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 113.48 -1.691 . . . . 0.0 107.396 174.704 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.0 tp . . . . . 0 N--CA 1.48 1.067 1 CA-C-N 108.102 -4.135 . . . . 0.0 112.123 -155.282 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 118.705 2.854 . . . . 0.0 118.705 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -165.72 165.18 11.27 Favored Pre-proline 0 CA--C 1.561 1.382 0 C-N-CA 127.107 2.163 . . . . 0.0 108.38 -177.015 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -74.87 -44.16 0.37 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 C-N-CA 122.586 2.191 . . . . 0.0 111.06 172.41 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.415 0.4 OUTLIER -144.8 148.92 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 127.374 2.269 . . . . 0.0 109.669 177.368 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.3 p -91.54 145.66 24.43 Favored 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.3 -165.521 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mt -45.71 -27.88 0.9 Allowed 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -170.384 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -59.58 -39.61 84.7 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.816 0.735 . . . . 0.0 111.744 176.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.5 -48.31 74.81 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 171.121 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.0 t -60.0 -40.62 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 174.317 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.15 -50.54 73.29 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.643 -1.617 . . . . 0.0 113.201 177.563 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.69 -39.35 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.993 1.717 . . . . 0.0 113.72 177.212 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -67.27 -34.97 78.53 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.572 0.749 . . . . 0.0 111.212 177.479 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.42 -14.91 44.76 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.104 177.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.91 29.46 54.38 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 126.124 1.821 . . . . 0.0 112.655 170.831 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -132.4 134.37 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.981 0 CA-C-O 122.202 1.001 . . . . 0.0 109.651 -168.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.5 p -41.21 130.88 2.79 Favored 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 128.135 2.574 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -51.95 -29.54 20.88 Favored 'General case' 0 N--CA 1.51 2.528 0 N-CA-C 119.586 3.18 . . . . 0.0 119.586 -174.524 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -49.31 -41.52 38.59 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 116.479 -1.724 . . . . 0.0 113.374 172.889 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 43.5 p -63.22 -53.85 46.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 82.4 t -62.38 -48.18 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.831 0.852 . . . . 0.0 110.207 -173.079 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.0 p -57.81 -42.45 84.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 116.609 2.078 . . . . 0.0 116.609 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.2 mtp85 -62.01 -45.59 92.91 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 109.995 -3.275 . . . . 0.0 115.157 171.212 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.3 t -54.92 -48.31 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 127.405 2.282 . . . . 0.0 109.657 179.253 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.3 t -57.26 -48.68 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 CA-C-N 109.945 -3.298 . . . . 0.0 112.937 -166.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.301 21.2 m120 -108.54 33.44 4.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.756 -1.565 . . . . 0.0 114.9 176.364 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 73.51 -5.49 1.97 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.902 2.881 . . . . 0.0 118.619 167.053 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.15 30.02 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.814 2.446 . . . . 0.0 115.266 -175.785 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.6 p 55.21 -44.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 -148.448 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.272 77.9 m80 -153.8 131.96 11.85 Favored 'General case' 0 CA--C 1.556 1.189 0 CA-C-O 117.64 -1.171 . . . . 0.0 109.875 -175.986 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.9 t -150.98 143.19 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.847 1.658 . . . . 0.0 113.887 159.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 p -23.34 131.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 119.387 3.106 . . . . 0.0 119.387 166.123 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.45 -47.43 73.17 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.945 0.898 . . . . 0.0 112.791 -176.61 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.93 15.76 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 176.226 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -61.78 -49.61 75.65 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.931 1.692 . . . . 0.0 107.653 175.995 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -58.18 -46.77 85.17 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.688 1.995 . . . . 0.0 113.054 -178.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.26 -37.92 75.92 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 179.506 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -73.3 -43.26 61.26 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 112.27 -2.241 . . . . 0.0 111.87 178.695 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 85.8 t -63.6 -48.84 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 114.396 -1.275 . . . . 0.0 108.699 177.393 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -49.17 -46.81 45.95 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 128.981 2.912 . . . . 0.0 108.995 178.464 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.45 -54.23 31.41 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 112.706 -2.043 . . . . 0.0 111.359 -178.475 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.13 -42.41 69.48 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.275 -1.784 . . . . 0.0 114.23 174.332 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.0 mmt -59.62 -50.37 74.14 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 125.88 1.672 . . . . 0.0 111.587 -179.087 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.98 -42.77 94.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.292 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.52 -32.93 74.59 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.501 179.566 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.6 mt -92.76 11.53 26.59 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 125.683 1.593 . . . . 0.0 113.727 177.576 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.408 0.2 OUTLIER 46.47 29.76 0.96 Allowed 'General case' 0 CA--C 1.564 1.487 0 C-N-CA 127.298 2.239 . . . . 0.0 113.715 -175.791 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -93.8 103.48 15.61 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.03 -1.044 . . . . 0.0 108.59 -168.037 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -49.78 118.84 9.07 Favored Pre-proline 0 N--CA 1.494 1.764 0 CA-C-N 113.534 -1.666 . . . . 0.0 113.799 169.395 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.48 44.19 0.71 Allowed 'Trans proline' 0 N--CA 1.485 1.019 0 C-N-CA 123.004 2.469 . . . . 0.0 118.318 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.45 85.76 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 113.097 -1.865 . . . . 0.0 108.059 -175.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.309 0.0 OUTLIER -25.86 102.26 0.02 OUTLIER 'General case' 0 CA--C 1.57 1.721 0 N-CA-C 117.577 2.436 . . . . 0.0 117.577 -178.868 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.6 m -69.71 77.69 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 C-N-CA 124.143 0.977 . . . . 0.0 108.687 173.687 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.4 77.34 0.39 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 122.585 1.183 . . . . 0.0 111.188 171.112 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -115.3 -52.79 2.65 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 111.629 -2.532 . . . . 0.0 112.393 174.98 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.303 0.0 OUTLIER -90.8 54.38 2.65 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 124.083 1.897 . . . . 0.0 112.126 167.314 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 pp . . . . . 0 N--CA 1.478 0.959 0 CA-C-N 111.083 -2.78 . . . . 0.0 116.683 -170.518 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.3 tmm? . . . . . 0 N--CA 1.482 1.141 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.333 2.1 mptt -83.95 138.86 39.93 Favored Pre-proline 0 CA--C 1.552 1.051 0 CA-C-O 115.842 -2.028 . . . . 0.0 113.9 -167.299 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -57.1 -52.7 6.1 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.698 2.265 . . . . 0.0 112.917 -168.72 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.465 1.1 t -168.31 148.27 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 103.474 -2.787 . . . . 0.0 103.474 -173.444 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 19.1 p -101.05 141.46 33.91 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.616 -0.677 . . . . 0.0 110.371 -176.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.6 mt -47.02 -23.84 0.53 Allowed 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 119.563 3.171 . . . . 0.0 119.563 -164.863 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -62.28 -35.59 79.47 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.14 0.882 . . . . 0.0 111.727 175.2 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -59.55 -46.92 87.49 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 118.383 -0.818 . . . . 0.0 112.885 171.283 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.9 t -58.61 -45.46 90.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 172.765 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.01 71.34 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.288 1.435 . . . . 0.0 112.598 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.58 -38.81 84.58 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.184 1.794 . . . . 0.0 115.766 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -64.82 -35.64 81.76 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.97 0.908 . . . . 0.0 110.346 176.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.38 -14.9 44.91 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.149 -1.387 . . . . 0.0 110.241 179.311 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.31 24.96 69.55 Favored Glycine 0 N--CA 1.48 1.582 0 C-N-CA 127.23 2.347 . . . . 0.0 113.275 172.443 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -121.02 124.72 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 124.188 0.995 . . . . 0.0 109.749 -167.812 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.4 p -31.12 123.27 0.22 Allowed 'General case' 0 N--CA 1.513 2.715 0 C-N-CA 127.207 2.203 . . . . 0.0 108.534 175.214 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -39.47 -33.18 0.15 Allowed 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 115.863 1.801 . . . . 0.0 115.863 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -48.11 -42.4 29.02 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 117.745 -1.121 . . . . 0.0 112.733 176.986 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.3 p -60.83 -55.77 29.08 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 175.764 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.326 94.7 t -60.45 -44.61 96.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 C-N-CA 124.666 1.186 . . . . 0.0 110.092 -165.05 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.5 p -59.61 -49.35 78.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.198 0.999 . . . . 0.0 113.056 178.885 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -56.75 -44.53 81.83 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 111.998 -2.364 . . . . 0.0 113.857 173.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.57 -47.83 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.522 1.529 . . . . 0.0 109.069 -178.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.02 -41.38 86.05 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 112.982 -1.917 . . . . 0.0 112.042 -167.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.26 14.0 m120 -100.05 23.48 9.85 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 113.697 -1.592 . . . . 0.0 114.867 173.518 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.34 5.91 4.54 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 170.647 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.96 43.36 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 111.566 -2.561 . . . . 0.0 115.147 -167.904 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.0 p 57.34 -59.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 113.155 -1.839 . . . . 0.0 114.485 -160.261 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -140.16 108.41 5.8 Favored 'General case' 0 CA--C 1.559 1.297 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.145 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.3 p -121.51 157.66 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 171.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 p -68.96 131.44 45.09 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 116.462 2.023 . . . . 0.0 116.462 -175.13 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -24.65 -67.06 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 128.004 2.522 . . . . 0.0 117.026 176.053 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -53.36 -40.54 65.02 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -172.346 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -50.45 70.09 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 113.056 -1.884 . . . . 0.0 107.31 -178.108 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -40.13 96.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -179.645 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.76 -36.56 83.45 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.744 -176.743 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.74 -41.45 53.29 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 112.883 -1.962 . . . . 0.0 110.965 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.7 t -64.83 -47.4 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.294 1.438 . . . . 0.0 109.099 176.075 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -52.48 -43.97 65.33 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 130.066 3.347 . . . . 0.0 109.693 179.095 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.76 -51.35 67.48 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.005 -1.907 . . . . 0.0 111.28 177.738 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.85 93.22 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 113.837 -1.529 . . . . 0.0 113.55 176.261 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 mtt -56.59 -45.78 81.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 127.573 2.349 . . . . 0.0 113.537 -178.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.52 -47.96 76.93 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 113.077 -1.874 . . . . 0.0 112.628 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -63.04 -39.34 94.46 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 112.348 -2.205 . . . . 0.0 113.142 -177.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.9 mt -84.76 7.81 19.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.32 2.248 . . . . 0.0 113.902 -177.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.403 0.5 OUTLIER 49.22 45.21 23.43 Favored 'General case' 0 CA--C 1.573 1.849 0 C-N-CA 125.304 1.442 . . . . 0.0 112.852 179.679 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -95.39 -167.29 1.59 Allowed 'General case' 0 CA--C 1.558 1.254 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.26 -167.519 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.3 103.32 3.13 Favored Pre-proline 0 N--CA 1.479 0.984 0 CA-C-O 117.708 -1.139 . . . . 0.0 109.571 179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.348 0.0 OUTLIER -8.69 -76.99 0.0 OUTLIER 'Trans proline' 0 N--CA 1.488 1.178 1 C-N-CA 125.777 4.318 . . . . 0.0 117.249 -177.278 . . . . . . . . 4 3 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.5 145.22 37.13 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 173.267 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.62 94.87 5.87 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 105.461 -2.051 . . . . 0.0 105.461 -167.191 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.0 m -77.84 74.31 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.563 1.467 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -171.953 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.79 115.54 6.03 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.814 0.816 . . . . 0.0 109.922 178.345 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 9.4 tm0? -106.87 -60.98 1.6 Allowed 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 113.002 -1.908 . . . . 0.0 112.628 -171.276 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.66 90.83 0.41 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.915 0.864 . . . . 0.0 109.622 168.21 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.6 mt . . . . . 0 N--CA 1.487 1.416 0 CA-C-N 113.224 -1.807 . . . . 0.0 114.069 -173.45 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.5 mmt . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.03 114.55 0.4 Allowed Pre-proline 0 CA--C 1.567 1.614 0 C-N-CA 127.574 2.35 . . . . 0.0 105.769 179.038 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -84.31 -8.37 9.73 Favored 'Trans proline' 0 N--CA 1.486 1.031 0 N-CA-C 118.754 2.559 . . . . 0.0 118.754 170.905 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.445 1.1 t -162.07 145.53 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 N-CA-C 102.906 -2.998 . . . . 0.0 102.906 -178.362 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.9 p -93.94 134.94 35.8 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.197 -174.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.4 mt -51.36 -22.37 2.87 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 120.188 3.403 . . . . 0.0 120.188 -163.591 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -58.37 -32.36 68.49 Favored 'General case' 0 CA--C 1.551 1.0 0 O-C-N 123.406 0.441 . . . . 0.0 109.951 175.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -61.59 -52.33 64.83 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 118.01 -0.995 . . . . 0.0 113.26 171.406 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.6 t -56.59 -44.71 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 174.205 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.11 -51.9 67.79 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.353 2.661 . . . . 0.0 112.998 -178.118 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.77 -39.85 84.09 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.86 1.664 . . . . 0.0 113.909 177.456 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -67.17 -34.01 76.63 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.414 1.086 . . . . 0.0 111.155 177.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.86 -11.25 42.51 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.73 1.212 . . . . 0.0 111.291 178.357 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.49 17.57 77.91 Favored Glycine 0 N--CA 1.48 1.602 0 C-N-CA 126.511 2.005 . . . . 0.0 114.15 169.187 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -117.98 136.64 54.5 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 124.828 1.251 . . . . 0.0 110.07 -170.427 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -36.29 123.59 0.77 Allowed 'General case' 0 N--CA 1.52 3.029 0 C-N-CA 127.414 2.286 . . . . 0.0 108.872 -179.485 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -34.21 -46.75 0.26 Allowed 'General case' 0 N--CA 1.53 3.543 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 175.044 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.572 0.0 OUTLIER -59.6 -29.97 68.36 Favored 'General case' 0 C--N 1.322 -0.613 1 N-CA-C 124.455 4.983 . . . . 0.0 124.455 176.642 . . . . . . . . 4 3 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 70.1 p -59.18 -46.14 89.19 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.416 -1.266 . . . . 0.0 112.763 165.047 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.5 t -66.06 -47.5 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.686 0.794 . . . . 0.0 110.275 -175.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.292 2.7 m -61.55 -34.67 75.96 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -177.836 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.3 mtt85 -60.81 -49.02 79.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 111.385 -2.643 . . . . 0.0 114.603 166.423 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.8 t -61.52 -45.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.113 -175.778 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 t -57.97 -45.09 87.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 O-C-N 124.938 1.399 . . . . 0.0 111.477 -168.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -90.81 24.24 2.81 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 113.846 -1.525 . . . . 0.0 113.958 175.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.292 0.0 OUTLIER 62.98 1.85 0.92 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 129.953 3.301 . . . . 0.0 117.741 173.668 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.76 40.02 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 111.811 -2.45 . . . . 0.0 116.141 -170.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.25 98.4 p 61.23 -49.61 0.12 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -164.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -153.33 104.59 2.78 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -174.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 p -125.74 150.99 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 N-CA-C 116.495 2.035 . . . . 0.0 116.495 -179.595 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -59.65 137.48 58.02 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 116.977 2.214 . . . . 0.0 116.977 -176.009 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.24 -61.52 1.95 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.521 1.929 . . . . 0.0 114.868 177.102 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.72 -35.83 56.52 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.7 m -69.27 -58.14 4.42 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.549 1.54 . . . . 0.0 107.346 174.661 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.9 mtm105 -53.5 -48.09 69.28 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -179.157 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -56.3 -36.84 69.1 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.735 2.014 . . . . 0.0 113.695 -174.108 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -77.62 -44.64 27.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 109.698 -3.41 . . . . 0.0 110.518 -176.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 42.0 t -65.34 -48.46 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.125 1.77 . . . . 0.0 108.234 179.082 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.15 -40.04 84.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 128.64 2.776 . . . . 0.0 115.645 179.123 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.9 58.12 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 111.98 -2.373 . . . . 0.0 110.029 172.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.54 -37.57 73.29 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 112.988 -1.914 . . . . 0.0 113.29 176.986 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 34.3 mtt -58.09 -55.98 27.96 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 -174.699 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -42.32 99.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.613 179.024 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.86 -37.07 85.41 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.307 -2.224 . . . . 0.0 112.501 -176.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -94.0 16.84 13.49 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.966 1.306 . . . . 0.0 114.269 -178.165 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.343 1.5 p-10 54.73 48.9 19.17 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-O 123.948 1.832 . . . . 0.0 113.745 178.871 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -105.86 157.87 17.16 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.368 -1.287 . . . . 0.0 112.462 -173.166 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.2 91.97 9.74 Favored Pre-proline 0 N--CA 1.489 1.496 0 CA-C-N 114.008 -1.451 . . . . 0.0 111.601 -173.827 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -43.73 109.33 0.14 Allowed 'Trans proline' 0 N--CA 1.479 0.676 1 C-N-CA 125.463 4.108 . . . . 0.0 113.969 -169.215 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -173.05 -70.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 119.344 3.091 . . . . 0.0 119.344 164.009 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 11.4 mmp_? 67.45 112.9 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 125.78 1.632 . . . . 0.0 113.154 179.073 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.5 m -77.59 165.04 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 119.504 -0.878 . . . . 0.0 110.399 151.962 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.01 83.3 0.96 Allowed 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.934 1.349 . . . . 0.0 112.974 -175.291 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -118.71 -30.91 4.99 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 112.938 -1.937 . . . . 0.0 115.914 178.024 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -162.55 47.56 0.16 Allowed 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 123.859 1.79 . . . . 0.0 110.267 -172.324 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.6 mt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 119.847 3.277 . . . . 0.0 119.847 -154.285 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.9 mmm . . . . . 0 N--CA 1.485 1.306 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -112.67 148.0 38.34 Favored Pre-proline 0 CA--C 1.553 1.072 0 CA-C-O 116.004 -1.95 . . . . 0.0 111.559 179.651 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -61.81 -30.6 84.65 Favored 'Trans proline' 0 N--CA 1.487 1.097 0 CA-C-N 121.892 1.712 . . . . 0.0 115.101 -162.586 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.4 OUTLIER -137.94 150.09 25.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 CA-C-N 110.222 -3.172 . . . . 0.0 103.354 162.034 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 p -85.41 150.56 24.64 Favored 'General case' 0 CA--C 1.552 1.033 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 175.891 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.0 mt -46.41 -25.11 0.6 Allowed 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 119.996 3.332 . . . . 0.0 119.996 -166.811 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -60.54 -40.17 90.6 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 119.665 1.12 . . . . 0.0 112.155 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.57 -31.04 71.86 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.72 179.328 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.69 -50.31 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 168.238 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.68 -53.78 35.3 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.544 1.938 . . . . 0.0 112.249 176.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.39 -39.03 88.8 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.559 1.543 . . . . 0.0 112.298 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -65.1 -34.4 78.32 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 121.755 0.788 . . . . 0.0 109.906 177.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.53 -11.91 44.35 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.094 178.616 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 31.29 66.83 Favored Glycine 0 N--CA 1.483 1.818 0 C-N-CA 126.891 2.186 . . . . 0.0 112.24 171.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.12 128.49 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-O 121.78 0.8 . . . . 0.0 111.354 -168.579 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.4 p -34.57 122.22 0.52 Allowed 'General case' 0 N--CA 1.516 2.826 0 C-N-CA 128.095 2.558 . . . . 0.0 107.462 174.294 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -42.18 -43.3 3.3 Favored 'General case' 0 N--CA 1.538 3.931 0 N-CA-C 117.849 2.537 . . . . 0.0 117.849 -166.509 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.413 0.0 OUTLIER -57.43 -24.83 57.91 Favored 'General case' 0 C--N 1.318 -0.795 1 N-CA-C 123.437 4.606 . . . . 0.0 123.437 -178.214 . . . . . . . . 4 3 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.7 p -55.77 -54.71 41.09 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.801 0.688 . . . . 0.0 111.707 164.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 82.1 t -59.74 -49.79 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.31 1.844 . . . . 0.0 108.623 -172.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 m -59.81 -37.53 79.4 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.239 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.0 mtt85 -67.29 -41.16 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 118.953 2.946 . . . . 0.0 118.953 170.27 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 74.4 t -59.35 -41.44 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 126.379 1.872 . . . . 0.0 107.368 179.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -59.28 -45.0 93.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 113.182 -1.826 . . . . 0.0 112.579 -169.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -83.84 4.4 29.44 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 170.3 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 66.31 14.18 9.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.016 2.127 . . . . 0.0 115.832 -177.047 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 24.02 40.46 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.834 2.454 . . . . 0.0 117.557 -171.41 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.258 96.0 p 58.46 -53.7 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -162.576 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -140.34 79.56 1.71 Allowed 'General case' 0 CA--C 1.571 1.776 0 C-N-CA 124.101 0.961 . . . . 0.0 109.909 -175.124 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -102.24 140.2 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 119.836 -1.79 . . . . 0.0 114.699 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.1 t -58.2 150.55 21.29 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -176.604 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.69 0.24 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.747 2.019 . . . . 0.0 113.491 -175.834 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -56.32 -30.93 63.21 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 120.401 3.482 . . . . 0.0 120.401 -178.807 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 36.6 m -62.73 -52.0 64.94 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 174.579 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -57.01 -44.3 82.68 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 176.608 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -36.63 72.56 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.769 1.627 . . . . 0.0 115.157 -176.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.6 ttpt -76.07 -42.31 47.82 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 110.934 -2.848 . . . . 0.0 110.987 -178.453 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 74.9 t -65.67 -51.25 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.861 179.595 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -53.57 -46.73 70.4 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 129.825 3.25 . . . . 0.0 110.999 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.85 -49.65 71.92 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.439 -2.164 . . . . 0.0 111.879 176.532 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.18 -49.64 77.07 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.578 -1.647 . . . . 0.0 113.178 176.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.6 mtt -54.2 -45.54 72.22 Favored 'General case' 0 N--CA 1.497 1.903 0 C-N-CA 127.0 2.12 . . . . 0.0 111.061 -179.437 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.61 -47.77 82.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 125.843 1.964 . . . . 0.0 111.507 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -64.41 -40.55 95.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 113.044 -1.889 . . . . 0.0 113.584 177.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.6 mt -84.89 9.24 14.88 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 127.632 2.373 . . . . 0.0 115.103 179.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.274 0.6 OUTLIER 49.1 34.66 6.04 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 126.29 1.836 . . . . 0.0 114.048 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -80.34 161.29 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.461 -0.774 . . . . 0.0 111.077 -171.338 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.31 0.0 OUTLIER -115.97 93.87 39.63 Favored Pre-proline 0 N--CA 1.481 1.123 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.863 177.985 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.309 0.1 OUTLIER -15.76 -62.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.507 1 C-N-CA 126.487 4.791 . . . . 0.0 120.775 -169.606 . . . . . . . . 4 3 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -82.75 38.27 0.56 Allowed 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 118.11 2.633 . . . . 0.0 118.11 -173.362 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 31.54 59.21 0.3 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 117.33 2.344 . . . . 0.0 117.33 -175.574 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.371 28.3 m 50.72 14.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 N-CA-C 120.502 3.519 . . . . 0.0 120.502 -172.411 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.35 -55.76 5.64 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -178.606 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -98.85 66.92 1.64 Allowed 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 123.945 1.831 . . . . 0.0 110.57 -177.0 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 173.56 -31.35 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 109.913 -3.312 . . . . 0.0 110.732 -176.679 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 tp . . . . . 0 N--CA 1.475 0.798 0 O-C-N 123.923 0.764 . . . . 0.0 112.788 165.626 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.485 1.284 0 N-CA-C 116.962 2.208 . . . . 0.0 116.962 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 46.2 pttt 177.95 138.33 0.24 Allowed Pre-proline 0 CA--C 1.567 1.606 0 C-N-CA 126.304 1.841 . . . . 0.0 109.299 176.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -77.61 -26.74 6.78 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.217 1.944 . . . . 0.0 115.473 -166.184 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.405 0.3 OUTLIER -151.13 134.81 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 126.589 1.955 . . . . 0.0 109.007 -175.013 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.5 p -71.96 144.44 48.89 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 -169.559 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.7 mt -55.5 -23.7 27.55 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -162.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -51.82 -39.87 59.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.766 1.626 . . . . 0.0 109.322 177.156 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -62.63 -45.23 93.79 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.706 174.644 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.4 t -57.88 -47.86 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 169.222 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.49 -51.02 66.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.316 1.846 . . . . 0.0 113.547 177.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.43 90.98 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.24 1.816 . . . . 0.0 113.558 179.215 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -64.88 -31.82 73.24 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 121.909 0.862 . . . . 0.0 110.582 176.341 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.36 -20.62 25.09 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.295 178.998 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 28.2 55.32 Favored Glycine 0 CA--C 1.545 1.909 0 C-N-CA 126.339 1.923 . . . . 0.0 112.82 173.719 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -127.93 128.25 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -173.128 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 p -52.48 139.88 24.02 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 124.516 1.126 . . . . 0.0 111.407 -173.198 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -46.63 -43.56 17.58 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 119.871 3.286 . . . . 0.0 119.871 -165.559 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.403 0.0 OUTLIER -55.37 -25.07 33.13 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 121.748 3.981 . . . . 0.0 121.748 -179.362 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 55.8 p -60.74 -55.17 36.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 114.009 -1.451 . . . . 0.0 112.951 166.461 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 97.1 t -60.08 -48.59 87.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.153 1.781 . . . . 0.0 109.469 -176.285 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.341 3.6 m -56.21 -36.8 68.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 115.551 1.685 . . . . 0.0 115.551 177.38 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.3 mtt85 -67.81 -45.95 73.27 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 111.727 -2.488 . . . . 0.0 115.98 171.745 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 66.0 t -60.4 -43.33 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 125.372 1.469 . . . . 0.0 109.673 -179.538 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.0 t -54.58 -50.74 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.382 0 CA-C-N 112.441 -2.163 . . . . 0.0 110.521 -173.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.21 18.12 14.34 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.655 -1.611 . . . . 0.0 113.952 177.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.3 17.4 mt-30 68.19 11.09 8.22 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 119.768 3.247 . . . . 0.0 119.768 173.657 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.41 -36.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 121.12 3.748 . . . . 0.0 121.12 176.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.0 p 125.38 -73.32 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.871 1 C-N-CA 133.571 4.748 . . . . 0.0 107.647 -166.425 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -141.08 128.2 20.8 Favored 'General case' 0 CA--C 1.556 1.183 0 CA-C-O 116.546 -1.693 . . . . 0.0 112.238 173.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 0.3 OUTLIER -139.52 158.86 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 118.137 2.643 . . . . 0.0 118.137 167.72 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -45.27 135.38 5.9 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -176.105 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.71 -63.35 1.2 Allowed 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -172.568 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.265 13.4 tptp -49.08 -34.73 14.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.734 2.124 . . . . 0.0 116.734 179.018 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.8 m -54.17 -56.26 19.91 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 174.215 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 19.2 mtt180 -58.64 -45.85 88.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.353 1.461 . . . . 0.0 113.72 -175.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -34.47 75.44 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 179.995 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.36 -45.77 37.26 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.889 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.8 t -58.48 -48.26 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.288 177.474 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -60.12 -44.79 94.61 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.561 2.344 . . . . 0.0 114.569 -178.641 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.88 65.43 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.617 176.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.25 -40.98 75.02 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 112.686 -2.052 . . . . 0.0 113.024 176.596 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.6 mtt -60.58 -51.47 69.26 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 125.818 1.647 . . . . 0.0 115.196 -176.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.85 98.54 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 113.189 -1.823 . . . . 0.0 111.835 179.585 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -65.03 -40.97 95.61 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 112.523 -2.126 . . . . 0.0 113.954 -176.83 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.5 mt -86.25 22.55 1.76 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.827 1.651 . . . . 0.0 115.251 -178.271 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.3 29.55 3.85 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 126.019 1.728 . . . . 0.0 113.376 177.528 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 61.4 t80 -87.27 -176.22 5.57 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.859 -1.518 . . . . 0.0 110.228 -170.978 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.422 ' N ' ' CG ' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -138.05 96.93 10.02 Favored Pre-proline 0 CA--C 1.546 0.804 0 CA-C-O 117.941 -1.028 . . . . 0.0 109.388 -173.207 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.357 0.0 OUTLIER -11.07 -72.07 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.028 1 C-N-CA 126.067 4.512 . . . . 0.0 117.129 -176.125 . . . . . . . . 4 3 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.304 0.2 OUTLIER -88.25 115.17 25.55 Favored 'General case' 0 CA--C 1.558 1.27 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 168.964 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.98 99.1 0.08 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.612 1.165 . . . . 0.0 111.741 167.343 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.9 m -85.02 52.7 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 CA-C-O 122.999 1.381 . . . . 0.0 107.316 -179.748 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -131.99 159.3 39.13 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 113.014 -1.903 . . . . 0.0 113.681 -159.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.4 mp0 -111.59 6.85 20.29 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 113.674 -1.603 . . . . 0.0 113.598 172.237 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.8 56.56 3.71 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 123.672 1.701 . . . . 0.0 112.061 178.655 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 pp . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 117.801 2.519 . . . . 0.0 117.801 -174.95 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.8 mtt . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.09 151.86 26.88 Favored Pre-proline 0 CA--C 1.554 1.126 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -171.661 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -68.43 -38.8 10.73 Favored 'Trans proline' 0 N--CA 1.487 1.097 0 C-N-CA 122.868 2.378 . . . . 0.0 115.412 -158.702 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.469 0.7 OUTLIER -159.13 151.04 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 O-C-N 125.384 1.678 . . . . 0.0 107.898 -162.217 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.339 2.0 p -67.94 105.11 1.9 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.7 mt -43.56 -21.96 0.04 OUTLIER 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -177.453 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -57.28 -31.43 65.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 120.851 0.358 . . . . 0.0 111.931 169.908 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -58.82 -51.09 71.49 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.873 0.869 . . . . 0.0 110.895 170.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.8 t -59.14 -43.35 89.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 176.218 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.22 -55.45 31.16 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.944 1.697 . . . . 0.0 112.707 175.619 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -42.21 92.66 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.952 2.101 . . . . 0.0 114.229 -179.536 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -66.23 -34.27 77.63 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.119 0.887 . . . . 0.0 110.515 179.248 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.21 34.84 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 113.822 -1.536 . . . . 0.0 110.571 179.374 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.63 29.0 60.24 Favored Glycine 0 CA--C 1.546 1.99 0 C-N-CA 127.192 2.329 . . . . 0.0 112.71 172.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.32 138.71 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 123.636 0.774 . . . . 0.0 110.483 -167.843 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -46.2 130.26 10.32 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 127.101 2.161 . . . . 0.0 107.139 178.768 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -50.01 -31.63 13.29 Favored 'General case' 0 N--CA 1.503 2.208 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -50.81 -44.8 59.13 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 124.642 1.214 . . . . 0.0 112.377 177.231 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . 0.756 0.6 OUTLIER -67.79 -40.45 83.92 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.868 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 71.6 t -60.98 -50.47 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.221 0.608 . . . . 0.0 110.861 -176.09 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 56.2 p -58.73 -43.44 90.18 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.422 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -59.48 -46.13 89.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 110.621 -2.99 . . . . 0.0 115.861 168.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 63.0 t -59.0 -43.47 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.658 1.183 . . . . 0.0 108.869 -178.175 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.9 t -50.54 -48.07 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 112.901 -1.954 . . . . 0.0 112.977 -171.228 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.272 10.7 m120 -99.9 25.82 6.94 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 172.149 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 65.91 5.12 3.28 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 127.51 2.324 . . . . 0.0 116.964 173.837 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 37.94 37.05 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.489 2.716 . . . . 0.0 115.719 -176.049 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.5 p 60.29 -49.54 0.09 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 126.486 1.915 . . . . 0.0 115.774 -163.252 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.266 74.3 m80 -147.83 101.01 3.27 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -175.635 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.43 158.07 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 O-C-N 119.877 -1.764 . . . . 0.0 114.222 170.005 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -57.7 133.31 55.24 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.22 -54.88 42.04 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -177.155 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.98 -38.74 8.06 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 118.553 2.797 . . . . 0.0 118.553 175.798 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 49.5 m -62.57 -49.02 76.93 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.45 -1.704 . . . . 0.0 107.282 177.987 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.57 -46.2 84.26 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 178.076 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.94 -37.09 71.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -178.44 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -77.24 -47.28 20.6 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 112.435 -2.166 . . . . 0.0 111.373 -179.365 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.79 -47.47 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 124.682 1.193 . . . . 0.0 108.009 178.308 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -54.58 -42.06 70.59 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 128.796 2.838 . . . . 0.0 111.73 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.53 66.68 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 112.005 -2.361 . . . . 0.0 110.815 176.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.61 -39.03 79.3 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 112.93 -1.941 . . . . 0.0 112.18 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 31.2 mtt -61.04 -49.07 78.89 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.638 -1.164 . . . . 0.0 114.031 -173.044 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.78 98.09 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 112.336 -2.211 . . . . 0.0 111.687 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.97 -37.78 88.46 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 112.292 -2.231 . . . . 0.0 112.785 -178.706 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 47.8 mt -102.03 22.84 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.605 1.962 . . . . 0.0 113.822 -174.29 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 55.16 28.46 11.07 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 174.393 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -99.44 167.49 10.59 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 113.594 -1.639 . . . . 0.0 110.159 -173.053 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -146.46 123.67 5.95 Favored Pre-proline 0 CA--C 1.555 1.146 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.421 -168.394 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -30.99 -46.34 0.16 Allowed 'Trans proline' 0 N--CA 1.485 0.994 1 C-N-CA 126.07 4.513 . . . . 0.0 116.33 179.855 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.356 7.7 t30 -103.16 126.15 50.19 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 156.871 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.79 66.68 1.53 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -176.643 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.1 p -123.84 64.07 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.489 177.117 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -127.28 -155.25 0.68 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.677 179.084 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 63.12 -39.98 0.18 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 178.237 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.289 0.1 OUTLIER -106.84 66.17 0.68 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 124.552 2.12 . . . . 0.0 111.193 173.383 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.0 mt . . . . . 0 N--CA 1.487 1.395 0 CA-C-N 110.621 -2.991 . . . . 0.0 113.271 -165.998 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.6 mtt . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 85.0 tttt 21.78 67.42 0.31 Allowed Pre-proline 0 N--CA 1.496 1.875 0 C-N-CA 128.854 2.861 . . . . 0.0 108.762 -169.828 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . 0.254 4.0 Cg_exo -53.57 -10.88 1.72 Allowed 'Trans proline' 0 C--N 1.358 1.069 1 N-CA-C 123.113 4.236 . . . . 0.0 123.113 -172.349 . . . . . . . . 3 2 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.386 0.4 OUTLIER -155.3 152.61 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 -178.926 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.9 p -90.31 120.77 31.73 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.776 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.8 mt -35.64 -22.19 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.978 0 C-N-CA 129.444 3.098 . . . . 0.0 118.666 -174.529 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -56.27 -36.17 68.27 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.026 0.53 . . . . 0.0 110.793 170.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.75 -49.88 75.7 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 117.946 -1.026 . . . . 0.0 113.194 173.619 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.6 t -56.96 -41.9 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.079 0.952 . . . . 0.0 113.335 172.168 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.02 -53.67 54.28 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 112.836 -1.984 . . . . 0.0 112.349 -179.244 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.62 -38.64 84.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.718 2.007 . . . . 0.0 114.031 178.164 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -66.14 -35.56 80.8 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.192 0.997 . . . . 0.0 110.763 176.58 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.47 -10.62 51.35 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.262 178.292 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.73 25.94 74.98 Favored Glycine 0 N--CA 1.479 1.514 0 C-N-CA 126.795 2.14 . . . . 0.0 112.204 174.109 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.6 p -119.56 132.02 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 123.785 0.834 . . . . 0.0 109.909 -168.683 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.7 p -38.7 124.64 1.37 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 128.933 2.893 . . . . 0.0 107.204 177.626 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.255 36.5 t80 -46.08 -37.45 6.83 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 116.661 2.097 . . . . 0.0 116.661 -171.517 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -52.3 -40.0 61.25 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -178.142 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 73.2 p -53.44 -50.15 65.85 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.436 1.094 . . . . 0.0 112.802 175.537 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.5 t -64.17 -55.44 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.657 -170.588 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.323 13.6 m -62.73 -33.3 74.85 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -43.44 98.81 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 117.225 2.306 . . . . 0.0 117.225 167.697 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.9 t -58.01 -49.01 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 127.157 2.183 . . . . 0.0 108.836 177.656 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.65 -44.61 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 CA-C-N 110.849 -2.887 . . . . 0.0 111.528 -169.678 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -96.62 11.4 35.42 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 113.444 -1.707 . . . . 0.0 114.178 176.857 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.279 24.5 tt0 60.11 20.74 9.97 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.272 2.629 . . . . 0.0 115.859 177.244 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.8 37.91 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 110.456 -3.065 . . . . 0.0 117.815 -176.639 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.4 t 65.78 -54.3 0.37 Allowed 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.667 1.587 . . . . 0.0 112.233 -163.751 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.256 69.6 m80 -144.82 89.95 2.02 Favored 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.442 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.9 p -100.67 146.82 8.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 119.985 -1.697 . . . . 0.0 114.028 174.296 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.05 138.51 58.19 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 174.929 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.98 -55.69 29.91 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -172.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.01 -36.01 16.7 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 117.694 2.479 . . . . 0.0 117.694 178.525 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.5 m -60.76 -48.69 80.66 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.417 176.811 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.49 -39.82 92.35 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 177.797 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -34.41 69.62 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -178.254 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -77.78 -47.68 18.4 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 111.783 -2.462 . . . . 0.0 110.824 -179.941 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 39.7 t -63.26 -35.87 73.81 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.03 179.958 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -61.5 -45.58 93.61 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 130.495 3.518 . . . . 0.0 113.394 -176.643 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.21 82.85 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.007 174.988 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.45 -44.72 76.65 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 112.009 -2.36 . . . . 0.0 113.156 175.959 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.9 mtt -59.36 -50.54 73.58 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.4 1.88 . . . . 0.0 114.892 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.62 89.07 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 112.892 -1.958 . . . . 0.0 112.584 179.866 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -66.54 -36.81 83.59 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 113.021 -1.9 . . . . 0.0 113.058 -179.931 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.6 mt -92.15 7.09 44.09 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 114.257 177.265 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.337 2.4 p-10 62.42 -49.68 0.17 Allowed 'General case' 0 C--N 1.346 0.428 0 C-N-CA 130.656 3.582 . . . . 0.0 117.374 -173.822 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . 0.268 7.4 t80 29.93 -91.23 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 110.565 -3.016 . . . . 0.0 116.597 -179.271 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.259 0.0 OUTLIER 123.8 94.08 0.0 OUTLIER Pre-proline 0 N--CA 1.509 2.517 0 C-N-CA 129.362 3.065 . . . . 0.0 111.779 -155.486 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.268 0.1 OUTLIER -22.19 -71.09 0.03 OUTLIER 'Trans proline' 0 CA--C 1.54 0.816 1 C-N-CA 127.357 5.371 . . . . 0.0 120.024 179.748 . . . . . . . . 4 3 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.268 4.3 p-10 -92.19 31.5 1.28 Allowed 'General case' 0 N--CA 1.477 0.906 1 N-CA-C 122.811 4.374 . . . . 0.0 122.811 -170.846 . . . . . . . . 3 2 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 52.05 107.78 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 127.302 2.241 . . . . 0.0 112.898 174.707 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 1.7 m -112.53 100.52 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 -179.211 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -24.81 106.63 0.03 OUTLIER 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 -179.35 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -109.87 -70.08 0.83 Allowed 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 113.223 -1.808 . . . . 0.0 108.761 161.342 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.56 107.97 16.89 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.879 -1.509 . . . . 0.0 107.511 165.945 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 N--CA 1.481 1.104 0 CA-C-N 112.052 -2.34 . . . . 0.0 116.072 -163.897 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.6 ptm . . . . . 0 N--CA 1.487 1.395 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.252 0.0 OUTLIER -134.46 162.84 55.28 Favored Pre-proline 0 CA--C 1.547 0.861 0 CA-C-O 116.651 -1.642 . . . . 0.0 115.116 168.733 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -84.41 -52.5 0.03 OUTLIER 'Trans proline' 0 N--CA 1.48 0.716 0 CA-C-N 121.951 1.733 . . . . 0.0 111.887 172.99 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.512 1.2 t -164.51 144.54 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 103.875 -2.639 . . . . 0.0 103.875 -165.08 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 p -94.6 141.13 28.96 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-O 118.65 -0.69 . . . . 0.0 109.232 -173.685 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.61 -13.48 3.96 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 120.499 3.518 . . . . 0.0 120.499 -158.023 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -57.85 -33.43 68.64 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 119.881 1.219 . . . . 0.0 111.622 175.561 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -65.9 -47.61 74.23 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.457 176.978 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.3 t -59.23 -43.84 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.577 0.751 . . . . 0.0 112.207 175.17 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.38 -50.55 73.25 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.07 1.348 . . . . 0.0 113.213 179.101 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -37.68 81.24 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 127.558 2.343 . . . . 0.0 114.196 177.424 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -63.94 -36.21 83.21 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.237 1.015 . . . . 0.0 109.767 175.751 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.12 -15.81 30.86 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.541 -179.142 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.23 19.05 78.85 Favored Glycine 0 N--CA 1.485 1.926 0 C-N-CA 127.451 2.453 . . . . 0.0 113.711 173.899 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -127.43 121.27 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 C-N-CA 124.08 0.952 . . . . 0.0 109.717 -166.536 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -17.06 138.22 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.846 0 C-N-CA 129.533 3.133 . . . . 0.0 112.02 -178.861 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -55.74 -27.8 52.56 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 118.527 -2.608 . . . . 0.0 115.177 170.423 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -54.29 -51.28 65.09 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 116.994 -1.479 . . . . 0.0 111.822 171.646 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -58.0 -50.45 73.36 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 179.275 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.293 71.8 t -63.19 -47.39 92.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.493 -173.58 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.6 p -59.2 -42.77 91.72 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -177.93 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 55.0 mtp85 -59.13 -50.77 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 110.007 -3.27 . . . . 0.0 115.004 168.647 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 88.6 t -59.28 -44.61 92.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 124.299 1.04 . . . . 0.0 109.281 -176.442 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.2 t -54.13 -50.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.006 -165.271 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.399 3.0 m120 -105.31 42.0 1.29 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 172.34 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.424 17.7 tt0 73.01 -3.28 2.47 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 121.346 3.832 . . . . 0.0 121.346 165.702 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.31 30.72 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 112.077 -2.329 . . . . 0.0 115.372 -176.546 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.8 p 60.96 -53.41 0.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.36 1.864 . . . . 0.0 114.322 -158.648 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -150.99 141.8 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 117.631 -1.175 . . . . 0.0 108.73 -178.964 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -150.33 159.79 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 121.08 1.764 . . . . 0.0 113.713 164.346 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -51.32 139.29 19.46 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 175.569 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.86 -57.56 11.56 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.568 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -41.94 -41.19 2.4 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 177.684 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.6 m -58.5 -48.89 79.3 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 114.256 -1.338 . . . . 0.0 108.676 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 40.2 mtt-85 -60.47 -46.4 90.22 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 125.539 1.536 . . . . 0.0 113.964 -179.956 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -32.04 70.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -178.318 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ttpt -80.46 -41.62 24.08 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 111.338 -2.665 . . . . 0.0 112.516 -178.904 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.4 t -61.79 -51.32 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 126.326 1.85 . . . . 0.0 107.611 172.315 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.08 -41.06 91.63 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.54 1.936 . . . . 0.0 115.133 -175.955 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.3 -51.1 62.91 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 112.329 -2.214 . . . . 0.0 110.751 174.063 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.19 -41.53 84.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.297 -1.774 . . . . 0.0 113.559 176.554 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 mtt -62.58 -44.59 95.94 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -179.894 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.62 98.31 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.875 178.411 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -64.57 -37.86 89.03 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.006 -1.906 . . . . 0.0 112.925 179.855 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 40.8 mt -95.91 16.21 18.35 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.082 2.553 . . . . 0.0 115.135 178.612 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.328 0.1 OUTLIER 45.63 30.11 0.75 Allowed 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.588 2.811 . . . . 0.0 118.588 -178.199 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -93.7 88.26 5.76 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 112.25 -2.25 . . . . 0.0 111.422 -163.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -7.81 112.83 0.03 OUTLIER Pre-proline 0 N--CA 1.509 2.482 0 CA-C-N 111.378 -2.646 . . . . 0.0 113.278 153.614 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -62.07 67.78 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.74 2.294 . . . . 0.0 115.008 171.088 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 173.56 156.47 0.12 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.594 2.358 . . . . 0.0 110.995 169.414 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 99.81 7.4 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 118.735 0.698 . . . . 0.0 109.211 166.006 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.7 m -83.87 140.11 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 165.21 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -108.34 116.57 32.21 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 -165.348 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -103.08 -39.07 7.04 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 112.968 -1.924 . . . . 0.0 108.251 161.572 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -43.5 84.27 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 113.852 -1.522 . . . . 0.0 111.147 152.622 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.6 mt . . . . . 0 N--CA 1.482 1.128 0 CA-C-N 111.735 -2.484 . . . . 0.0 112.971 -179.3 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.423 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 105.465 -2.05 . . . . 0.0 105.465 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 1.1 p -60.0 97.02 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 127.053 2.141 . . . . 0.0 107.415 174.29 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.3 mt -39.95 -19.96 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 119.085 2.994 . . . . 0.0 119.085 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -54.85 -35.22 63.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.228 0.611 . . . . 0.0 111.353 166.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -58.01 -48.87 78.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.071 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -58.25 -46.35 88.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 173.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.64 -50.73 69.42 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 112.629 -2.078 . . . . 0.0 111.917 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -43.39 75.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.83 2.452 . . . . 0.0 113.844 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -66.98 -33.7 76.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.266 1.026 . . . . 0.0 110.384 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.08 -9.26 57.03 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.081 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.54 24.45 76.2 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 126.821 2.153 . . . . 0.0 112.477 170.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.9 p -122.77 134.19 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 124.183 0.993 . . . . 0.0 110.665 -170.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.4 p -41.08 128.54 2.8 Favored 'General case' 0 N--CA 1.51 2.558 0 C-N-CA 127.648 2.379 . . . . 0.0 107.751 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -42.98 -31.31 0.5 Allowed 'General case' 0 N--CA 1.523 3.186 0 N-CA-C 116.658 2.096 . . . . 0.0 116.658 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -48.25 -45.16 34.06 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 125.175 1.547 . . . . 0.0 112.149 177.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 23' ' ' VAL . 6.7 p -59.88 -53.98 51.5 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 178.047 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' HG23 ' A' ' 24' ' ' VAL 0.329 79.3 t -59.86 -50.97 78.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.705 0.802 . . . . 0.0 111.25 -163.785 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.508 49.4 m -66.3 -29.01 69.14 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -44.4 92.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 112.429 -2.169 . . . . 0.0 115.736 164.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 38' ' ' VAL . 75.4 t -60.94 -43.9 96.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.564 1.545 . . . . 0.0 108.4 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 20' ' ' VAL . 84.1 t -53.8 -49.07 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.334 -172.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -90.94 14.81 12.78 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 171.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 63.3 14.7 8.05 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.196 2.599 . . . . 0.0 117.819 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 29.06 40.96 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 110.53 -3.032 . . . . 0.0 116.326 -172.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p 56.59 -52.96 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.62 1.968 . . . . 0.0 115.919 -165.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -137.27 117.03 13.08 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 170.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -133.73 154.39 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 120.18 1.355 . . . . 0.0 113.215 169.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 p -59.94 128.62 37.77 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.706 0.802 . . . . 0.0 112.757 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.79 -53.79 36.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -174.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.87 -36.95 8.08 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 42.1 m -60.63 -49.25 78.29 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.509 1.524 . . . . 0.0 108.142 175.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.3 mtp-105 -60.41 -43.49 96.67 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.214 1.806 . . . . 0.0 113.182 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -35.06 70.84 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -77.89 -46.23 21.92 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 112.071 -2.331 . . . . 0.0 111.604 -179.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.464 HG21 HG11 ' A' ' 23' ' ' VAL . 51.1 t -62.52 -47.29 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 C-N-CA 126.169 1.788 . . . . 0.0 108.039 177.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.24 -43.8 79.03 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 128.888 2.875 . . . . 0.0 111.57 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -52.63 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 112.235 -2.257 . . . . 0.0 110.673 176.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.58 -39.68 68.05 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 112.903 -1.953 . . . . 0.0 113.174 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.1 mtt -59.87 -52.81 63.85 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 117.428 2.381 . . . . 0.0 117.428 -173.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.04 96.52 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 112.412 -2.176 . . . . 0.0 112.866 178.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.92 -33.1 75.04 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 111.324 -2.671 . . . . 0.0 113.987 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 65.2 mt -98.78 21.11 11.9 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.996 1.718 . . . . 0.0 113.878 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.17 24.14 7.73 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -99.74 157.26 16.61 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -172.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.358 7.2 mm . . . . . 0 C--N 1.328 -0.326 0 N-CA-C 118.806 2.891 . . . . 0.0 118.806 -177.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.443 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.458 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 p -78.56 114.75 17.75 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 102.706 -3.072 . . . . 0.0 102.706 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.525 HD21 ' CZ ' ' A' ' 47' ' ' TYR . 24.3 mt -48.69 -19.91 0.41 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 70.5 m-85 -54.74 -35.52 63.81 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.382 0.673 . . . . 0.0 111.318 167.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.45 ' OD2' HD22 ' A' ' 45' ' ' LEU . 36.6 t0 -60.76 -47.69 85.19 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.992 172.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HA ' HD13 ' A' ' 45' ' ' LEU . 93.7 t -59.26 -43.06 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.83 -52.84 61.59 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 111.582 -2.553 . . . . 0.0 111.877 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.481 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.4 OUTLIER -65.39 -39.47 92.26 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.387 1.875 . . . . 0.0 113.868 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.427 ' CB ' HD11 ' A' ' 45' ' ' LEU . 33.9 t80 -66.97 -34.32 77.5 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.156 0.91 . . . . 0.0 110.829 177.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.45 -13.46 34.77 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 125.018 1.327 . . . . 0.0 112.099 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.39 26.3 72.27 Favored Glycine 0 CA--C 1.546 2.002 0 C-N-CA 126.674 2.083 . . . . 0.0 112.985 173.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -125.96 136.14 61.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 121.448 0.642 . . . . 0.0 109.865 -171.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.8 p -36.65 128.65 0.82 Allowed 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 128.694 2.798 . . . . 0.0 108.131 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -49.23 -36.55 20.48 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.605 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.522 0.0 OUTLIER -59.48 -27.19 65.9 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 121.734 3.975 . . . . 0.0 121.734 172.695 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 44.3 p -62.58 -52.82 61.88 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.457 1.098 . . . . 0.0 111.796 163.433 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.648 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.4 t -59.28 -50.29 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.969 1.308 . . . . 0.0 108.532 -173.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.7 p -55.69 -42.47 75.25 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.683 1.193 . . . . 0.0 113.901 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.605 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 40.8 mtt85 -62.06 -47.41 84.8 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 111.817 -2.447 . . . . 0.0 116.328 170.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.498 HG11 HG21 ' A' ' 38' ' ' VAL . 49.1 t -58.28 -41.38 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 C-N-CA 127.048 2.139 . . . . 0.0 107.556 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 20' ' ' VAL . 57.5 t -56.8 -42.55 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.286 -170.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.284 85.6 m-20 -101.31 22.99 11.61 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 168.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.389 9.3 pt20 58.47 -0.36 0.12 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 130.988 3.715 . . . . 0.0 119.404 -177.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.09 33.08 0.14 Allowed 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 112.14 -2.3 . . . . 0.0 114.716 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p 59.96 -54.04 0.07 Allowed 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 126.999 2.12 . . . . 0.0 114.432 -159.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -144.41 116.37 8.32 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-N 113.606 -1.634 . . . . 0.0 111.985 -172.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.2 t -146.43 156.49 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 120.254 1.388 . . . . 0.0 113.083 168.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -45.57 133.82 7.55 Favored 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.89 -53.44 52.61 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -49.11 -35.59 16.73 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 117.827 2.529 . . . . 0.0 117.827 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 56.7 m -60.05 -50.24 74.5 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -58.48 -42.5 87.69 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.81 -39.78 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -74.34 -43.79 55.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.531 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.498 HG21 HG11 ' A' ' 23' ' ' VAL . 45.7 t -63.08 -49.1 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 125.83 1.652 . . . . 0.0 108.052 177.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.87 -41.38 82.35 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.251 2.62 . . . . 0.0 114.886 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -49.31 75.1 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 111.311 -2.677 . . . . 0.0 110.325 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.61 -39.86 85.65 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 112.638 -2.074 . . . . 0.0 113.308 175.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.7 mtt -58.89 -51.59 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.68 97.68 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 112.248 -2.251 . . . . 0.0 111.88 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -62.85 -42.51 99.77 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 111.534 -2.575 . . . . 0.0 112.249 -178.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 9' ' ' VAL . 51.8 mt -93.09 23.21 4.44 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.355 1.862 . . . . 0.0 114.02 -177.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 50.4 34.15 8.73 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.955 2.206 . . . . 0.0 116.955 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.525 ' CZ ' HD21 ' A' ' 6' ' ' LEU . 32.0 t80 -96.17 160.69 14.31 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 113.986 -1.461 . . . . 0.0 112.754 -173.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.898 0 CA-C-N 112.556 -2.111 . . . . 0.0 109.048 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 103.448 -2.797 . . . . 0.0 103.448 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.257 80.3 m -61.86 110.46 1.55 Allowed 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 105.202 -2.148 . . . . 0.0 105.202 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -51.85 -17.46 0.97 Allowed 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.586 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.373 23.1 m-85 -57.78 -29.38 64.8 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 120.28 1.4 . . . . 0.0 112.687 165.652 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -63.43 -50.96 67.72 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.399 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -56.89 -43.04 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 CA-C-O 121.302 0.572 . . . . 0.0 112.418 175.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -61.12 -50.77 71.86 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 112.436 -2.165 . . . . 0.0 111.847 -176.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.586 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -68.78 -40.65 79.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.624 1.97 . . . . 0.0 115.182 175.781 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -62.79 -33.93 76.21 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.048 1.339 . . . . 0.0 110.079 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.68 -22.64 17.43 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 113.891 -1.504 . . . . 0.0 111.663 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.53 25.35 56.91 Favored Glycine 0 CA--C 1.554 2.524 0 C-N-CA 125.699 1.619 . . . . 0.0 113.18 173.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.538 HG22 HG21 ' A' ' 19' ' ' THR . 6.9 p -126.25 94.5 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.222 0 C-N-CA 122.992 0.517 . . . . 0.0 110.066 -167.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.6 p -7.62 127.11 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.734 0 C-N-CA 127.334 2.254 . . . . 0.0 113.672 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -50.17 -38.89 41.88 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 117.924 2.565 . . . . 0.0 117.924 -171.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -51.2 -40.11 57.98 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 118.906 0.775 . . . . 0.0 112.472 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.538 HG21 HG22 ' A' ' 15' ' ' VAL . 20.4 m -55.39 -53.26 58.48 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.835 2.054 . . . . 0.0 112.169 171.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.675 ' O ' HG23 ' A' ' 24' ' ' VAL . 73.6 t -63.73 -53.42 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-O 118.675 -0.679 . . . . 0.0 109.698 -173.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.413 3.2 m -60.22 -34.09 73.17 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 117.198 2.295 . . . . 0.0 117.198 -177.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 mtp85 -59.06 -49.54 77.51 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.249 -1.796 . . . . 0.0 115.36 166.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.827 HG11 HG21 ' A' ' 38' ' ' VAL . 29.5 t -57.82 -47.24 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 126.533 1.933 . . . . 0.0 108.749 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 20' ' ' VAL . 39.3 t -57.35 -42.07 79.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 O-C-N 126.594 2.434 . . . . 0.0 112.299 -166.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -94.54 15.01 19.04 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 125.209 1.568 . . . . 0.0 112.773 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 69.03 9.63 7.51 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.15 2.18 . . . . 0.0 116.571 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.66 38.63 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.789 -2.46 . . . . 0.0 117.197 -173.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.4 p 58.88 -50.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 126.343 1.857 . . . . 0.0 115.758 -164.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -146.86 93.8 2.33 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.44 HG11 ' HD3' ' A' ' 35' ' ' ARG . 11.1 p -116.63 155.34 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.58 124.87 21.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.82 -63.56 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.695 ' HE3' ' H ' ' A' ' 33' ' ' LYS 0.362 0.1 OUTLIER -42.6 -35.63 1.15 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 119.652 3.204 . . . . 0.0 119.652 173.078 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 m -65.46 -50.55 64.95 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 112.879 -1.964 . . . . 0.0 108.178 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.674 ' HD2' HG13 ' A' ' 23' ' ' VAL . 6.5 mmm180 -57.16 -45.79 83.32 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 178.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.59 -36.43 73.99 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.5 ttmt -76.06 -44.32 39.6 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 112.266 -2.243 . . . . 0.0 111.186 -177.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.827 HG21 HG11 ' A' ' 23' ' ' VAL . 55.1 t -63.91 -47.94 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 126.463 1.905 . . . . 0.0 108.18 177.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 46.2 mt-10 -54.55 -44.84 73.21 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.452 2.701 . . . . 0.0 111.405 -178.074 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.89 69.53 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.142 -2.299 . . . . 0.0 111.0 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.52 -41.37 89.83 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 113.206 -1.816 . . . . 0.0 114.019 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.5 mtt -62.07 -44.83 95.82 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 119.949 -1.719 . . . . 0.0 112.962 -174.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.52 93.49 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 126.271 2.232 . . . . 0.0 111.496 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -65.91 -34.18 77.53 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.914 -2.403 . . . . 0.0 113.351 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.5 mt -97.24 13.92 27.8 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.294 2.237 . . . . 0.0 114.486 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.37 33.75 21.48 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 117.573 2.435 . . . . 0.0 117.573 175.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -92.1 152.68 19.81 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.925 -171.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.294 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.74 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.694 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.53 1.1 t . . . . . 0 N--CA 1.497 1.925 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 40.0 p -95.32 145.33 25.18 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.262 0.937 . . . . 0.0 109.556 -175.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.534 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 4.6 mt -59.94 -14.9 17.94 Favored 'General case' 0 N--CA 1.506 2.343 0 N-CA-C 117.095 2.258 . . . . 0.0 117.095 -163.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.491 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 47.2 m-85 -55.87 -38.42 70.1 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.468 1.485 . . . . 0.0 111.448 174.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -64.73 -44.51 89.94 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.767 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.423 ' HA ' HD13 ' A' ' 45' ' ' LEU . 81.1 t -59.64 -43.61 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-N 118.747 0.703 . . . . 0.0 112.886 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.9 69.94 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 113.173 -1.83 . . . . 0.0 113.394 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.491 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.5 OUTLIER -66.75 -39.55 87.94 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.473 1.909 . . . . 0.0 114.274 174.585 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -63.43 -33.7 76.13 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.414 1.086 . . . . 0.0 110.31 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.28 -19.58 19.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.106 1.362 . . . . 0.0 112.216 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.83 25.1 56.92 Favored Glycine 0 CA--C 1.549 2.216 0 C-N-CA 126.613 2.054 . . . . 0.0 113.399 174.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.471 HG22 HG21 ' A' ' 19' ' ' THR 0.268 3.9 p -129.83 119.16 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.33 0 C-N-CA 124.914 1.285 . . . . 0.0 108.24 -166.482 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.7 p -27.47 143.55 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.344 0 C-N-CA 128.647 2.779 . . . . 0.0 111.849 -174.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' A' ' 6' ' ' LEU . 64.2 t80 -57.62 -34.33 69.19 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 119.238 -2.164 . . . . 0.0 114.665 175.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.266 14.8 tp60 -56.41 -45.95 80.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 117.434 -1.27 . . . . 0.0 112.596 173.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' HG23 ' A' ' 23' ' ' VAL . 86.4 m -53.31 -54.17 40.35 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.885 1.274 . . . . 0.0 111.388 175.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' HG23 ' A' ' 24' ' ' VAL . 70.6 t -64.18 -49.26 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.837 -176.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.281 69.6 p -57.42 -39.38 76.07 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 119.196 3.036 . . . . 0.0 119.196 -174.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 19' ' ' THR . 36.6 mtp85 -61.58 -51.18 69.6 Favored 'General case' 0 C--N 1.319 -0.72 1 CA-C-N 106.857 -4.701 . . . . 0.0 114.198 167.123 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 19' ' ' THR . 95.1 t -58.58 -43.01 86.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.861 1.265 . . . . 0.0 109.764 -176.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 20' ' ' VAL . 75.9 t -49.14 -53.22 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 112.705 -2.043 . . . . 0.0 111.816 -171.084 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.331 93.8 m-20 -107.37 37.43 2.4 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 113.67 -1.605 . . . . 0.0 114.589 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.253 1.2 tp-100 73.92 -5.46 2.03 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 129.289 3.036 . . . . 0.0 117.873 166.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 36.69 36.32 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 113.302 -1.772 . . . . 0.0 115.256 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.0 p 55.31 -48.37 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -151.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.262 71.7 m80 -157.57 130.91 7.77 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -170.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -145.5 150.68 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 116.967 2.21 . . . . 0.0 116.967 162.331 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.3 p -51.47 139.47 19.88 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -57.48 9.34 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -173.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.523 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -40.2 -43.22 1.63 Allowed 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 176.436 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.8 m -57.79 -48.79 78.69 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 126.528 1.931 . . . . 0.0 108.577 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtt-85 -65.33 -44.8 86.63 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 117.475 2.398 . . . . 0.0 117.475 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.21 -29.94 64.15 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -80.31 -42.28 23.31 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 111.381 -2.645 . . . . 0.0 112.048 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.54 -49.7 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 125.686 1.595 . . . . 0.0 109.204 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -55.63 -46.84 77.34 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.605 3.162 . . . . 0.0 111.757 -176.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -51.17 64.02 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.339 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.97 -42.05 84.23 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 112.974 -1.921 . . . . 0.0 114.598 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -56.09 -45.2 79.49 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 178.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.09 -43.74 91.1 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.646 -2.07 . . . . 0.0 113.071 177.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -66.1 -38.46 88.27 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 112.759 -2.019 . . . . 0.0 113.014 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 9' ' ' VAL . 30.3 mt -85.3 13.66 6.25 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 127.089 2.156 . . . . 0.0 113.842 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.401 0.2 OUTLIER 44.99 31.5 0.71 Allowed 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 115.98 1.844 . . . . 0.0 115.98 -176.579 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -98.59 101.14 12.47 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.058 -160.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.173 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 167.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.434 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.483 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -77.56 107.0 9.71 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 101.388 -3.56 . . . . 0.0 101.388 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.412 HD11 ' OH ' ' A' ' 47' ' ' TYR . 76.8 mt -51.14 -10.24 0.07 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 120.161 3.393 . . . . 0.0 120.161 -175.186 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -53.75 -31.9 50.23 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.644 0.656 . . . . 0.0 112.221 162.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.76 -52.74 62.99 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 176.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.15 -43.23 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 172.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.05 -51.09 71.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 113.119 -1.855 . . . . 0.0 111.876 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -39.5 91.24 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.219 2.207 . . . . 0.0 114.146 174.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -65.79 -34.05 77.28 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.141 0.977 . . . . 0.0 110.909 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.39 -13.63 37.31 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.829 1.251 . . . . 0.0 111.332 177.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.9 23.12 64.67 Favored Glycine 0 N--CA 1.491 2.32 0 C-N-CA 127.199 2.333 . . . . 0.0 113.387 172.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.49 124.28 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.514 1.126 . . . . 0.0 111.331 -168.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -32.2 129.63 0.18 Allowed 'General case' 0 N--CA 1.526 3.336 0 C-N-CA 125.347 1.459 . . . . 0.0 109.631 175.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -45.26 -34.57 2.93 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 118.318 2.711 . . . . 0.0 118.318 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -50.58 -30.2 12.66 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.436 ' O ' HG23 ' A' ' 23' ' ' VAL . 13.9 p -66.77 -56.67 9.43 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 168.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.661 ' O ' HG23 ' A' ' 24' ' ' VAL . 78.5 t -57.47 -53.48 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 C-N-CA 123.901 0.88 . . . . 0.0 110.237 -164.18 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 2.0 m -60.93 -35.04 75.68 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -64.51 -47.33 79.3 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 19' ' ' THR . 93.0 t -59.56 -40.9 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.207 1.403 . . . . 0.0 108.851 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 20' ' ' VAL . 91.9 t -51.14 -46.18 31.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 O-C-N 125.461 1.726 . . . . 0.0 111.492 -171.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.303 94.7 m-20 -107.42 32.4 4.69 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 173.313 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 64.52 0.34 1.08 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 130.089 3.355 . . . . 0.0 118.95 175.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.59 35.25 0.18 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 113.064 -1.88 . . . . 0.0 114.698 -173.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.9 p 62.52 -44.95 0.18 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -158.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.298 69.1 m80 -165.51 116.75 1.09 Allowed 'General case' 0 CA--C 1.561 1.395 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 -168.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.561 HG12 ' NH1' ' A' ' 35' ' ' ARG . 1.0 OUTLIER -136.4 162.67 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 159.584 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 p -45.94 135.61 7.13 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.67 -61.1 2.3 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -171.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.3 pptp? -39.69 -37.47 0.52 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 117.82 2.526 . . . . 0.0 117.82 176.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -61.41 -50.03 74.5 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.447 1.499 . . . . 0.0 108.866 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.561 ' NH1' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.82 -43.84 97.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 178.486 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.99 -35.46 76.88 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -80.18 -46.04 17.04 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 112.657 -2.065 . . . . 0.0 112.243 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 HG21 ' A' ' 23' ' ' VAL . 79.7 t -59.91 -49.93 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.527 1.131 . . . . 0.0 108.953 173.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -56.35 -41.54 76.27 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.816 2.046 . . . . 0.0 114.91 -178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.93 -53.28 52.72 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 111.679 -2.51 . . . . 0.0 110.469 175.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.55 -40.45 78.9 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 113.298 -1.773 . . . . 0.0 113.476 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.0 mtt -59.44 -48.55 81.2 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -176.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.88 -41.05 95.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 112.175 -2.284 . . . . 0.0 112.996 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -65.6 -37.18 85.89 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.292 -1.776 . . . . 0.0 113.286 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.9 mt -90.81 14.33 13.89 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.538 2.335 . . . . 0.0 112.878 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.275 3.7 p-10 53.92 19.05 1.82 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 120.029 3.344 . . . . 0.0 120.029 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.412 ' OH ' HD11 ' A' ' 6' ' ' LEU . 42.4 t80 -87.45 91.82 8.87 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 112.243 -2.253 . . . . 0.0 110.887 -169.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.51 2.557 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.236 153.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.378 1.2 t . . . . . 0 N--CA 1.484 1.269 0 CA-C-O 122.134 0.969 . . . . 0.0 108.606 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.417 1.2 m -51.85 109.17 0.34 Allowed 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 131.014 3.725 . . . . 0.0 107.701 175.196 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -48.71 -24.46 1.39 Allowed 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 117.726 2.491 . . . . 0.0 117.726 171.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.262 54.0 m-85 -61.62 -31.57 71.66 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 168.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.66 -46.56 87.64 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 118.154 -0.927 . . . . 0.0 110.464 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.402 ' HA ' HD13 ' A' ' 45' ' ' LEU . 60.9 t -56.94 -42.74 79.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 174.351 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.59 -54.9 39.85 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.809 1.644 . . . . 0.0 112.709 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -36.61 84.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.157 1.783 . . . . 0.0 113.387 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -64.93 -37.38 87.45 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.873 0.844 . . . . 0.0 109.859 177.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.66 -10.86 50.09 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.604 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.54 24.19 73.39 Favored Glycine 0 N--CA 1.487 2.061 0 C-N-CA 127.528 2.49 . . . . 0.0 113.431 172.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -125.98 122.49 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.026 0.93 . . . . 0.0 111.879 -167.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.7 p -29.41 121.42 0.15 Allowed 'General case' 0 N--CA 1.524 3.249 0 C-N-CA 127.929 2.491 . . . . 0.0 107.95 171.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -49.85 -27.47 5.14 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -46.1 -40.51 11.0 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.94 1.4 . . . . 0.0 112.133 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 23' ' ' VAL . 10.4 p -61.07 -55.24 34.92 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 173.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' HG23 ' A' ' 24' ' ' VAL 0.255 74.2 t -59.96 -46.65 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.617 1.167 . . . . 0.0 109.648 -169.683 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.9 p -59.77 -45.87 90.93 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.5 mtp85 -57.5 -46.47 83.73 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.595 -2.093 . . . . 0.0 114.843 170.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.591 HG21 HG21 ' A' ' 38' ' ' VAL . 79.0 t -60.18 -44.94 96.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.724 1.209 . . . . 0.0 109.089 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 20' ' ' VAL . 82.2 t -52.92 -46.17 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 O-C-N 126.213 2.196 . . . . 0.0 111.269 -169.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.251 95.0 m-20 -106.57 27.68 8.58 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 65.7 9.08 5.66 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 118.518 2.785 . . . . 0.0 118.518 171.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 34.25 33.68 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 128.266 2.626 . . . . 0.0 116.423 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 58.84 -42.75 0.07 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 -160.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -149.0 92.78 2.01 Favored 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.7 p -110.18 151.92 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 N-CA-C 117.223 2.305 . . . . 0.0 117.223 171.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -65.07 136.41 56.71 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 176.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.64 -43.38 96.96 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -175.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.792 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -49.85 -45.14 50.12 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 173.746 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.9 m -64.34 -47.47 79.25 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 112.658 -2.064 . . . . 0.0 108.386 177.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -56.45 -42.46 78.2 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.126 1.37 . . . . 0.0 114.631 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -60.96 -39.83 91.01 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 113.394 -1.73 . . . . 0.0 113.733 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -72.99 -43.59 62.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.661 1.985 . . . . 0.0 111.031 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.591 HG21 HG21 ' A' ' 23' ' ' VAL . 60.8 t -66.08 -48.98 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.087 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.7 mt-10 -52.49 -45.07 66.03 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 130.913 3.685 . . . . 0.0 110.354 -178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.71 -51.14 66.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.172 176.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -46.15 87.16 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.339 -1.755 . . . . 0.0 113.306 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.41 -45.38 80.69 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.679 1.592 . . . . 0.0 112.972 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.57 -46.45 88.3 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 112.903 -1.953 . . . . 0.0 112.34 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -64.43 -38.49 91.2 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.034 -2.348 . . . . 0.0 112.837 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 9' ' ' VAL . 11.4 mt -87.32 11.92 13.2 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.939 2.496 . . . . 0.0 114.185 -178.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.41 0.2 OUTLIER 52.47 23.58 2.6 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.196 2.598 . . . . 0.0 113.388 -176.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -96.56 87.63 4.44 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.386 -1.446 . . . . 0.0 110.52 -159.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.519 2.987 0 CA-C-N 113.178 -1.828 . . . . 0.0 113.509 153.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.308 4.2 p -70.39 97.6 1.29 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -177.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.4 mt -41.49 -14.27 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 -175.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.463 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 49.3 m-85 -53.74 -33.3 55.28 Favored 'General case' 0 CA--C 1.561 1.368 0 O-C-N 123.514 0.508 . . . . 0.0 110.913 165.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -59.07 -52.4 65.89 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 118.474 -0.774 . . . . 0.0 113.024 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 66.5 t -57.99 -45.04 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.506 0.722 . . . . 0.0 112.855 174.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.93 -49.18 78.81 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 113.444 -1.707 . . . . 0.0 112.016 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.463 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.4 OUTLIER -67.82 -43.61 79.2 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.139 1.776 . . . . 0.0 115.198 176.864 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -32.38 74.03 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.792 0.837 . . . . 0.0 111.311 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.7 -17.39 26.84 Favored 'General case' 0 CA--C 1.562 1.408 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.062 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.03 23.42 69.03 Favored Glycine 0 N--CA 1.49 2.264 0 C-N-CA 125.721 1.629 . . . . 0.0 113.524 173.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.449 HG22 HG21 ' A' ' 19' ' ' THR 0.253 4.5 p -123.28 126.07 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.426 0 C-N-CA 124.627 1.171 . . . . 0.0 107.929 -170.119 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' HB ' ' A' ' 19' ' ' THR . 83.2 p -33.24 139.48 0.05 Allowed 'General case' 0 N--CA 1.528 3.432 0 C-N-CA 126.21 1.804 . . . . 0.0 111.269 -177.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.365 55.2 t80 -40.45 -65.87 0.37 Allowed 'General case' 0 N--CA 1.519 3.019 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.48 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.401 0.8 OUTLIER -58.0 -23.47 54.18 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 121.785 3.994 . . . . 0.0 121.785 -177.39 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.516 ' O ' HG23 ' A' ' 23' ' ' VAL . 83.4 m -53.64 -48.43 69.38 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.595 163.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.584 ' O ' HG23 ' A' ' 24' ' ' VAL . 98.9 t -65.57 -51.31 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.199 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.253 1.3 m -57.26 -36.03 70.47 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -178.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.54 ' HG3' HH11 ' A' ' 22' ' ' ARG . 10.8 mtt85 -59.21 -49.24 78.6 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 166.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 38' ' ' VAL . 77.3 t -59.41 -41.0 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.454 -176.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 20' ' ' VAL . 92.1 t -54.68 -50.23 61.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.319 0 CA-C-N 112.974 -1.921 . . . . 0.0 112.409 -167.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.398 55.9 m-20 -100.6 29.74 4.31 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 170.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.81 14.65 7.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 129.16 2.984 . . . . 0.0 118.445 169.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.04 47.46 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 111.036 -2.802 . . . . 0.0 115.413 -173.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.254 91.5 p 57.32 -59.86 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 126.288 1.835 . . . . 0.0 115.214 -161.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -141.16 94.6 2.72 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -177.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.28 150.68 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 p -60.89 142.06 56.63 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -38.58 -79.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.125 2.17 . . . . 0.0 115.682 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -34.37 55.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 38' ' ' VAL . 47.8 m -61.74 -49.28 77.04 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.618 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.415 ' HB3' ' OE1' ' A' ' 39' ' ' GLU . 12.2 mtm105 -58.39 -53.37 59.02 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.305 1.594 . . . . 0.0 115.305 173.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -50.85 -38.57 49.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -76.82 -47.88 20.13 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 111.242 -2.708 . . . . 0.0 113.127 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 23' ' ' VAL . 43.2 t -61.18 -48.54 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.377 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.415 ' OE1' ' HB3' ' A' ' 35' ' ' ARG . 47.0 mt-10 -57.46 -45.83 84.32 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 128.161 2.584 . . . . 0.0 114.973 -178.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.12 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 112.855 -1.975 . . . . 0.0 110.665 176.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.42 -36.94 74.38 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 112.763 -2.017 . . . . 0.0 115.081 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 20.5 mtt -60.65 -53.33 58.72 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -171.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.31 97.31 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 113.499 -1.682 . . . . 0.0 113.311 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.63 -39.29 93.44 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.264 -2.244 . . . . 0.0 113.693 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.2 mt -94.3 25.3 3.91 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.933 1.693 . . . . 0.0 112.682 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.3 p30 59.54 21.57 10.12 Favored 'General case' 0 CA--C 1.57 1.741 0 C-N-CA 125.473 1.509 . . . . 0.0 114.32 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -93.19 166.57 12.26 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.956 0.902 . . . . 0.0 110.009 -175.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.702 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.457 1.1 t . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 103.374 -2.825 . . . . 0.0 103.374 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.8 p -101.99 145.44 29.28 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 117.57 -1.652 . . . . 0.0 108.944 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.24 -9.58 1.01 Allowed 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -165.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -58.82 -37.56 76.67 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.926 0.784 . . . . 0.0 111.514 170.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.434 ' OD2' HD22 ' A' ' 45' ' ' LEU . 54.1 t0 -62.31 -48.43 79.9 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 118.062 -0.971 . . . . 0.0 111.603 176.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.21 -40.89 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 N-CA-C 112.235 0.458 . . . . 0.0 112.235 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.47 -55.26 36.9 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 125.827 1.651 . . . . 0.0 114.716 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -41.68 94.36 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 127.153 2.181 . . . . 0.0 113.841 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CB ' HD11 ' A' ' 45' ' ' LEU . 35.7 t80 -65.91 -31.47 72.43 Favored 'General case' 0 CA--C 1.551 0.981 0 O-C-N 124.411 1.07 . . . . 0.0 110.592 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.84 -16.86 22.59 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.111 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.94 23.2 59.92 Favored Glycine 0 CA--C 1.547 2.04 0 C-N-CA 126.496 1.998 . . . . 0.0 113.459 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.272 9.9 p -128.54 129.0 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -167.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.8 p -35.44 146.86 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 128.283 2.633 . . . . 0.0 112.181 -172.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -59.37 -32.8 70.46 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 119.192 -2.192 . . . . 0.0 114.648 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.271 27.2 tp60 -55.28 -38.93 69.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 117.473 -1.251 . . . . 0.0 113.01 171.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.459 ' O ' HG23 ' A' ' 23' ' ' VAL . 20.3 m -59.9 -53.39 58.49 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.469 0.708 . . . . 0.0 110.917 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.591 ' O ' HG23 ' A' ' 24' ' ' VAL 0.377 62.7 t -65.52 -43.11 94.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.826 -171.579 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.9 p -58.31 -48.1 81.6 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.452 HH11 ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -55.07 -53.6 53.82 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 110.932 -2.849 . . . . 0.0 113.491 170.597 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.763 HG11 HG21 ' A' ' 38' ' ' VAL . 76.4 t -62.24 -44.81 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.991 -174.295 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 20' ' ' VAL . 41.9 t -64.28 -41.64 93.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 CA-C-N 113.771 -1.558 . . . . 0.0 111.23 -168.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -77.22 5.07 9.1 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 113.787 -1.551 . . . . 0.0 113.832 169.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.512 ' OE1' ' HD2' ' A' ' 35' ' ' ARG . 14.9 mm100 69.97 3.68 4.45 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.895 2.478 . . . . 0.0 114.653 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.61 42.35 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 128.745 2.818 . . . . 0.0 116.898 -173.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.259 84.8 p 65.41 -62.19 0.23 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.584 1.954 . . . . 0.0 112.266 -164.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.8 m170 -138.2 137.57 37.7 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 124.2 0.938 . . . . 0.0 109.357 172.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.42 ' CG1' ' HD3' ' A' ' 35' ' ' ARG 0.253 1.4 p -138.21 153.84 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 120.278 1.399 . . . . 0.0 113.671 175.381 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -55.66 126.41 25.31 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.01 -60.88 1.27 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.1 -31.82 69.26 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.7 m -60.5 -48.17 82.92 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.145 1.378 . . . . 0.0 107.506 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.512 ' HD2' ' OE1' ' A' ' 26' ' ' GLN . 2.8 mtp85 -61.14 -44.66 96.98 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 116.773 2.138 . . . . 0.0 116.773 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.61 -34.36 71.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.864 178.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -80.28 -43.52 21.17 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.534 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.763 HG21 HG11 ' A' ' 23' ' ' VAL . 64.1 t -60.82 -48.28 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.549 1.54 . . . . 0.0 107.778 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.57 -40.76 88.4 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.916 2.086 . . . . 0.0 112.623 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.29 -49.66 70.94 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 113.783 -1.553 . . . . 0.0 111.137 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.01 -40.85 77.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 112.055 -2.339 . . . . 0.0 113.432 169.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 28.6 ttm -61.78 -46.24 90.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.632 1.573 . . . . 0.0 112.189 -172.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.44 -48.55 79.17 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.097 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.98 -39.15 93.83 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 113.19 -1.823 . . . . 0.0 113.561 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.444 HD11 ' CB ' ' A' ' 12' ' ' TYR . 61.6 mt -92.03 22.79 4.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -176.207 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 p30 57.03 19.35 4.6 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 117.624 2.453 . . . . 0.0 117.624 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -85.12 100.11 11.5 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.136 -1.393 . . . . 0.0 112.325 -163.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 116.41 -1.757 . . . . 0.0 113.024 160.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.481 1.1 t . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 100.523 -3.88 . . . . 0.0 100.523 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.7 p -81.31 139.05 35.62 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.895 -1.128 . . . . 0.0 108.491 -162.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.471 HD21 ' CE2' ' A' ' 47' ' ' TYR . 53.8 mt -62.09 -6.2 2.8 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 120.909 3.67 . . . . 0.0 120.909 -155.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.257 70.4 m-85 -57.69 -37.91 74.26 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.319 1.418 . . . . 0.0 111.611 173.357 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.497 ' OD2' HD22 ' A' ' 45' ' ' LEU . 11.1 t70 -55.94 -53.29 58.58 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.1 t -59.95 -44.32 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.129 0.572 . . . . 0.0 111.818 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.07 77.7 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.058 1.343 . . . . 0.0 112.818 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.481 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.9 OUTLIER -69.42 -41.71 76.01 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.91 2.084 . . . . 0.0 114.185 178.095 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -63.96 -35.11 79.61 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.539 1.136 . . . . 0.0 110.003 177.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.81 -19.77 24.28 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.298 1.439 . . . . 0.0 111.528 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.72 28.21 61.53 Favored Glycine 0 N--CA 1.488 2.153 0 C-N-CA 125.721 1.629 . . . . 0.0 112.772 174.179 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.522 HG22 HG21 ' A' ' 19' ' ' THR 0.27 5.1 p -132.31 123.4 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.191 0 C-N-CA 124.82 1.248 . . . . 0.0 107.707 -170.531 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.7 p -32.46 145.09 0.02 OUTLIER 'General case' 0 N--CA 1.528 3.431 0 C-N-CA 128.005 2.522 . . . . 0.0 111.803 -171.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -57.89 -35.92 71.68 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 119.067 -2.27 . . . . 0.0 115.313 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -57.32 -40.23 77.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 118.772 -0.632 . . . . 0.0 112.187 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.558 ' O ' HG23 ' A' ' 23' ' ' VAL . 57.4 m -55.24 -50.2 70.06 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.685 0.794 . . . . 0.0 110.122 173.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.492 ' O ' HG23 ' A' ' 24' ' ' VAL 0.332 74.2 t -66.54 -42.39 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.174 0.59 . . . . 0.0 112.459 -174.611 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.6 p -63.28 -47.38 82.59 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.406 ' NH2' ' HB1' ' A' ' 27' ' ' ALA . 15.4 mtp85 -51.61 -47.19 63.72 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.395 -2.184 . . . . 0.0 112.996 168.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.577 HG21 HG21 ' A' ' 38' ' ' VAL . 78.6 t -60.18 -48.41 88.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-O 122.035 0.921 . . . . 0.0 110.076 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 20' ' ' VAL . 61.9 t -59.76 -47.98 89.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 112.859 -1.973 . . . . 0.0 111.222 -172.179 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -84.99 23.13 1.26 Allowed 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.914 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.271 0.0 OUTLIER 59.22 7.79 0.96 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.382 2.673 . . . . 0.0 116.249 174.047 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.406 ' HB1' ' NH2' ' A' ' 22' ' ' ARG . . . 29.47 36.25 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 128.548 2.739 . . . . 0.0 116.075 -167.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p 59.33 -46.88 0.07 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 126.639 1.975 . . . . 0.0 115.759 -162.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -144.1 95.57 2.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.4 p -111.93 150.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -65.77 142.22 58.05 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.25 -69.47 0.11 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -49.62 -36.65 25.1 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 117.779 2.511 . . . . 0.0 117.779 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.2 m -58.82 -52.27 66.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.603 -1.635 . . . . 0.0 108.333 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.0 mtm105 -56.6 -47.52 79.42 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 175.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.09 -34.38 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -178.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.73 -42.95 57.34 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 112.542 -2.117 . . . . 0.0 112.02 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.577 HG21 HG21 ' A' ' 23' ' ' VAL . 60.4 t -64.62 -48.9 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 112.897 -1.956 . . . . 0.0 109.56 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -57.32 -47.15 82.28 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.655 2.782 . . . . 0.0 112.368 -178.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.34 -48.3 80.43 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 112.749 -2.023 . . . . 0.0 110.892 177.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.26 -43.63 88.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.527 -2.124 . . . . 0.0 114.703 175.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.9 mtt -59.28 -46.31 88.87 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.21 -44.35 95.55 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.881 -1.509 . . . . 0.0 112.437 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -61.54 -34.52 75.68 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.107 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.497 HD22 ' OD2' ' A' ' 8' ' ' ASP . 54.5 mt -99.79 13.08 34.94 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.625 2.37 . . . . 0.0 115.269 -177.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.378 0.2 OUTLIER 54.74 18.41 2.1 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 126.778 2.031 . . . . 0.0 115.763 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.471 ' CE2' HD21 ' A' ' 6' ' ' LEU . 61.4 t80 -83.83 102.29 12.24 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.428 -1.42 . . . . 0.0 108.467 -171.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.459 168.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.47 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.205 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.4 p -87.38 142.25 28.02 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.919 -168.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mt -58.94 -12.04 4.07 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 121.511 3.893 . . . . 0.0 121.511 -158.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -60.64 -34.14 73.83 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.557 0.617 . . . . 0.0 110.544 173.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.423 ' OD1' HD22 ' A' ' 45' ' ' LEU . 4.9 t70 -59.4 -50.55 73.51 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 170.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.49 -42.59 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 174.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.93 51.69 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 112.934 -1.939 . . . . 0.0 112.992 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -39.53 93.24 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.57 1.948 . . . . 0.0 114.309 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.483 ' CB ' HD11 ' A' ' 45' ' ' LEU . 41.5 t80 -64.44 -36.12 83.13 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.184 0.994 . . . . 0.0 110.39 176.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.98 -13.94 37.73 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.645 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.75 25.42 69.74 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 127.753 2.597 . . . . 0.0 113.31 172.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.25 128.62 71.73 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 CA-C-O 121.08 0.467 . . . . 0.0 111.894 -167.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.8 p -28.74 124.25 0.12 Allowed 'General case' 0 N--CA 1.52 3.053 0 C-N-CA 128.639 2.775 . . . . 0.0 109.323 174.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -45.31 -39.38 6.57 Favored 'General case' 0 N--CA 1.529 3.476 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.344 0.0 OUTLIER -54.05 -34.7 60.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 118.734 2.864 . . . . 0.0 118.734 -178.912 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' HG23 ' A' ' 23' ' ' VAL . 69.4 p -59.06 -47.11 86.42 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.755 1.222 . . . . 0.0 112.044 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.611 ' O ' HG23 ' A' ' 24' ' ' VAL . 92.6 t -66.02 -54.31 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.546 1.139 . . . . 0.0 109.675 -177.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.511 20.1 m -64.11 -26.89 68.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 19' ' ' THR . 26.2 mtp85 -61.27 -48.43 81.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 110.542 -3.026 . . . . 0.0 115.273 163.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.604 HG21 HG21 ' A' ' 38' ' ' VAL . 54.2 t -57.65 -46.5 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.417 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 20' ' ' VAL . 85.9 t -55.4 -48.04 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.852 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -104.93 19.7 20.11 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.26 2.9 mp0 64.92 14.8 9.53 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 174.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.426 ' HB1' ' CZ ' ' A' ' 22' ' ' ARG . . . 44.36 6.28 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 110.524 -3.035 . . . . 0.0 119.066 175.23 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.2 t 65.04 -51.76 0.34 Allowed 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 124.224 1.01 . . . . 0.0 110.867 -155.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -130.1 101.94 6.03 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.159 175.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -108.7 134.61 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 176.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.0 p -72.43 133.95 45.14 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.9 -63.38 1.11 Allowed 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.375 0.0 OUTLIER -45.38 -33.38 2.52 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 117.492 2.404 . . . . 0.0 117.492 178.673 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 38' ' ' VAL . 28.8 m -62.56 -49.73 74.1 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 -176.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -56.64 -45.16 81.76 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.202 1.801 . . . . 0.0 112.884 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.44 -38.21 83.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 113.759 -1.564 . . . . 0.0 113.844 -175.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 ttpt -78.19 -44.96 24.35 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 126.93 2.092 . . . . 0.0 110.415 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.604 HG21 HG21 ' A' ' 23' ' ' VAL . 49.0 t -62.05 -45.71 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.647 1.579 . . . . 0.0 108.233 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.01 -43.12 69.82 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.228 3.011 . . . . 0.0 113.058 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.43 -50.02 71.43 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 111.548 -2.569 . . . . 0.0 110.96 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.92 -45.7 86.14 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.758 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.563 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -58.69 -47.53 84.22 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.069 2.148 . . . . 0.0 113.885 -177.919 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.33 85.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 113.145 -1.843 . . . . 0.0 111.527 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -66.54 -37.4 84.91 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.317 -178.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.483 HD11 ' CB ' ' A' ' 12' ' ' TYR . 57.5 mt -88.83 14.28 10.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 178.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 53.48 28.54 7.76 Favored 'General case' 0 CA--C 1.57 1.725 0 C-N-CA 126.602 1.961 . . . . 0.0 113.62 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.563 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 27.7 t80 -89.51 169.27 11.5 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.543 -168.257 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.384 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -178.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 104.886 -2.265 . . . . 0.0 104.886 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.274 1.1 p -66.96 97.08 0.46 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.4 mt -36.35 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.623 0 N-CA-C 118.882 2.919 . . . . 0.0 118.882 -176.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.419 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 51.7 m-85 -54.94 -33.46 62.27 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.574 1.079 . . . . 0.0 110.863 167.206 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -56.44 -52.79 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.939 172.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.53 -44.89 90.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.652 0.66 . . . . 0.0 112.003 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.11 -50.03 74.9 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.37 -178.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.419 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.7 OUTLIER -67.76 -43.23 80.34 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.339 1.856 . . . . 0.0 115.497 174.916 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -65.47 -34.63 78.73 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.468 1.107 . . . . 0.0 111.131 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -17.95 25.36 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.801 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.46 26.02 68.9 Favored Glycine 0 N--CA 1.485 1.935 0 C-N-CA 125.822 1.677 . . . . 0.0 113.038 174.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.577 HG22 HG21 ' A' ' 19' ' ' THR . 5.4 p -129.64 108.38 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -169.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.8 p -17.27 145.93 0.0 OUTLIER 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 127.051 2.14 . . . . 0.0 114.516 -174.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -52.32 -46.67 66.1 Favored 'General case' 0 N--CA 1.52 3.042 0 O-C-N 119.758 -1.839 . . . . 0.0 114.129 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.54 -41.94 61.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.435 1.084 . . . . 0.0 112.516 177.135 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.577 HG21 HG22 ' A' ' 15' ' ' VAL . 52.2 m -57.33 -50.7 72.1 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.296 1.039 . . . . 0.0 111.998 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 24' ' ' VAL . 88.5 t -65.16 -51.0 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.044 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m -58.02 -32.79 68.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.385 1.074 . . . . 0.0 112.645 -177.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.9 mtp85 -65.28 -49.44 69.54 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 168.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.541 HG21 HG21 ' A' ' 38' ' ' VAL . 58.3 t -62.08 -38.11 80.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.707 -178.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 20' ' ' VAL . 51.3 t -48.65 -54.33 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.578 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -87.37 16.15 5.67 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.175 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.678 ' HA ' HH12 ' A' ' 35' ' ' ARG 0.375 0.2 OUTLIER 69.19 -1.42 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 130.212 3.405 . . . . 0.0 118.494 177.758 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 5.83 51.32 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 109.738 -3.392 . . . . 0.0 118.086 -164.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t 63.58 -57.29 0.19 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 110.95 -2.841 . . . . 0.0 115.427 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -130.59 21.64 5.1 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -163.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.321 93.6 t -74.06 111.68 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 N-CA-C 119.509 3.152 . . . . 0.0 119.509 -160.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 m -13.16 132.34 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.27 -2.241 . . . . 0.0 116.074 -174.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.64 -55.43 11.29 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -172.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.16 -49.48 42.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 117.936 2.569 . . . . 0.0 117.936 173.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 38' ' ' VAL . 61.6 m -55.96 -49.53 73.3 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.254 1.021 . . . . 0.0 108.609 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.678 HH12 ' HA ' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -58.42 -47.68 83.15 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 176.663 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.05 79.83 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -79.65 -42.21 25.29 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 112.662 -2.063 . . . . 0.0 112.534 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.541 HG21 HG21 ' A' ' 23' ' ' VAL . 59.9 t -60.84 -50.81 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 174.472 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -55.9 -44.24 78.01 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.631 2.773 . . . . 0.0 112.738 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.8 -51.27 65.54 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.673 -2.058 . . . . 0.0 110.83 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.46 84.37 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 112.935 -1.939 . . . . 0.0 113.356 175.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.406 ' HG3' HG12 ' A' ' 38' ' ' VAL . 4.9 mtt -59.17 -49.32 78.3 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -174.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.87 98.12 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 111.865 -2.425 . . . . 0.0 113.131 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.12 -38.15 87.48 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 112.525 -2.125 . . . . 0.0 114.022 -176.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.2 mt -94.91 21.82 7.17 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 126.717 2.007 . . . . 0.0 113.314 -174.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.59 25.98 13.86 Favored 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -98.48 166.45 11.35 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.075 -1.42 . . . . 0.0 108.311 -171.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.952 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.995 -174.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.387 0.5 OUTLIER . . . . . 0 CA--C 1.554 1.123 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 5.0 p -80.93 102.97 10.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 102.636 -3.098 . . . . 0.0 102.636 177.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -46.36 -13.79 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.829 0 N-CA-C 118.681 2.845 . . . . 0.0 118.681 -174.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 47.9 m-85 -53.99 -32.75 55.04 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 118.44 0.564 . . . . 0.0 111.2 165.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.433 ' OD2' HD22 ' A' ' 45' ' ' LEU . 10.4 t70 -57.9 -50.27 73.92 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.2 t -59.27 -43.32 89.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 118.492 0.587 . . . . 0.0 111.771 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.19 -49.94 75.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.638 -175.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.414 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -68.79 -41.77 78.3 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.894 2.078 . . . . 0.0 114.718 175.378 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -63.9 -33.66 76.21 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.975 0.91 . . . . 0.0 110.88 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.89 -18.73 22.44 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-N 113.497 -1.683 . . . . 0.0 111.037 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.24 26.78 56.96 Favored Glycine 0 N--CA 1.487 2.088 0 C-N-CA 126.383 1.945 . . . . 0.0 113.703 173.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.61 HG21 HG23 ' A' ' 34' ' ' THR . 9.1 p -125.6 114.84 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 124.326 1.051 . . . . 0.0 110.932 -170.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -21.73 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 128.636 2.774 . . . . 0.0 110.989 175.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -42.23 -40.55 2.44 Favored 'General case' 0 N--CA 1.52 3.052 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -50.35 -38.91 44.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.582 1.176 . . . . 0.0 113.611 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.645 ' O ' HG23 ' A' ' 23' ' ' VAL 0.256 24.3 p -62.7 -51.23 68.03 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 173.283 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.411 76.5 t -59.54 -41.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.867 0.867 . . . . 0.0 112.53 -167.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.72 -38.12 89.91 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 19' ' ' THR . 22.2 mtp85 -62.97 -38.54 91.51 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 172.351 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.809 HG21 HG21 ' A' ' 38' ' ' VAL . 97.2 t -56.97 -47.82 82.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 126.717 2.007 . . . . 0.0 108.824 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.37 -55.96 20.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 109.285 -3.598 . . . . 0.0 114.303 -169.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -82.92 0.5 44.09 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 125.464 1.728 . . . . 0.0 114.336 175.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 55.0 36.93 28.05 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 124.744 2.212 . . . . 0.0 110.184 -170.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.381 . . -68.79 84.14 0.3 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 118.821 2.897 . . . . 0.0 118.821 -165.049 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 57.8 p 80.43 -88.76 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.728 169.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -112.36 44.05 1.51 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.862 HG23 ' HE ' ' A' ' 35' ' ' ARG . 4.3 p -34.07 135.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 111.931 -2.395 . . . . 0.0 113.246 151.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.73 ' H ' ' CZ ' ' A' ' 35' ' ' ARG . 45.4 t -111.23 126.43 54.86 Favored 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -170.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.03 -59.66 1.67 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -47.37 83.41 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.61 HG23 HG21 ' A' ' 15' ' ' VAL . 28.6 m -58.4 -48.26 81.22 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 112.605 -2.088 . . . . 0.0 105.599 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.862 ' HE ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -57.4 -39.42 76.07 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 113.798 -1.546 . . . . 0.0 115.06 -174.791 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -62.58 -40.82 98.12 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.453 -1.703 . . . . 0.0 114.269 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -75.56 -40.97 56.02 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.47 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.809 HG21 HG21 ' A' ' 23' ' ' VAL . 20.6 t -62.2 -48.92 86.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 127.486 2.314 . . . . 0.0 106.638 176.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -55.6 -43.31 75.93 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 128.409 2.683 . . . . 0.0 113.786 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.19 -51.65 62.71 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 110.73 -2.941 . . . . 0.0 110.4 172.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.87 -54.77 40.63 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.828 ' HB2' ' HB3' ' A' ' 47' ' ' TYR 0.36 0.0 OUTLIER -64.29 -25.55 68.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 -174.66 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.17 -47.62 73.39 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.82 172.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.95 -34.2 75.68 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.588 1.555 . . . . 0.0 112.558 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.433 HD22 ' OD2' ' A' ' 8' ' ' ASP . 36.6 mt -95.68 7.24 46.84 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.304 2.642 . . . . 0.0 115.344 -176.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.416 0.2 OUTLIER 60.4 14.57 4.83 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 178.712 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.828 ' HB3' ' HB2' ' A' ' 42' ' ' MET . 83.6 t80 -73.44 105.37 4.78 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 C-N-CA 118.484 -1.286 . . . . 0.0 112.741 163.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.416 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -90.83 135.68 33.57 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 103.324 -2.843 . . . . 0.0 103.324 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.672 ' HB2' ' HE1' ' A' ' 17' ' ' TYR . 20.1 mt -54.91 -18.55 5.1 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 128.945 2.898 . . . . 0.0 116.053 -162.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -55.03 -33.57 62.78 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 119.566 1.076 . . . . 0.0 111.142 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -65.55 -47.83 74.52 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.169 176.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.5 t -55.79 -45.9 79.66 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 124.516 1.126 . . . . 0.0 112.625 173.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.05 -54.98 36.18 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 126.172 1.789 . . . . 0.0 112.671 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -38.07 89.75 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.123 1.769 . . . . 0.0 113.728 177.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.23 -34.8 78.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.022 1.329 . . . . 0.0 110.7 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.62 -4.57 55.11 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.13 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 70.15 23.45 77.21 Favored Glycine 0 N--CA 1.492 2.374 0 C-N-CA 127.274 2.368 . . . . 0.0 113.089 172.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.252 8.8 p -123.73 137.02 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -166.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 p -55.03 138.12 44.73 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.842 1.257 . . . . 0.0 109.013 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.672 ' HE1' ' HB2' ' A' ' 6' ' ' LEU . 72.9 t80 -49.95 -28.56 6.95 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -172.177 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 -46.96 -47.38 21.8 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 124.853 1.345 . . . . 0.0 112.292 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 23' ' ' VAL . 65.3 p -58.78 -51.81 68.4 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.638 ' O ' HG23 ' A' ' 24' ' ' VAL . 89.1 t -62.96 -51.82 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.817 1.647 . . . . 0.0 109.549 -173.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.8 t -59.13 -41.23 87.73 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 19' ' ' THR . 19.6 mtp85 -60.25 -45.2 94.08 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 113.804 -1.543 . . . . 0.0 114.854 173.027 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.626 HG21 HG21 ' A' ' 38' ' ' VAL . 42.6 t -57.56 -44.04 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.631 1.972 . . . . 0.0 109.277 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 20' ' ' VAL . 75.0 t -58.07 -42.05 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 CA-C-N 111.315 -2.675 . . . . 0.0 112.491 -171.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -91.38 4.22 52.97 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 113.529 -1.668 . . . . 0.0 113.354 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.433 ' OE1' HG12 ' A' ' 30' ' ' VAL . 1.1 tm0? 58.1 17.18 4.31 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 128.852 2.861 . . . . 0.0 114.63 -173.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.59 38.55 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 110.615 -2.993 . . . . 0.0 116.307 -174.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 97.6 p 55.36 -28.86 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 119.246 3.054 . . . . 0.0 119.246 -160.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -161.85 80.04 0.56 Allowed 'General case' 0 CA--C 1.564 1.501 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 -161.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.433 HG12 ' OE1' ' A' ' 26' ' ' GLN . 8.8 p -117.27 147.26 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 120.452 -1.405 . . . . 0.0 114.674 -179.02 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.4 p -63.06 135.11 57.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.042 0.937 . . . . 0.0 113.458 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.15 -66.23 0.43 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.309 1.6 pptp? -48.02 -33.22 7.64 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 120.299 3.444 . . . . 0.0 120.299 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -61.77 -49.67 75.45 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.608 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 14.2 mtm105 -57.83 -46.89 84.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.39 -36.09 70.84 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -75.54 -44.1 45.27 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.493 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.626 HG21 HG21 ' A' ' 23' ' ' VAL . 48.7 t -63.93 -45.24 97.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.415 176.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 45.5 mt-10 -55.39 -43.78 75.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 129.532 3.133 . . . . 0.0 111.784 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.11 -50.93 66.36 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.469 -1.696 . . . . 0.0 111.583 175.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.36 89.02 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 113.547 -1.66 . . . . 0.0 114.137 176.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.409 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 0.7 OUTLIER -57.61 -45.21 85.64 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.926 1.69 . . . . 0.0 114.356 179.833 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.98 -46.31 85.18 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 113.553 -1.658 . . . . 0.0 111.035 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -64.81 -37.27 87.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 113.122 -1.854 . . . . 0.0 113.726 -178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.9 mt -96.37 17.82 15.2 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.94 2.496 . . . . 0.0 114.391 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.383 0.2 OUTLIER 51.41 21.74 1.28 Allowed 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 127.402 2.281 . . . . 0.0 115.772 177.436 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.409 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 27.8 t80 -74.72 154.72 38.29 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.436 -0.79 . . . . 0.0 110.54 -168.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.718 0 CA-C-N 112.181 -2.282 . . . . 0.0 111.813 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.487 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 102.121 -3.289 . . . . 0.0 102.121 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -93.85 134.16 36.51 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.079 -1.013 . . . . 0.0 108.39 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.486 HD21 ' CZ ' ' A' ' 47' ' ' TYR . 14.6 mt -48.45 -17.69 0.18 Allowed 'General case' 0 N--CA 1.511 2.603 0 N-CA-C 118.454 2.761 . . . . 0.0 118.454 -163.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 45.5 m-85 -58.1 -35.38 71.35 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.78 0.718 . . . . 0.0 111.316 172.03 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -64.18 -45.77 86.92 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 117.525 -1.226 . . . . 0.0 111.339 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.63 ' HA ' HD13 ' A' ' 45' ' ' LEU . 71.2 t -57.61 -42.22 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 CA-C-N 119.052 0.842 . . . . 0.0 112.987 174.31 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.484 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -62.18 -52.98 61.62 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 111.646 -2.525 . . . . 0.0 111.748 -176.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.405 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.67 -38.07 83.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.202 2.201 . . . . 0.0 113.204 177.491 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.427 ' CB ' HD11 ' A' ' 45' ' ' LEU . 30.1 t80 -64.35 -35.39 80.73 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.417 1.487 . . . . 0.0 109.521 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.15 -18.32 24.67 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.876 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.44 29.54 57.95 Favored Glycine 0 N--CA 1.49 2.24 0 C-N-CA 126.391 1.948 . . . . 0.0 113.003 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.1 p -125.36 137.9 56.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 123.908 0.883 . . . . 0.0 109.028 -170.079 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.0 p -43.41 122.07 2.48 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 127.038 2.135 . . . . 0.0 107.852 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -33.05 -48.76 0.22 Allowed 'General case' 0 N--CA 1.524 3.241 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.554 0.0 OUTLIER -57.84 -20.98 40.11 Favored 'General case' 0 C--N 1.314 -0.963 1 N-CA-C 124.232 4.901 . . . . 0.0 124.232 -179.956 . . . . . . . . 4 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' HG23 ' A' ' 23' ' ' VAL 0.696 0.7 OUTLIER -76.56 -43.56 38.43 Favored 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 160.753 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' HG23 ' A' ' 24' ' ' VAL . 77.4 t -59.72 -49.39 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.635 -176.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.3 p -58.01 -44.43 87.26 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -173.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -60.36 -47.39 86.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 108.695 -3.866 . . . . 0.0 114.852 168.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 19' ' ' THR . 91.4 t -59.19 -40.66 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -176.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 20' ' ' VAL . 68.5 t -53.62 -50.0 52.89 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 CA-C-N 113.914 -1.493 . . . . 0.0 112.966 -172.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.308 62.7 m-20 -99.34 27.78 4.98 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 123.103 1.43 . . . . 0.0 114.706 170.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 71.31 -16.58 0.36 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 131.589 3.956 . . . . 0.0 116.583 173.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 45.18 37.93 2.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.113 2.165 . . . . 0.0 111.781 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.2 p 57.55 -46.34 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.751 -2.022 . . . . 0.0 115.821 -150.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -154.73 109.82 3.07 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.192 -165.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.638 ' H ' ' NH2' ' A' ' 35' ' ' ARG . 25.3 t -132.97 132.55 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 120.628 1.558 . . . . 0.0 114.763 157.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -16.16 135.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 175.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 35' ' ' ARG . . . -59.93 -49.08 79.08 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.559 1.144 . . . . 0.0 113.416 -173.218 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -44.2 43.65 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 175.097 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.0 m -62.03 -51.27 68.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 113.068 -1.878 . . . . 0.0 108.273 175.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.638 ' NH2' ' H ' ' A' ' 30' ' ' VAL . 38.3 mtt-85 -53.87 -46.81 71.42 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.386 1.074 . . . . 0.0 113.856 178.002 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.88 -37.42 76.52 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.792 -1.095 . . . . 0.0 113.539 -176.274 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -76.44 -45.3 32.02 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.741 -2.027 . . . . 0.0 111.908 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.4 t -61.29 -47.91 91.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-N 113.884 -1.507 . . . . 0.0 108.513 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -58.53 -46.12 87.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.009 3.324 . . . . 0.0 111.503 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.54 -48.98 73.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 113.434 -1.712 . . . . 0.0 110.873 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.8 -43.94 86.01 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 112.95 -1.932 . . . . 0.0 112.661 173.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.499 ' HG2' ' HD2' ' A' ' 47' ' ' TYR . 9.9 mtt -55.04 -46.65 75.33 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 125.436 1.495 . . . . 0.0 112.169 -178.202 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -47.45 83.26 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 112.951 -1.931 . . . . 0.0 111.731 -175.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -61.03 -40.31 93.09 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 112.413 -2.176 . . . . 0.0 112.916 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 9' ' ' VAL . 19.4 mt -87.13 6.23 33.81 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 128.393 2.677 . . . . 0.0 116.645 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.43 0.2 OUTLIER 52.6 23.1 2.45 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 128.09 2.556 . . . . 0.0 113.792 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.499 ' HD2' ' HG2' ' A' ' 42' ' ' MET . 51.8 t80 -82.05 97.96 8.4 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 118.614 -2.554 . . . . 0.0 110.824 -172.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.633 155.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.327 0.5 OUTLIER . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 p -67.81 147.15 52.96 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -152.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.542 ' HB2' ' HE2' ' A' ' 17' ' ' TYR . 11.8 mt -48.89 -17.54 0.2 Allowed 'General case' 0 N--CA 1.517 2.889 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 -162.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.425 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 30.3 m-85 -60.83 -40.58 93.32 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 118.596 0.635 . . . . 0.0 111.241 179.444 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.427 ' OD2' HD22 ' A' ' 45' ' ' LEU . 6.4 t70 -51.81 -55.86 17.37 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.299 1.04 . . . . 0.0 112.057 166.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.6 t -58.94 -39.72 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 7' ' ' TYR . . . -58.07 -55.57 33.18 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 126.384 1.873 . . . . 0.0 112.701 172.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -38.37 89.3 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.52 1.928 . . . . 0.0 114.237 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.422 ' CG ' HD11 ' A' ' 45' ' ' LEU . 43.2 t80 -64.57 -37.28 87.02 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.466 1.107 . . . . 0.0 109.808 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.17 -12.33 44.23 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.829 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 26.61 67.57 Favored Glycine 0 CA--C 1.549 2.169 0 C-N-CA 127.533 2.492 . . . . 0.0 113.337 172.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.0 p -124.06 132.08 71.9 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 123.909 0.883 . . . . 0.0 110.663 -171.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -36.79 127.76 0.86 Allowed 'General case' 0 N--CA 1.522 3.137 0 C-N-CA 126.638 1.975 . . . . 0.0 108.952 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.542 ' HE2' ' HB2' ' A' ' 6' ' ' LEU . 58.7 t80 -48.05 -33.0 7.41 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 115.848 1.795 . . . . 0.0 115.848 176.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -52.38 -46.19 66.11 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-O 117.115 -1.421 . . . . 0.0 111.315 175.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.574 ' O ' HG23 ' A' ' 23' ' ' VAL 0.905 0.6 OUTLIER -67.86 -40.01 83.68 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.963 2.209 . . . . 0.0 116.963 176.544 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.65 ' O ' HG23 ' A' ' 24' ' ' VAL 0.278 78.2 t -59.61 -46.79 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 117.294 -1.336 . . . . 0.0 110.279 -177.614 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.347 3.5 m -68.08 -29.7 68.71 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 120.358 3.466 . . . . 0.0 120.358 -174.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 19' ' ' THR . 33.7 mtp85 -63.91 -52.18 61.08 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 110.808 -2.905 . . . . 0.0 113.184 162.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.736 HG22 HG21 ' A' ' 30' ' ' VAL . 62.8 t -62.39 -42.27 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 C-N-CA 124.488 1.115 . . . . 0.0 110.255 -172.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 20' ' ' VAL . 52.3 t -51.65 -54.87 10.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 O-C-N 125.418 1.699 . . . . 0.0 111.112 -162.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.289 85.8 m-20 -105.89 42.01 1.32 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 113.948 -1.478 . . . . 0.0 112.858 176.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.384 10.6 pt20 80.97 -9.97 1.27 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.546 3.539 . . . . 0.0 118.417 163.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.36 30.55 0.08 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.717 2.007 . . . . 0.0 115.075 -168.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.9 p 61.02 -44.82 0.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 115.98 1.845 . . . . 0.0 115.98 -155.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.276 78.4 m80 -152.53 126.4 9.0 Favored 'General case' 0 CA--C 1.558 1.275 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -170.04 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.736 HG21 HG22 ' A' ' 23' ' ' VAL . 3.7 p -141.53 162.75 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.568 0 CA-C-N 120.157 1.344 . . . . 0.0 112.656 170.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -59.45 130.03 44.88 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 170.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.93 -59.53 4.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -175.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.6 tptp -41.41 -41.3 1.98 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.7 m -58.51 -47.0 85.59 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 113.639 -1.619 . . . . 0.0 109.173 -178.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.6 mmt85 -55.34 -45.19 76.43 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -35.13 76.05 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -78.55 -42.3 29.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 112.477 -2.147 . . . . 0.0 112.217 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.401 HG21 HG11 ' A' ' 23' ' ' VAL . 84.3 t -60.83 -50.8 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.007 1.723 . . . . 0.0 108.059 173.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -54.95 -44.9 74.77 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 125.327 1.451 . . . . 0.0 112.922 -178.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.89 -49.26 71.18 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 112.479 -2.146 . . . . 0.0 111.213 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.17 -45.59 83.52 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 113.581 -1.645 . . . . 0.0 113.249 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.489 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.1 mmt -60.11 -47.39 86.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.667 -1.151 . . . . 0.0 114.019 -177.09 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 113.27 -1.786 . . . . 0.0 111.449 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -64.78 -40.62 95.56 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.027 -2.351 . . . . 0.0 112.358 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.427 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.3 mt -85.78 6.67 26.93 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 127.81 2.444 . . . . 0.0 112.517 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.474 0.2 OUTLIER 44.16 34.05 0.92 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -171.257 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 60.7 t80 -98.34 88.46 4.16 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 111.324 -2.671 . . . . 0.0 108.778 -166.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.853 0 CA-C-N 111.65 -2.523 . . . . 0.0 114.219 155.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.5 OUTLIER . . . . . 0 CA--C 1.558 1.268 0 N-CA-C 102.578 -3.119 . . . . 0.0 102.578 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.337 0.8 OUTLIER -71.09 106.09 3.6 Favored 'General case' 0 CA--C 1.563 1.475 0 N-CA-C 101.75 -3.426 . . . . 0.0 101.75 -179.392 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.7 mt -45.48 -16.3 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.894 0 N-CA-C 118.341 2.719 . . . . 0.0 118.341 -179.307 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.61 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.314 56.4 m-85 -54.54 -32.5 58.37 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.621 1.555 . . . . 0.0 111.447 166.395 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.516 ' OD2' HD22 ' A' ' 45' ' ' LEU . 23.3 t0 -60.19 -49.67 76.71 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.327 175.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.98 -46.25 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 174.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.75 -49.51 77.44 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 111.67 -2.513 . . . . 0.0 111.66 -176.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.61 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.7 OUTLIER -67.89 -43.09 80.14 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.629 2.372 . . . . 0.0 114.678 177.243 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -63.24 -32.89 74.41 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.864 0.728 . . . . 0.0 110.601 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.75 -16.44 25.43 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 113.94 -1.482 . . . . 0.0 111.723 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.77 25.78 66.5 Favored Glycine 0 CA--C 1.55 2.24 0 C-N-CA 126.56 2.028 . . . . 0.0 113.618 173.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.428 HG22 HG21 ' A' ' 19' ' ' THR 0.276 4.3 p -129.94 125.12 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.511 0 C-N-CA 124.115 0.966 . . . . 0.0 108.394 -167.012 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -32.96 139.26 0.05 Allowed 'General case' 0 N--CA 1.526 3.37 0 C-N-CA 127.507 2.323 . . . . 0.0 111.274 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -52.52 -41.73 63.71 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-N 121.117 1.78 . . . . 0.0 115.047 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.606 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.529 3.2 pp0? -61.77 -30.51 70.84 Favored 'General case' 0 C--N 1.318 -0.77 1 N-CA-C 122.718 4.34 . . . . 0.0 122.718 175.331 . . . . . . . . 4 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 23' ' ' VAL . 87.4 m -55.19 -49.34 72.16 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 112.801 -2.0 . . . . 0.0 109.581 162.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.681 ' O ' HG23 ' A' ' 24' ' ' VAL 0.284 73.9 t -64.67 -48.06 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.772 -178.15 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.338 3.3 m -63.37 -33.24 75.12 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.606 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 20.7 mtt85 -60.9 -48.84 79.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.085 -1.87 . . . . 0.0 114.354 167.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.568 HG21 HG21 ' A' ' 38' ' ' VAL . 89.7 t -61.07 -39.98 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.695 1.198 . . . . 0.0 108.954 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 20' ' ' VAL . 42.1 t -55.28 -42.53 66.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-N 113.53 -1.668 . . . . 0.0 112.996 -170.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.12 19.4 19.62 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 171.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.28 0.7 OUTLIER 65.47 11.65 7.56 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 129.459 3.104 . . . . 0.0 118.731 176.723 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.73 42.08 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 110.57 -3.014 . . . . 0.0 116.096 -173.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.275 69.7 m 58.14 -44.45 0.05 Allowed 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 117.906 2.558 . . . . 0.0 117.906 -165.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -152.68 101.32 2.62 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.276 4.2 p -132.04 147.82 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -57.21 143.09 40.53 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -172.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.35 -67.16 0.31 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -40.63 66.77 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -177.123 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.556 ' O ' HG23 ' A' ' 38' ' ' VAL . 36.8 m -56.95 -52.47 65.09 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 113.058 -1.883 . . . . 0.0 106.938 177.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm105 -61.39 -48.55 80.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.792 1.237 . . . . 0.0 114.265 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.11 86.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.294 1.837 . . . . 0.0 114.826 -176.122 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -75.43 -42.84 52.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 112.059 -2.337 . . . . 0.0 110.761 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.568 HG21 HG21 ' A' ' 23' ' ' VAL . 38.9 t -63.78 -49.83 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 CA-C-N 114.187 -1.37 . . . . 0.0 107.76 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.39 -46.42 73.08 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 126.661 1.985 . . . . 0.0 112.599 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.61 80.75 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 112.361 -2.2 . . . . 0.0 111.134 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.23 -39.97 80.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.584 -2.098 . . . . 0.0 113.293 173.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 30.5 mtt -61.01 -52.11 66.39 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -172.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.28 -41.33 85.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.254 -1.793 . . . . 0.0 113.673 174.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -59.46 -37.83 79.2 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 113.402 -1.726 . . . . 0.0 113.45 -178.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.516 HD22 ' OD2' ' A' ' 8' ' ' ASP . 52.9 mt -91.99 26.06 2.6 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 52.38 33.6 13.28 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.82 1.772 . . . . 0.0 114.139 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 66.3 t80 -101.45 -177.49 3.45 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.423 1.489 . . . . 0.0 109.751 -174.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 47' ' ' TYR 0.258 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 117.374 -1.298 . . . . 0.0 108.683 -177.24 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.2 p -61.45 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 174.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.536 HD11 ' OH ' ' A' ' 47' ' ' TYR . 17.7 mt -35.17 -16.89 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.347 0 N-CA-C 119.596 3.184 . . . . 0.0 119.596 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.488 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 52.0 m-85 -53.34 -33.89 55.35 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.407 0.683 . . . . 0.0 110.899 164.255 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.455 ' OD2' HD22 ' A' ' 45' ' ' LEU . 14.1 t70 -57.23 -50.6 72.37 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 172.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.419 ' HA ' HD13 ' A' ' 45' ' ' LEU . 84.6 t -59.95 -43.12 91.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 123.252 0.621 . . . . 0.0 112.592 173.52 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.78 -55.11 39.4 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 112.065 -2.334 . . . . 0.0 112.175 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.488 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.9 OUTLIER -66.24 -40.59 90.33 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.717 2.007 . . . . 0.0 115.049 177.508 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -65.22 -35.76 82.05 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.964 0.887 . . . . 0.0 110.73 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.11 -19.33 27.17 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 113.632 -1.622 . . . . 0.0 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 26.19 57.93 Favored Glycine 0 CA--C 1.545 1.951 0 C-N-CA 126.793 2.139 . . . . 0.0 113.001 172.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.6 p -119.56 126.4 75.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 125.325 1.45 . . . . 0.0 110.605 -171.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.2 p -28.3 121.4 0.12 Allowed 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 129.154 2.982 . . . . 0.0 110.476 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -44.46 -45.1 8.97 Favored 'General case' 0 N--CA 1.521 3.091 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.426 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.665 0.6 OUTLIER -56.56 -18.63 12.4 Favored 'General case' 0 C--N 1.321 -0.643 1 N-CA-C 125.265 5.283 . . . . 0.0 125.265 176.22 . . . . . . . . 5 4 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.485 ' O ' HG23 ' A' ' 23' ' ' VAL . 71.0 p -64.66 -53.01 54.13 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 113.714 -1.584 . . . . 0.0 113.65 159.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.615 ' O ' HG23 ' A' ' 24' ' ' VAL 0.25 80.1 t -60.99 -50.86 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 O-C-N 121.106 -0.996 . . . . 0.0 110.87 -164.298 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.29 13.8 m -59.76 -35.18 74.08 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -179.27 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 19' ' ' THR . 11.2 mtt85 -67.23 -42.73 83.54 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 112.055 -2.339 . . . . 0.0 117.103 170.098 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.737 HG11 HG21 ' A' ' 38' ' ' VAL . 75.7 t -60.63 -43.13 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 125.813 1.645 . . . . 0.0 108.161 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.2 t -49.04 -49.45 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.289 0 O-C-N 125.708 1.88 . . . . 0.0 111.416 -171.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.377 81.8 m-20 -106.46 29.85 6.51 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 35.9 tt0 61.05 17.76 8.3 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 129.493 3.117 . . . . 0.0 115.604 170.372 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.58 39.88 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 111.735 -2.484 . . . . 0.0 116.998 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.257 86.1 p 61.01 -56.72 0.09 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 126.313 1.845 . . . . 0.0 113.663 -163.015 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.288 98.8 m-70 -138.26 115.49 11.04 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.969 167.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 p -127.17 156.11 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 172.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.9 p -54.63 134.71 47.01 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 174.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.99 -53.28 57.83 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -175.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -48.4 -41.71 29.79 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.442 ' O ' HG23 ' A' ' 38' ' ' VAL . 27.9 m -56.46 -48.72 76.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 114.271 -1.331 . . . . 0.0 107.881 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 2.4 mmm180 -59.22 -42.64 91.46 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 117.72 2.489 . . . . 0.0 117.72 177.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -36.07 76.13 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 113.479 -1.691 . . . . 0.0 115.445 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -77.99 -44.56 26.3 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 111.949 -2.387 . . . . 0.0 111.283 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.737 HG21 HG11 ' A' ' 23' ' ' VAL . 41.6 t -64.25 -45.36 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 113.803 -1.544 . . . . 0.0 108.636 177.285 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 51.9 mt-10 -58.44 -42.09 86.53 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.565 3.146 . . . . 0.0 112.985 -177.654 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -52.03 65.06 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 112.585 -2.098 . . . . 0.0 109.843 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.66 -38.15 74.6 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 113.285 -1.78 . . . . 0.0 114.999 175.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 36.3 mtt -59.81 -53.21 60.61 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.04 94.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 113.07 -1.877 . . . . 0.0 112.386 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.42 -37.29 86.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 112.619 -2.082 . . . . 0.0 113.732 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.455 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.5 mt -98.75 20.76 12.46 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 126.455 1.902 . . . . 0.0 113.539 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 56.72 25.24 9.91 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 116.52 2.045 . . . . 0.0 116.52 175.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.536 ' OH ' HD11 ' A' ' 6' ' ' LEU . 54.4 t80 -86.82 170.83 11.35 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.294 -172.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.861 -170.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.476 ' O ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.494 1.728 1 N-CA-C 122.388 4.218 . . . . 0.0 122.388 . . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 4' ' ' VAL 0.31 7.0 t 71.82 149.59 0.09 Allowed 'General case' 0 N--CA 1.491 1.602 1 C-N-CA 133.92 4.888 . . . . 0.0 117.587 -177.862 . . . . . . . . 4 3 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.449 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 33.9 mt -62.55 -27.85 69.45 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -175.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -58.1 -37.54 74.71 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.876 0.871 . . . . 0.0 109.695 172.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.538 ' OD2' HD22 ' A' ' 45' ' ' LEU . 22.6 t70 -64.94 -49.51 70.08 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.885 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -43.34 90.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.404 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -57.1 -46.53 82.5 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.415 1.886 . . . . 0.0 113.214 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.54 -43.96 71.9 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 126.315 1.846 . . . . 0.0 115.673 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.43 ' CB ' HD11 ' A' ' 45' ' ' LEU . 37.5 t80 -64.55 -33.22 75.4 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.559 0.695 . . . . 0.0 110.546 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.38 -20.64 23.73 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.555 -1.657 . . . . 0.0 111.568 -179.148 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.18 27.9 61.18 Favored Glycine 0 N--CA 1.489 2.229 0 C-N-CA 125.524 1.535 . . . . 0.0 112.773 171.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.424 HG22 HG21 ' A' ' 19' ' ' THR 0.255 8.6 p -132.28 120.94 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.476 0.71 . . . . 0.0 109.727 -167.945 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.6 p -26.35 139.67 0.01 OUTLIER 'General case' 0 N--CA 1.524 3.27 0 C-N-CA 128.233 2.613 . . . . 0.0 110.623 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 6' ' ' LEU . 66.1 t80 -54.51 -34.8 62.31 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 119.483 -2.011 . . . . 0.0 114.728 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -53.51 -44.69 69.29 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.909 0.756 . . . . 0.0 111.62 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' HG23 ' A' ' 23' ' ' VAL . 36.6 m -55.13 -52.53 62.98 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.958 1.303 . . . . 0.0 111.127 176.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.65 ' O ' HG23 ' A' ' 24' ' ' VAL . 76.9 t -65.33 -50.83 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.393 -0.813 . . . . 0.0 110.911 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.384 7.6 m -63.15 -31.15 72.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 118.453 2.76 . . . . 0.0 118.453 -178.143 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.6 mtp85 -60.01 -48.85 80.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.356 -2.657 . . . . 0.0 115.121 164.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 38' ' ' VAL . 69.8 t -59.72 -45.11 94.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 124.949 1.3 . . . . 0.0 108.797 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 20' ' ' VAL . 94.8 t -53.14 -44.69 52.64 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 112.753 -2.021 . . . . 0.0 112.108 -171.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.285 96.1 m-20 -104.22 25.82 9.6 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 173.125 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.438 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER 58.87 19.99 7.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.668 2.787 . . . . 0.0 115.997 172.265 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.79 45.64 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 111.371 -2.65 . . . . 0.0 116.699 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 88.5 p 59.44 -52.93 0.06 Allowed 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 126.129 1.772 . . . . 0.0 114.802 -162.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.8 m170 -138.44 117.15 12.25 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.438 HG12 ' OE1' ' A' ' 26' ' ' GLN . 3.3 p -118.18 147.56 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 p -61.92 139.43 58.39 Favored 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.43 -66.53 0.39 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB2' ' HZ2' ' A' ' 33' ' ' LYS 0.271 0.0 OUTLIER -52.94 -34.07 53.74 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -179.317 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -62.48 -50.89 69.65 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -57.69 -46.91 83.7 Favored 'General case' 0 N--CA 1.434 -1.254 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 175.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.03 -36.35 65.42 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -175.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -74.56 -44.61 50.18 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.748 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 23' ' ' VAL . 61.1 t -66.6 -50.01 70.03 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 113.677 -1.602 . . . . 0.0 109.606 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -49.77 -45.59 49.82 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.648 3.179 . . . . 0.0 111.394 178.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.15 77.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 111.404 -2.634 . . . . 0.0 110.887 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.61 -46.67 88.82 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 113.356 -1.747 . . . . 0.0 114.965 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.55 -45.41 81.26 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.342 1.857 . . . . 0.0 113.662 -177.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.42 78.58 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.177 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.42 -43.28 94.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 112.612 -2.085 . . . . 0.0 113.104 -177.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.538 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.0 mt -81.15 14.09 2.5 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.333 1.2 p-10 50.28 41.85 24.88 Favored 'General case' 0 CA--C 1.574 1.893 0 CA-C-O 122.777 1.275 . . . . 0.0 113.338 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -105.11 179.41 4.28 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 114.83 -1.077 . . . . 0.0 108.916 -173.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.272 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.082 0 O-C-N 121.36 -0.838 . . . . 0.0 112.1 -174.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.307 2.7 p -71.07 94.14 1.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 105.616 -1.994 . . . . 0.0 105.616 -175.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.9 mt -27.87 -16.66 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 1 N-CA-C 123.028 4.455 . . . . 0.0 123.028 177.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -56.5 -36.45 69.17 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 118.97 0.805 . . . . 0.0 111.158 165.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.02 -52.25 59.06 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 172.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.22 -45.93 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.166 0.987 . . . . 0.0 112.387 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.45 79.4 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.238 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -44.48 76.67 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 115.296 175.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.449 ' CB ' HD11 ' A' ' 45' ' ' LEU . 52.4 t80 -63.59 -33.53 75.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.993 1.317 . . . . 0.0 111.248 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.63 -15.35 25.44 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.92 -1.491 . . . . 0.0 111.21 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.95 26.69 68.32 Favored Glycine 0 N--CA 1.494 2.504 0 C-N-CA 125.949 1.738 . . . . 0.0 112.6 171.262 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.447 HG22 HG21 ' A' ' 19' ' ' THR . 8.5 p -131.78 117.68 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.478 1.111 . . . . 0.0 108.441 -168.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.7 p -22.24 142.87 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.984 0 C-N-CA 127.066 2.146 . . . . 0.0 112.73 -174.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.25 83.3 t80 -50.73 -42.89 57.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 119.919 -1.738 . . . . 0.0 114.295 171.057 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -52.52 -41.9 63.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 123.872 0.733 . . . . 0.0 112.754 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 23' ' ' VAL . 46.4 m -56.55 -51.86 66.97 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.75 175.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 24' ' ' VAL 0.328 86.9 t -64.91 -45.39 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 118.085 -0.959 . . . . 0.0 112.4 -173.599 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 3.7 m -63.57 -36.0 82.36 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -178.55 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -60.17 -47.45 85.89 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 167.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.78 HG11 HG21 ' A' ' 38' ' ' VAL . 73.3 t -59.98 -39.59 80.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.668 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.9 t -53.06 -50.94 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 CA-C-N 113.898 -1.501 . . . . 0.0 112.293 -171.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -84.45 7.46 19.68 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 171.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.557 ' HG2' ' HD3' ' A' ' 35' ' ' ARG . 0.9 OUTLIER 62.66 14.24 7.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 128.091 2.557 . . . . 0.0 113.781 -177.006 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.05 42.53 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 111.937 -2.392 . . . . 0.0 115.967 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.4 m 56.25 -36.1 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -165.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.281 79.1 m80 -157.29 103.25 1.97 Allowed 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 -178.14 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.98 156.88 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 120.093 -1.629 . . . . 0.0 114.53 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -60.57 136.26 58.0 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.435 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . . . -55.21 -53.84 50.96 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -175.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HE2' ' HB3' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -54.32 -38.97 66.59 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 177.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.7 m -62.07 -52.02 65.63 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.557 ' HD3' ' HG2' ' A' ' 26' ' ' GLN . 3.6 mtm105 -56.82 -45.07 82.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -61.38 -35.71 78.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.141 -1.845 . . . . 0.0 114.039 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -75.63 -42.12 52.44 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 111.712 -2.494 . . . . 0.0 111.046 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.78 HG21 HG11 ' A' ' 23' ' ' VAL . 46.3 t -61.77 -48.37 88.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 125.347 1.459 . . . . 0.0 107.399 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -55.02 -41.33 71.18 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 128.105 2.562 . . . . 0.0 113.78 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.42 -51.04 61.08 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 111.698 -2.501 . . . . 0.0 111.447 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.29 -43.41 88.02 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 113.689 -1.596 . . . . 0.0 113.936 178.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.551 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -58.02 -47.55 82.74 Favored 'General case' 0 CA--C 1.598 2.805 0 C-N-CA 128.805 2.842 . . . . 0.0 111.297 -176.926 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.01 82.9 Favored 'General case' 0 C--N 1.318 -0.767 0 O-C-N 126.439 2.337 . . . . 0.0 111.771 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -65.99 -41.41 91.15 Favored 'General case' 0 CA--C 1.586 2.346 0 C-N-CA 126.447 1.899 . . . . 0.0 111.94 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.449 HD11 ' CB ' ' A' ' 12' ' ' TYR . 56.4 mt -88.54 13.21 12.54 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.689 1.996 . . . . 0.0 114.649 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.267 2.2 p-10 56.76 32.33 21.05 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-N 114.202 -1.363 . . . . 0.0 114.535 176.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.551 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 6.7 t80 -94.79 174.28 7.18 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -175.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.932 0 CA-C-O 118.367 -0.825 . . . . 0.0 109.138 -178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.466 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.738 0 N-CA-C 106.517 -1.661 . . . . 0.0 106.517 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.258 1.6 p -68.94 90.71 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.9 mt -34.99 -14.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 -175.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -56.24 -29.94 61.72 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.183 0.901 . . . . 0.0 112.826 164.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -54.86 -50.56 68.36 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 168.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.41 -44.21 95.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 123.09 0.556 . . . . 0.0 111.889 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.1 -48.7 80.63 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.17 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -42.41 88.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.519 1.928 . . . . 0.0 114.902 176.049 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.47 ' CB ' HD11 ' A' ' 45' ' ' LEU . 41.6 t80 -66.52 -32.68 74.19 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.913 1.285 . . . . 0.0 111.434 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.63 -8.24 47.77 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.686 1.194 . . . . 0.0 111.674 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.59 20.53 79.83 Favored Glycine 0 N--CA 1.496 2.7 0 C-N-CA 126.92 2.2 . . . . 0.0 113.04 171.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.23 127.19 65.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.239 0.616 . . . . 0.0 112.253 -164.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -27.95 128.72 0.06 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 127.717 2.407 . . . . 0.0 110.53 176.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -42.81 -36.0 1.34 Allowed 'General case' 0 N--CA 1.521 3.111 0 C-N-CA 124.998 1.319 . . . . 0.0 114.111 177.321 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -51.18 -43.67 61.37 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.247 177.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . 46.9 p -59.19 -54.31 48.34 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 176.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.506 ' O ' HG23 ' A' ' 24' ' ' VAL . 87.5 t -61.33 -49.64 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 125.248 1.419 . . . . 0.0 109.951 -172.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.0 p -53.54 -47.06 70.33 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.381 1.473 . . . . 0.0 113.674 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -60.37 -45.66 92.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 110.754 -2.93 . . . . 0.0 116.985 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.645 HG21 HG21 ' A' ' 38' ' ' VAL . 94.4 t -62.55 -39.88 86.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.242 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 20' ' ' VAL . 78.2 t -51.55 -55.09 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 113.312 -1.767 . . . . 0.0 112.486 -175.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.291 34.3 m120 -92.29 22.87 4.19 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 175.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 20.4 tt0 67.09 1.2 2.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 128.349 2.66 . . . . 0.0 117.433 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.21 35.81 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 111.675 -2.511 . . . . 0.0 116.827 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 59.24 -43.95 0.07 Allowed 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 117.97 2.582 . . . . 0.0 117.97 -167.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.274 69.3 m80 -152.49 103.59 2.83 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -174.061 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -123.29 151.7 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 171.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 p -67.48 145.93 54.48 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 -175.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.411 ' HB1' ' OE2' ' A' ' 36' ' ' GLU . . . -46.1 -73.87 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.569 ' H ' ' HE2' ' A' ' 33' ' ' LYS 0.292 0.0 OUTLIER -51.21 -28.9 12.56 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 119.832 3.271 . . . . 0.0 119.832 179.564 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 23.7 m -65.05 -56.97 9.96 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 175.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtm105 -55.35 -51.35 67.07 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.411 ' OE2' ' HB1' ' A' ' 32' ' ' ALA . 0.4 OUTLIER -54.65 -34.64 62.48 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -175.672 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.19 -51.06 11.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.806 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.645 HG21 HG21 ' A' ' 23' ' ' VAL . 48.5 t -58.8 -46.39 90.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 125.86 1.664 . . . . 0.0 108.177 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.0 -44.11 91.61 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.147 2.179 . . . . 0.0 116.208 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.9 -50.01 70.41 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.626 -2.079 . . . . 0.0 110.511 174.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.15 -37.88 75.53 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 112.283 -2.235 . . . . 0.0 114.866 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 35.0 mtt -59.56 -51.29 70.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.21 -40.38 95.91 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 112.43 -2.168 . . . . 0.0 111.818 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.13 -41.07 95.15 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.783 -2.008 . . . . 0.0 113.495 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.47 HD11 ' CB ' ' A' ' 12' ' ' TYR . 63.1 mt -98.94 25.14 6.93 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 127.031 2.132 . . . . 0.0 112.24 -175.094 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.41 21.12 10.75 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 117.698 2.481 . . . . 0.0 117.698 173.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -87.93 159.64 18.26 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.518 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.944 0 CA-C-N 112.347 -2.206 . . . . 0.0 108.504 -171.836 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 122.282 1.039 . . . . 0.0 112.765 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -77.31 145.26 37.5 Favored 'General case' 0 CA--C 1.556 1.204 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 -169.15 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.483 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 14.2 mt -61.92 0.92 0.32 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 121.429 3.863 . . . . 0.0 121.429 -155.236 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -58.37 -38.18 76.76 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 119.539 1.063 . . . . 0.0 110.997 174.729 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.435 ' OD1' HD22 ' A' ' 45' ' ' LEU . 4.6 t70 -61.69 -46.96 87.48 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 114.935 -1.03 . . . . 0.0 113.14 173.566 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.23 -45.36 96.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.463 1.105 . . . . 0.0 112.827 174.998 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.458 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -55.12 -54.0 48.74 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.026 2.13 . . . . 0.0 112.35 176.247 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.28 -37.96 86.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.126 1.371 . . . . 0.0 114.266 177.855 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -67.98 -34.41 76.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 123.505 0.503 . . . . 0.0 110.317 179.34 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.57 -19.55 27.67 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.277 178.583 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.56 29.17 53.49 Favored Glycine 0 N--CA 1.486 2.016 0 C-N-CA 127.007 2.241 . . . . 0.0 113.704 174.28 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.296 8.5 p -130.21 130.58 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.623 0 C-N-CA 123.563 0.745 . . . . 0.0 109.12 -175.706 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.6 p -44.29 142.17 1.61 Allowed 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 128.658 2.783 . . . . 0.0 110.381 -173.694 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.483 ' CE1' ' HB2' ' A' ' 6' ' ' LEU . 74.3 t80 -48.84 -47.94 42.15 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 117.489 2.403 . . . . 0.0 117.489 -170.105 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.424 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.558 0.0 OUTLIER -56.57 -25.34 52.1 Favored 'General case' 0 C--N 1.322 -0.607 1 N-CA-C 124.359 4.948 . . . . 0.0 124.359 179.835 . . . . . . . . 5 4 . 1 . 021 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.55 ' O ' HG23 ' A' ' 23' ' ' VAL . 5.1 m -58.13 -53.13 61.74 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 111.608 -2.542 . . . . 0.0 111.512 165.501 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.558 ' O ' HG23 ' A' ' 24' ' ' VAL . 95.0 t -63.77 -49.57 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.46 -169.462 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.446 1.0 OUTLIER -58.32 -37.95 76.14 Favored 'General case' 0 CA--C 1.466 -2.278 0 N-CA-C 119.106 3.002 . . . . 0.0 119.106 176.247 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.55 ' HG3' HH11 ' A' ' 22' ' ' ARG . 2.5 mtt85 -63.54 -44.38 94.35 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 110.412 -3.086 . . . . 0.0 114.78 169.012 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.678 HG11 HG21 ' A' ' 38' ' ' VAL . 99.4 t -61.19 -42.87 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.091 -1.413 . . . . 0.0 110.342 -176.6 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 20' ' ' VAL . 96.5 t -54.88 -50.01 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 112.899 -1.955 . . . . 0.0 112.395 -168.292 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -91.72 17.48 8.89 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 171.875 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.454 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.4 OUTLIER 67.49 11.74 8.53 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.99 2.916 . . . . 0.0 114.85 172.326 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.9 40.03 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 127.723 2.409 . . . . 0.0 116.441 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.6 p 57.91 -34.67 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -160.227 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -157.6 99.32 1.72 Allowed 'General case' 0 CA--C 1.564 1.487 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -168.57 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.454 HG12 ' OE1' ' A' ' 26' ' ' GLN 0.258 4.6 p -137.96 152.88 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 175.551 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.5 p -61.29 145.32 51.8 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -173.72 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.36 -63.83 1.0 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.574 1.949 . . . . 0.0 113.359 -177.323 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 33' ' ' LYS 0.254 11.6 tptp -56.96 -42.01 79.35 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.885 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.6 m -57.82 -50.49 73.09 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 113.344 -1.753 . . . . 0.0 108.054 178.755 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.56 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 15.8 mtm105 -57.05 -48.88 77.47 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 174.567 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.47 -34.47 74.07 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 113.708 -1.587 . . . . 0.0 114.896 -176.199 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -78.47 -43.19 27.72 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.212 2.205 . . . . 0.0 111.001 -179.434 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.678 HG21 HG11 ' A' ' 23' ' ' VAL . 81.3 t -63.24 -46.79 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.095 174.909 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 31.9 mt-10 -52.76 -45.51 67.12 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 126.452 1.901 . . . . 0.0 111.966 179.083 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.56 -52.5 60.8 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 110.582 -3.008 . . . . 0.0 111.037 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.33 -52.16 65.82 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 112.85 -1.977 . . . . 0.0 115.674 178.907 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.543 ' HB2' ' HB3' ' A' ' 47' ' ' TYR 0.264 0.0 OUTLIER -59.98 -33.32 71.8 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -178.111 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.91 -50.62 63.82 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.542 179.471 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -62.76 -33.77 75.85 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.521 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.435 HD22 ' OD1' ' A' ' 8' ' ' ASP . 62.0 mt -99.14 14.64 28.66 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.425 2.29 . . . . 0.0 116.951 -177.974 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.353 0.2 OUTLIER 54.48 19.33 2.31 Favored 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 127.127 2.171 . . . . 0.0 116.776 176.309 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.543 ' HB3' ' HB2' ' A' ' 42' ' ' MET . 62.3 t80 -82.99 95.4 8.0 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.977 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 172.509 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.331 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 117.505 -1.236 . . . . 0.0 108.795 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.5 p -75.85 120.63 21.47 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-N 120.878 1.672 . . . . 0.0 109.246 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.412 HD22 HG12 ' A' ' 20' ' ' VAL . 15.8 mt -31.35 -28.82 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.88 0 N-CA-C 121.27 3.804 . . . . 0.0 121.27 -178.215 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -54.2 -37.06 64.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.414 0.686 . . . . 0.0 109.152 173.353 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.463 ' OD2' HD22 ' A' ' 45' ' ' LEU . 21.7 t70 -60.58 -41.32 94.41 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 118.555 -0.736 . . . . 0.0 111.791 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.0 t -62.45 -50.82 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 170.813 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -48.75 -48.89 40.46 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.986 1.315 . . . . 0.0 112.19 175.823 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.54 -44.42 70.98 Favored 'General case' 0 C--N 1.316 -0.861 1 C-N-CA 132.539 4.335 . . . . 0.0 113.49 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.428 ' CB ' HD11 ' A' ' 45' ' ' LEU . 54.3 t80 -63.97 -34.59 78.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.022 0.929 . . . . 0.0 110.538 174.031 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.02 -12.5 38.39 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.522 -177.282 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.58 28.87 66.63 Favored Glycine 0 N--CA 1.495 2.599 0 C-N-CA 125.981 1.753 . . . . 0.0 113.82 177.115 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.405 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 9.3 p -124.85 142.22 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 122.49 1.138 . . . . 0.0 110.167 -170.409 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -55.82 128.69 36.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 129.328 3.051 . . . . 0.0 107.442 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -53.2 -31.67 44.19 Favored 'General case' 0 N--CA 1.509 2.487 0 N-CA-C 118.125 2.639 . . . . 0.0 118.125 -167.035 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -49.2 -44.56 43.25 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.354 -1.307 . . . . 0.0 113.827 175.626 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.637 ' O ' HG23 ' A' ' 23' ' ' VAL . 44.7 p -52.59 -48.82 66.01 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 124.018 0.824 . . . . 0.0 112.548 178.376 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.67 ' O ' HG23 ' A' ' 24' ' ' VAL . 85.4 t -68.46 -52.1 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 113.802 -1.545 . . . . 0.0 110.187 -174.925 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.8 m -59.05 -32.01 69.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.9 mtp85 -65.53 -46.98 77.47 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 111.26 -2.7 . . . . 0.0 113.937 170.898 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.773 HG21 HG21 ' A' ' 38' ' ' VAL . 92.7 t -58.59 -43.88 88.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.595 1.558 . . . . 0.0 108.018 -178.574 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 20' ' ' VAL . 58.1 t -55.45 -47.76 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 CA-C-N 111.951 -2.386 . . . . 0.0 111.54 -173.336 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -95.67 13.88 24.89 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 176.159 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 62.23 16.9 8.8 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 116.605 2.076 . . . . 0.0 116.605 179.027 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.462 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . . . 36.48 22.77 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 110.582 -3.008 . . . . 0.0 118.22 178.685 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 t 63.69 -51.76 0.24 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 125.121 1.369 . . . . 0.0 112.346 -160.66 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -138.16 109.67 7.0 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 178.323 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.869 HG11 HH11 ' A' ' 35' ' ' ARG . 4.6 p -124.06 144.03 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.34 0 O-C-N 120.309 -1.494 . . . . 0.0 113.243 179.53 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.4 p -71.02 137.74 49.29 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 177.717 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -50.79 72.36 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.187 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.468 ' O ' ' HG2' ' A' ' 36' ' ' GLU 0.302 0.0 OUTLIER -59.57 -28.62 67.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 118.164 2.654 . . . . 0.0 118.164 177.545 . . . . . . . . 4 4 . 1 . 022 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.7 m -67.24 -50.28 61.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 112.585 -2.098 . . . . 0.0 107.567 174.246 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.869 HH11 HG11 ' A' ' 30' ' ' VAL . 13.6 mtp85 -59.06 -42.68 90.9 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.58 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 3.2 pt-20 -58.98 -35.23 72.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 113.659 -1.609 . . . . 0.0 113.956 -177.968 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -76.95 -44.23 32.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 110.991 -2.822 . . . . 0.0 112.529 -176.873 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.773 HG21 HG21 ' A' ' 23' ' ' VAL . 42.7 t -64.66 -46.34 92.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 112.305 -2.225 . . . . 0.0 108.967 177.292 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -56.54 -42.18 78.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.824 2.85 . . . . 0.0 111.272 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.0 69.29 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.513 -1.676 . . . . 0.0 111.47 174.527 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.47 91.88 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 113.432 -1.713 . . . . 0.0 115.203 176.958 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.82 -44.53 93.99 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -178.678 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.3 -46.4 88.92 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.495 1.122 . . . . 0.0 112.446 178.661 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -61.99 -39.55 92.6 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.592 -2.094 . . . . 0.0 113.803 177.825 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.463 HD22 ' OD2' ' A' ' 8' ' ' ASP . 26.2 mt -90.21 15.83 9.65 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.601 1.56 . . . . 0.0 114.201 178.225 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 49.62 31.56 4.34 Favored 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 127.189 2.196 . . . . 0.0 112.6 176.895 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -97.52 139.91 32.74 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 122.863 1.316 . . . . 0.0 108.773 -165.657 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.327 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.971 0 CA-C-N 110.807 -2.906 . . . . 0.0 114.5 176.277 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.442 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.294 1.3 p -68.62 100.48 1.13 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 -179.261 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.413 HD21 ' CE2' ' A' ' 47' ' ' TYR . 21.2 mt -43.86 -14.26 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.73 0 N-CA-C 117.602 2.445 . . . . 0.0 117.602 -176.449 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.418 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 2.3 m-30 -55.93 -35.45 66.65 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.019 0.527 . . . . 0.0 110.334 165.909 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.475 ' OD2' HD22 ' A' ' 45' ' ' LEU . 32.6 t70 -59.0 -47.64 84.46 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.8 0.84 . . . . 0.0 113.08 174.395 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.8 t -59.31 -45.86 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 172.104 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -48.07 81.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.348 -2.205 . . . . 0.0 112.123 -177.358 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.418 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.5 OUTLIER -67.53 -42.2 83.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.221 2.208 . . . . 0.0 115.453 177.038 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.4 ' CB ' HD11 ' A' ' 45' ' ' LEU . 46.5 t80 -64.79 -33.05 75.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 124.017 0.823 . . . . 0.0 110.712 177.379 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.12 -16.43 24.93 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.397 -179.768 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.36 25.35 68.48 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 126.747 2.118 . . . . 0.0 113.479 173.558 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.437 HG22 HG21 ' A' ' 19' ' ' THR . 5.4 p -126.0 111.32 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.445 0.698 . . . . 0.0 110.197 -167.264 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 91.7 p -16.83 135.65 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.19 0 C-N-CA 127.889 2.476 . . . . 0.0 111.724 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.309 31.6 t80 -47.83 -53.29 16.0 Favored 'General case' 0 N--CA 1.521 3.086 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 -175.763 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.57 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.366 1.6 pp0? -58.44 -24.77 61.1 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 179.593 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 94.6 m -56.1 -50.21 71.67 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.233 165.255 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 24' ' ' VAL 0.297 79.9 t -65.5 -43.65 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-O 118.542 -0.742 . . . . 0.0 110.733 -177.126 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.89 81.58 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.034 0.834 . . . . 0.0 112.446 -177.54 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.57 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 18.9 mtt85 -61.37 -45.97 92.13 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.013 1.857 . . . . 0.0 116.013 169.168 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.608 HG21 HG21 ' A' ' 38' ' ' VAL . 70.1 t -59.86 -41.25 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 125.019 1.328 . . . . 0.0 108.458 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 20' ' ' VAL . 82.3 t -53.27 -49.87 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 113.687 -1.597 . . . . 0.0 112.665 -171.115 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -92.09 14.34 16.26 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 171.61 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.526 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.3 OUTLIER 60.02 21.08 10.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.971 2.508 . . . . 0.0 113.823 178.072 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.17 45.16 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 111.674 -2.512 . . . . 0.0 116.574 -175.192 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.2 t 64.09 -57.36 0.22 Allowed 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 125.959 1.704 . . . . 0.0 111.929 -163.589 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -146.08 104.86 3.86 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 125.858 1.663 . . . . 0.0 107.646 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.526 HG12 ' OE1' ' A' ' 26' ' ' GLN . 9.8 p -113.51 157.61 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 120.891 1.678 . . . . 0.0 114.453 177.311 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -60.81 121.01 11.24 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.647 0.737 . . . . 0.0 112.913 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -41.24 -62.62 0.81 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -43.3 -43.13 4.78 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 179.529 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -59.85 -52.42 65.53 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 179.05 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.2 mtm105 -54.43 -47.67 72.56 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.575 1.695 . . . . 0.0 115.575 177.316 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.46 -36.5 69.12 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -176.635 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -76.72 -42.12 42.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 111.354 -2.657 . . . . 0.0 111.364 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.608 HG21 HG21 ' A' ' 23' ' ' VAL . 60.5 t -64.98 -49.53 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 C-N-CA 125.892 1.677 . . . . 0.0 108.029 176.379 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -52.54 -40.4 62.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 128.54 2.736 . . . . 0.0 112.875 179.082 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.51 -52.98 55.04 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.3 -2.227 . . . . 0.0 111.663 173.544 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.98 86.04 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 113.404 -1.725 . . . . 0.0 114.254 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.97 -45.48 86.66 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.501 1.92 . . . . 0.0 115.947 -177.985 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.83 -46.39 82.15 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 112.721 -2.036 . . . . 0.0 112.563 177.135 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.84 -35.44 80.67 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 111.964 -2.38 . . . . 0.0 113.926 -174.893 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.475 HD22 ' OD2' ' A' ' 8' ' ' ASP . 46.4 mt -91.56 18.39 7.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.528 1.931 . . . . 0.0 113.96 179.936 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.42 0.2 OUTLIER 52.03 36.96 20.03 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.789 1.235 . . . . 0.0 113.876 178.537 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.413 ' CE2' HD21 ' A' ' 6' ' ' LEU . 11.1 t80 -100.41 175.64 5.63 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -172.443 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -176.578 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.36 0.5 OUTLIER . . . . . 0 N--CA 1.497 1.898 0 CA-C-O 121.377 0.608 . . . . 0.0 109.866 . . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.301 2.8 p -73.07 99.22 2.72 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.6 mt -41.0 -14.4 0.01 OUTLIER 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 118.546 2.795 . . . . 0.0 118.546 -176.956 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.502 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 56.2 m-85 -54.62 -33.17 60.06 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 119.096 0.862 . . . . 0.0 111.071 165.338 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.441 ' OD2' HD22 ' A' ' 45' ' ' LEU . 15.0 t70 -59.13 -48.82 80.2 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 118.408 -0.806 . . . . 0.0 113.09 173.877 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -58.05 -44.26 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 173.358 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.22 70.62 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 112.029 -2.351 . . . . 0.0 111.531 -177.261 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.502 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.1 -39.57 86.77 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.515 1.926 . . . . 0.0 114.282 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -66.34 -36.35 82.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-O 122.236 1.017 . . . . 0.0 110.881 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.61 -15.15 40.67 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.198 -1.819 . . . . 0.0 110.856 178.694 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 26.65 60.89 Favored Glycine 0 CA--C 1.544 1.888 0 C-N-CA 126.936 2.208 . . . . 0.0 113.128 170.576 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -124.36 128.75 73.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.25 0.62 . . . . 0.0 110.655 -167.243 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.7 p -33.08 122.14 0.38 Allowed 'General case' 0 N--CA 1.514 2.725 0 C-N-CA 127.445 2.298 . . . . 0.0 109.13 175.288 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.317 41.8 t80 -40.92 -47.8 3.04 Favored 'General case' 0 N--CA 1.522 3.147 0 N-CA-C 117.628 2.455 . . . . 0.0 117.628 -175.873 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.425 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.403 0.0 OUTLIER -57.53 -16.99 11.52 Favored 'General case' 0 C--N 1.32 -0.681 1 N-CA-C 122.073 4.101 . . . . 0.0 122.073 179.108 . . . . . . . . 5 4 . 1 . 024 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 23' ' ' VAL . 69.0 p -64.96 -52.61 55.34 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 114.203 -1.362 . . . . 0.0 112.866 162.014 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.677 ' O ' HG23 ' A' ' 24' ' ' VAL 0.27 73.7 t -60.99 -47.6 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.204 -171.39 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 p -57.12 -42.58 81.13 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 122.775 1.274 . . . . 0.0 112.411 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.425 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 17.1 mtt85 -67.7 -38.97 84.37 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 119.773 3.249 . . . . 0.0 119.773 173.912 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.813 HG11 HG21 ' A' ' 38' ' ' VAL . 24.7 t -55.11 -46.62 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 127.237 2.215 . . . . 0.0 107.979 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.677 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.2 t -55.7 -46.81 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 110.974 -2.83 . . . . 0.0 111.239 -168.006 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.282 95.4 m-20 -99.07 26.81 5.52 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.87 -1.513 . . . . 0.0 114.437 176.65 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.454 ' C ' ' H ' ' A' ' 28' ' ' SER . 17.5 pt20 49.29 44.54 23.52 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-O 123.809 1.766 . . . . 0.0 112.905 171.543 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.296 . . -72.87 36.15 0.08 Allowed 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 110.211 -3.177 . . . . 0.0 118.858 -176.501 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.454 ' H ' ' C ' ' A' ' 26' ' ' GLN . 4.7 m 4.83 93.99 0.01 OUTLIER 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 108.854 -3.794 . . . . 0.0 117.902 176.617 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.7 m80 171.89 -68.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 102.67 -3.085 . . . . 0.0 102.67 -167.58 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -25.16 101.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 129.1 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 86.1 p -100.6 156.29 17.39 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 112.234 -2.257 . . . . 0.0 114.811 -177.048 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -15.21 -63.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.403 1.881 . . . . 0.0 115.28 167.646 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.82 -51.85 12.19 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 176.948 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 38' ' ' VAL . 76.3 m -59.56 -51.45 69.77 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.481 1.512 . . . . 0.0 107.012 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.495 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -54.87 -43.3 73.02 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.762 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.86 -39.4 85.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.309 -1.769 . . . . 0.0 114.744 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -79.11 -40.84 30.06 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 113.079 -1.873 . . . . 0.0 112.072 -177.487 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.813 HG21 HG11 ' A' ' 23' ' ' VAL . 44.7 t -61.17 -47.56 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.74 1.616 . . . . 0.0 106.771 172.706 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 53.2 mt-10 -55.73 -44.68 77.76 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.344 2.258 . . . . 0.0 111.499 -178.585 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -51.7 65.83 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.658 -2.065 . . . . 0.0 110.925 177.936 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.68 -40.7 80.01 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 113.205 -1.816 . . . . 0.0 113.603 176.193 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 mtt -58.25 -48.97 78.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -176.0 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.4 94.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.101 -2.318 . . . . 0.0 112.875 177.599 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -64.13 -34.47 78.12 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-N 112.332 -2.213 . . . . 0.0 113.684 -177.533 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.441 HD22 ' OD2' ' A' ' 8' ' ' ASP . 47.0 mt -94.48 18.0 12.08 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.867 1.667 . . . . 0.0 113.042 -178.486 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.69 21.41 5.85 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.693 2.397 . . . . 0.0 113.043 178.341 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -89.79 157.43 17.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -170.294 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.429 24.5 mm . . . . . 0 CA--C 1.535 0.396 1 N-CA-C 121.921 4.045 . . . . 0.0 121.921 178.112 . . . . . . . . 2 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.415 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 118.962 -0.542 . . . . 0.0 109.669 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.3 p -91.54 145.66 24.43 Favored 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.3 -165.521 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.473 HD22 HG12 ' A' ' 20' ' ' VAL . 8.2 mt -45.71 -27.88 0.9 Allowed 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -170.384 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -59.58 -39.61 84.7 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.816 0.735 . . . . 0.0 111.744 176.597 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.5 -48.31 74.81 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 171.121 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.0 t -60.0 -40.62 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 174.317 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.406 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -60.15 -50.54 73.29 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.643 -1.617 . . . . 0.0 113.201 177.563 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.69 -39.35 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.993 1.717 . . . . 0.0 113.72 177.212 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.403 ' CB ' HD11 ' A' ' 45' ' ' LEU . 36.5 t80 -67.27 -34.97 78.53 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.572 0.749 . . . . 0.0 111.212 177.479 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.42 -14.91 44.76 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.104 177.246 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.91 29.46 54.38 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 126.124 1.821 . . . . 0.0 112.655 170.831 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -132.4 134.37 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.981 0 CA-C-O 122.202 1.001 . . . . 0.0 109.651 -168.409 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.5 p -41.21 130.88 2.79 Favored 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 128.135 2.574 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.414 ' HE1' ' HB2' ' A' ' 6' ' ' LEU . 85.9 t80 -51.95 -29.54 20.88 Favored 'General case' 0 N--CA 1.51 2.528 0 N-CA-C 119.586 3.18 . . . . 0.0 119.586 -174.524 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -49.31 -41.52 38.59 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 116.479 -1.724 . . . . 0.0 113.374 172.889 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 43.5 p -63.22 -53.85 46.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 176.378 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.726 ' O ' HG23 ' A' ' 24' ' ' VAL . 82.4 t -62.38 -48.18 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.831 0.852 . . . . 0.0 110.207 -173.079 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.0 p -57.81 -42.45 84.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 116.609 2.078 . . . . 0.0 116.609 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 19' ' ' THR . 30.2 mtp85 -62.01 -45.59 92.91 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 109.995 -3.275 . . . . 0.0 115.157 171.212 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 38' ' ' VAL . 14.3 t -54.92 -48.31 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 127.405 2.282 . . . . 0.0 109.657 179.253 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.726 HG23 ' O ' ' A' ' 20' ' ' VAL . 48.3 t -57.26 -48.68 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 CA-C-N 109.945 -3.298 . . . . 0.0 112.937 -166.826 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.301 79.9 m-20 -108.54 33.44 4.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.756 -1.565 . . . . 0.0 114.9 176.364 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 73.51 -5.49 1.97 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.902 2.881 . . . . 0.0 118.619 167.053 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.15 30.02 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.814 2.446 . . . . 0.0 115.266 -175.785 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.6 p 55.21 -44.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 -148.448 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.272 77.9 m80 -153.8 131.96 11.85 Favored 'General case' 0 CA--C 1.556 1.189 0 CA-C-O 117.64 -1.171 . . . . 0.0 109.875 -175.986 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.9 t -150.98 143.19 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.847 1.658 . . . . 0.0 113.887 159.244 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 p -23.34 131.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 119.387 3.106 . . . . 0.0 119.387 166.123 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 35' ' ' ARG . . . -66.45 -47.43 73.17 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.945 0.898 . . . . 0.0 112.791 -176.61 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.93 15.76 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 176.226 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -61.78 -49.61 75.65 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.931 1.692 . . . . 0.0 107.653 175.995 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.565 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 12.5 mmt85 -58.18 -46.77 85.17 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.688 1.995 . . . . 0.0 113.054 -178.941 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.26 -37.92 75.92 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 179.506 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -73.3 -43.26 61.26 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 112.27 -2.241 . . . . 0.0 111.87 178.695 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.562 HG21 HG11 ' A' ' 23' ' ' VAL . 85.8 t -63.6 -48.84 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 114.396 -1.275 . . . . 0.0 108.699 177.393 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.565 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 42.0 mt-10 -49.17 -46.81 45.95 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 128.981 2.912 . . . . 0.0 108.995 178.464 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.45 -54.23 31.41 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 112.706 -2.043 . . . . 0.0 111.359 -178.475 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.13 -42.41 69.48 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.275 -1.784 . . . . 0.0 114.23 174.332 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.603 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 3.0 mmt -59.62 -50.37 74.14 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 125.88 1.672 . . . . 0.0 111.587 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.98 -42.77 94.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.292 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.52 -32.93 74.59 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.501 179.566 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.403 HD11 ' CB ' ' A' ' 12' ' ' TYR . 29.6 mt -92.76 11.53 26.59 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 125.683 1.593 . . . . 0.0 113.727 177.576 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.408 0.2 OUTLIER 46.47 29.76 0.96 Allowed 'General case' 0 CA--C 1.564 1.487 0 C-N-CA 127.298 2.239 . . . . 0.0 113.715 -175.791 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.603 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 24.9 t80 -93.8 103.48 15.61 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.03 -1.044 . . . . 0.0 108.59 -168.037 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.764 0 CA-C-N 113.534 -1.666 . . . . 0.0 113.799 169.395 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.465 1.1 t . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 103.474 -2.787 . . . . 0.0 103.474 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 19.1 p -101.05 141.46 33.91 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.616 -0.677 . . . . 0.0 110.371 -176.924 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.572 HD22 HG12 ' A' ' 20' ' ' VAL . 21.6 mt -47.02 -23.84 0.53 Allowed 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 119.563 3.171 . . . . 0.0 119.563 -164.863 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -62.28 -35.59 79.47 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.14 0.882 . . . . 0.0 111.727 175.2 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.498 ' OD2' HD22 ' A' ' 45' ' ' LEU . 21.1 t70 -59.55 -46.92 87.49 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 118.383 -0.818 . . . . 0.0 112.885 171.283 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.9 t -58.61 -45.46 90.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 172.765 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.01 71.34 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.288 1.435 . . . . 0.0 112.598 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.58 -38.81 84.58 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.184 1.794 . . . . 0.0 115.766 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.407 ' CB ' HD11 ' A' ' 45' ' ' LEU . 48.6 t80 -64.82 -35.64 81.76 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.97 0.908 . . . . 0.0 110.346 176.58 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.38 -14.9 44.91 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.149 -1.387 . . . . 0.0 110.241 179.311 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.31 24.96 69.55 Favored Glycine 0 N--CA 1.48 1.582 0 C-N-CA 127.23 2.347 . . . . 0.0 113.275 172.443 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -121.02 124.72 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 124.188 0.995 . . . . 0.0 109.749 -167.812 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.4 p -31.12 123.27 0.22 Allowed 'General case' 0 N--CA 1.513 2.715 0 C-N-CA 127.207 2.203 . . . . 0.0 108.534 175.214 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -39.47 -33.18 0.15 Allowed 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 115.863 1.801 . . . . 0.0 115.863 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -48.11 -42.4 29.02 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 117.745 -1.121 . . . . 0.0 112.733 176.986 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.456 ' O ' HG23 ' A' ' 23' ' ' VAL . 2.3 p -60.83 -55.77 29.08 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 175.764 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.617 ' O ' HG23 ' A' ' 24' ' ' VAL 0.326 94.7 t -60.45 -44.61 96.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 C-N-CA 124.666 1.186 . . . . 0.0 110.092 -165.05 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.5 p -59.61 -49.35 78.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.198 0.999 . . . . 0.0 113.056 178.885 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 19' ' ' THR . 26.2 mtp85 -56.75 -44.53 81.83 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 111.998 -2.364 . . . . 0.0 113.857 173.278 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.486 HG21 HG21 ' A' ' 38' ' ' VAL . 43.7 t -59.57 -47.83 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.522 1.529 . . . . 0.0 109.069 -178.813 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 20' ' ' VAL . 50.5 t -60.02 -41.38 86.05 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 112.982 -1.917 . . . . 0.0 112.042 -167.776 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.26 90.1 m-20 -100.05 23.48 9.85 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 113.697 -1.592 . . . . 0.0 114.867 173.518 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.34 5.91 4.54 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 170.647 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.96 43.36 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 111.566 -2.561 . . . . 0.0 115.147 -167.904 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.0 p 57.34 -59.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 113.155 -1.839 . . . . 0.0 114.485 -160.261 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -140.16 108.41 5.8 Favored 'General case' 0 CA--C 1.559 1.297 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.145 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.3 p -121.51 157.66 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 171.606 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 p -68.96 131.44 45.09 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 116.462 2.023 . . . . 0.0 116.462 -175.13 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -24.65 -67.06 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 128.004 2.522 . . . . 0.0 117.026 176.053 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -53.36 -40.54 65.02 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -172.346 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -50.45 70.09 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 113.056 -1.884 . . . . 0.0 107.31 -178.108 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -63.45 -40.13 96.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -179.645 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.76 -36.56 83.45 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.744 -176.743 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.74 -41.45 53.29 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 112.883 -1.962 . . . . 0.0 110.965 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.486 HG21 HG21 ' A' ' 23' ' ' VAL . 47.7 t -64.83 -47.4 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.294 1.438 . . . . 0.0 109.099 176.075 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.2 mt-10 -52.48 -43.97 65.33 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 130.066 3.347 . . . . 0.0 109.693 179.095 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.76 -51.35 67.48 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.005 -1.907 . . . . 0.0 111.28 177.738 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.85 93.22 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 113.837 -1.529 . . . . 0.0 113.55 176.261 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 mtt -56.59 -45.78 81.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 127.573 2.349 . . . . 0.0 113.537 -178.8 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.52 -47.96 76.93 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 113.077 -1.874 . . . . 0.0 112.628 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -63.04 -39.34 94.46 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 112.348 -2.205 . . . . 0.0 113.142 -177.423 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.498 HD22 ' OD2' ' A' ' 8' ' ' ASP . 52.9 mt -84.76 7.81 19.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.32 2.248 . . . . 0.0 113.902 -177.5 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.403 0.5 OUTLIER 49.22 45.21 23.43 Favored 'General case' 0 CA--C 1.573 1.849 0 C-N-CA 125.304 1.442 . . . . 0.0 112.852 179.679 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -95.39 -167.29 1.59 Allowed 'General case' 0 CA--C 1.558 1.254 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.26 -167.519 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 117.708 -1.139 . . . . 0.0 109.571 179.977 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.445 1.1 t . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 102.906 -2.998 . . . . 0.0 102.906 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.9 p -93.94 134.94 35.8 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.197 -174.505 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.552 HD21 ' OH ' ' A' ' 47' ' ' TYR . 22.4 mt -51.36 -22.37 2.87 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 120.188 3.403 . . . . 0.0 120.188 -163.591 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -58.37 -32.36 68.49 Favored 'General case' 0 CA--C 1.551 1.0 0 O-C-N 123.406 0.441 . . . . 0.0 109.951 175.995 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -61.59 -52.33 64.83 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 118.01 -0.995 . . . . 0.0 113.26 171.406 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.6 t -56.59 -44.71 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 174.205 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.42 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -58.11 -51.9 67.79 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.353 2.661 . . . . 0.0 112.998 -178.118 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.77 -39.85 84.09 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.86 1.664 . . . . 0.0 113.909 177.456 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -67.17 -34.01 76.63 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.414 1.086 . . . . 0.0 111.155 177.074 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.86 -11.25 42.51 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.73 1.212 . . . . 0.0 111.291 178.357 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.49 17.57 77.91 Favored Glycine 0 N--CA 1.48 1.602 0 C-N-CA 126.511 2.005 . . . . 0.0 114.15 169.187 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -117.98 136.64 54.5 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 124.828 1.251 . . . . 0.0 110.07 -170.427 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -36.29 123.59 0.77 Allowed 'General case' 0 N--CA 1.52 3.029 0 C-N-CA 127.414 2.286 . . . . 0.0 108.872 -179.485 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -34.21 -46.75 0.26 Allowed 'General case' 0 N--CA 1.53 3.543 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 175.044 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.521 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.572 3.2 pp0? -59.6 -29.97 68.36 Favored 'General case' 0 C--N 1.322 -0.613 1 N-CA-C 124.455 4.983 . . . . 0.0 124.455 176.642 . . . . . . . . 4 3 . 1 . 027 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' HG23 ' A' ' 23' ' ' VAL . 70.1 p -59.18 -46.14 89.19 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.416 -1.266 . . . . 0.0 112.763 165.047 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.524 ' O ' HG23 ' A' ' 24' ' ' VAL . 92.5 t -66.06 -47.5 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.686 0.794 . . . . 0.0 110.275 -175.757 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.292 2.7 m -61.55 -34.67 75.96 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -177.836 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.566 ' HB2' ' O ' ' A' ' 19' ' ' THR . 17.3 mtt85 -60.81 -49.02 79.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 111.385 -2.643 . . . . 0.0 114.603 166.423 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 19' ' ' THR . 92.8 t -61.52 -45.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.113 -175.778 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 20' ' ' VAL . 30.1 t -57.97 -45.09 87.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 O-C-N 124.938 1.399 . . . . 0.0 111.477 -168.243 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -90.81 24.24 2.81 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 113.846 -1.525 . . . . 0.0 113.958 175.176 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.292 0.0 OUTLIER 62.98 1.85 0.92 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 129.953 3.301 . . . . 0.0 117.741 173.668 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.76 40.02 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 111.811 -2.45 . . . . 0.0 116.141 -170.921 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.25 98.4 p 61.23 -49.61 0.12 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -164.951 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -153.33 104.59 2.78 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -174.79 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 p -125.74 150.99 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 N-CA-C 116.495 2.035 . . . . 0.0 116.495 -179.595 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -59.65 137.48 58.02 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 116.977 2.214 . . . . 0.0 116.977 -176.009 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.24 -61.52 1.95 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.521 1.929 . . . . 0.0 114.868 177.102 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.72 -35.83 56.52 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 38' ' ' VAL . 24.7 m -69.27 -58.14 4.42 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.549 1.54 . . . . 0.0 107.346 174.661 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.458 ' HB3' ' OE2' ' A' ' 39' ' ' GLU . 7.9 mtm105 -53.5 -48.09 69.28 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -179.157 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -56.3 -36.84 69.1 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.735 2.014 . . . . 0.0 113.695 -174.108 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -77.62 -44.64 27.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 109.698 -3.41 . . . . 0.0 110.518 -176.956 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.539 HG21 HG21 ' A' ' 23' ' ' VAL . 42.0 t -65.34 -48.46 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.125 1.77 . . . . 0.0 108.234 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.458 ' OE2' ' HB3' ' A' ' 35' ' ' ARG . 41.4 mt-10 -59.15 -40.04 84.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 128.64 2.776 . . . . 0.0 115.645 179.123 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.9 58.12 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 111.98 -2.373 . . . . 0.0 110.029 172.766 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.54 -37.57 73.29 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 112.988 -1.914 . . . . 0.0 113.29 176.986 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.5 ' HG2' ' CD2' ' A' ' 47' ' ' TYR . 34.3 mtt -58.09 -55.98 27.96 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 -174.699 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -42.32 99.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.613 179.024 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.86 -37.07 85.41 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.307 -2.224 . . . . 0.0 112.501 -176.978 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -94.0 16.84 13.49 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.966 1.306 . . . . 0.0 114.269 -178.165 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.343 1.5 p-10 54.73 48.9 19.17 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-O 123.948 1.832 . . . . 0.0 113.745 178.871 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.552 ' OH ' HD21 ' A' ' 6' ' ' LEU . 73.5 t80 -105.86 157.87 17.16 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.368 -1.287 . . . . 0.0 112.462 -173.166 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.496 0 CA-C-N 114.008 -1.451 . . . . 0.0 111.601 -173.827 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.4 OUTLIER . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 103.354 -2.832 . . . . 0.0 103.354 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 p -85.41 150.56 24.64 Favored 'General case' 0 CA--C 1.552 1.033 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 175.891 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.0 mt -46.41 -25.11 0.6 Allowed 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 119.996 3.332 . . . . 0.0 119.996 -166.811 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -60.54 -40.17 90.6 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 119.665 1.12 . . . . 0.0 112.155 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.57 -31.04 71.86 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.72 179.328 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.69 -50.31 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 168.238 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.68 -53.78 35.3 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.544 1.938 . . . . 0.0 112.249 176.767 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.39 -39.03 88.8 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.559 1.543 . . . . 0.0 112.298 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.482 ' CB ' HD11 ' A' ' 45' ' ' LEU . 32.4 t80 -65.1 -34.4 78.32 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 121.755 0.788 . . . . 0.0 109.906 177.189 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.53 -11.91 44.35 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.094 178.616 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 31.29 66.83 Favored Glycine 0 N--CA 1.483 1.818 0 C-N-CA 126.891 2.186 . . . . 0.0 112.24 171.544 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.12 128.49 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-O 121.78 0.8 . . . . 0.0 111.354 -168.579 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.4 p -34.57 122.22 0.52 Allowed 'General case' 0 N--CA 1.516 2.826 0 C-N-CA 128.095 2.558 . . . . 0.0 107.462 174.294 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -42.18 -43.3 3.3 Favored 'General case' 0 N--CA 1.538 3.931 0 N-CA-C 117.849 2.537 . . . . 0.0 117.849 -166.509 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.413 0.0 OUTLIER -57.43 -24.83 57.91 Favored 'General case' 0 C--N 1.318 -0.795 1 N-CA-C 123.437 4.606 . . . . 0.0 123.437 -178.214 . . . . . . . . 4 3 . 1 . 028 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.524 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.7 p -55.77 -54.71 41.09 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.801 0.688 . . . . 0.0 111.707 164.548 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.627 ' O ' HG23 ' A' ' 24' ' ' VAL . 82.1 t -59.74 -49.79 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.31 1.844 . . . . 0.0 108.623 -172.195 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 m -59.81 -37.53 79.4 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.239 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.525 ' HG3' HH11 ' A' ' 22' ' ' ARG . 11.0 mtt85 -67.29 -41.16 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 118.953 2.946 . . . . 0.0 118.953 170.27 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 38' ' ' VAL . 74.4 t -59.35 -41.44 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 126.379 1.872 . . . . 0.0 107.368 179.544 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 20' ' ' VAL . 58.4 t -59.28 -45.0 93.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 113.182 -1.826 . . . . 0.0 112.579 -169.852 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -83.84 4.4 29.44 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 170.3 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 66.31 14.18 9.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.016 2.127 . . . . 0.0 115.832 -177.047 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 24.02 40.46 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.834 2.454 . . . . 0.0 117.557 -171.41 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.258 96.0 p 58.46 -53.7 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -162.576 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -140.34 79.56 1.71 Allowed 'General case' 0 CA--C 1.571 1.776 0 C-N-CA 124.101 0.961 . . . . 0.0 109.909 -175.124 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -102.24 140.2 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 119.836 -1.79 . . . . 0.0 114.699 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.1 t -58.2 150.55 21.29 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -176.604 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.69 0.24 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.747 2.019 . . . . 0.0 113.491 -175.834 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -56.32 -30.93 63.21 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 120.401 3.482 . . . . 0.0 120.401 -178.807 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 36.6 m -62.73 -52.0 64.94 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 174.579 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -57.01 -44.3 82.68 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 176.608 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -36.63 72.56 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.769 1.627 . . . . 0.0 115.157 -176.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.6 ttpt -76.07 -42.31 47.82 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 110.934 -2.848 . . . . 0.0 110.987 -178.453 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 23' ' ' VAL . 74.9 t -65.67 -51.25 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.861 179.595 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -53.57 -46.73 70.4 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 129.825 3.25 . . . . 0.0 110.999 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.85 -49.65 71.92 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.439 -2.164 . . . . 0.0 111.879 176.532 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.18 -49.64 77.07 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.578 -1.647 . . . . 0.0 113.178 176.494 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.6 mtt -54.2 -45.54 72.22 Favored 'General case' 0 N--CA 1.497 1.903 0 C-N-CA 127.0 2.12 . . . . 0.0 111.061 -179.437 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.61 -47.77 82.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 125.843 1.964 . . . . 0.0 111.507 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -64.41 -40.55 95.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 113.044 -1.889 . . . . 0.0 113.584 177.548 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.482 HD11 ' CB ' ' A' ' 12' ' ' TYR . 61.6 mt -84.89 9.24 14.88 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 127.632 2.373 . . . . 0.0 115.103 179.978 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.274 0.6 OUTLIER 49.1 34.66 6.04 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 126.29 1.836 . . . . 0.0 114.048 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -80.34 161.29 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.461 -0.774 . . . . 0.0 111.077 -171.338 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.31 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.123 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.863 177.985 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.405 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.5 p -71.96 144.44 48.89 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 -169.559 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.619 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 41.7 mt -55.5 -23.7 27.55 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -162.747 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -51.82 -39.87 59.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.766 1.626 . . . . 0.0 109.322 177.156 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -62.63 -45.23 93.79 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.706 174.644 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.4 t -57.88 -47.86 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 169.222 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.49 -51.02 66.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.316 1.846 . . . . 0.0 113.547 177.444 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.43 90.98 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.24 1.816 . . . . 0.0 113.558 179.215 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.415 ' CB ' HD11 ' A' ' 45' ' ' LEU . 37.0 t80 -64.88 -31.82 73.24 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 121.909 0.862 . . . . 0.0 110.582 176.341 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.36 -20.62 25.09 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.295 178.998 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 28.2 55.32 Favored Glycine 0 CA--C 1.545 1.909 0 C-N-CA 126.339 1.923 . . . . 0.0 112.82 173.719 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -127.93 128.25 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -173.128 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 p -52.48 139.88 24.02 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 124.516 1.126 . . . . 0.0 111.407 -173.198 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.619 ' CE1' ' HB2' ' A' ' 6' ' ' LEU . 41.9 t80 -46.63 -43.56 17.58 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 119.871 3.286 . . . . 0.0 119.871 -165.559 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.484 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.403 0.0 OUTLIER -55.37 -25.07 33.13 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 121.748 3.981 . . . . 0.0 121.748 -179.362 . . . . . . . . 4 4 . 1 . 029 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.535 ' O ' HG23 ' A' ' 23' ' ' VAL . 55.8 p -60.74 -55.17 36.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 114.009 -1.451 . . . . 0.0 112.951 166.461 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 24' ' ' VAL . 97.1 t -60.08 -48.59 87.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.153 1.781 . . . . 0.0 109.469 -176.285 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.341 3.6 m -56.21 -36.8 68.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 115.551 1.685 . . . . 0.0 115.551 177.38 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.548 ' HG3' HH11 ' A' ' 22' ' ' ARG . 12.3 mtt85 -67.81 -45.95 73.27 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 111.727 -2.488 . . . . 0.0 115.98 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.57 HG21 HG21 ' A' ' 38' ' ' VAL . 66.0 t -60.4 -43.33 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 125.372 1.469 . . . . 0.0 109.673 -179.538 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 20' ' ' VAL . 86.0 t -54.58 -50.74 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.382 0 CA-C-N 112.441 -2.163 . . . . 0.0 110.521 -173.434 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.21 18.12 14.34 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.655 -1.611 . . . . 0.0 113.952 177.761 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 28' ' ' SER 0.3 17.4 mt-30 68.19 11.09 8.22 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 119.768 3.247 . . . . 0.0 119.768 173.657 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.451 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . . . 40.41 -36.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 121.12 3.748 . . . . 0.0 121.12 176.89 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.492 ' H ' ' C ' ' A' ' 26' ' ' GLN . 51.0 p 125.38 -73.32 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.871 1 C-N-CA 133.571 4.748 . . . . 0.0 107.647 -166.425 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -141.08 128.2 20.8 Favored 'General case' 0 CA--C 1.556 1.183 0 CA-C-O 116.546 -1.693 . . . . 0.0 112.238 173.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.416 HG12 ' NE ' ' A' ' 35' ' ' ARG 0.258 0.3 OUTLIER -139.52 158.86 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 118.137 2.643 . . . . 0.0 118.137 167.72 . . . . . . . . 4 4 . 1 . 029 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -45.27 135.38 5.9 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -176.105 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.71 -63.35 1.2 Allowed 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -172.568 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' ' 33' ' ' LYS 0.265 13.4 tptp -49.08 -34.73 14.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.734 2.124 . . . . 0.0 116.734 179.018 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.499 ' O ' HG23 ' A' ' 38' ' ' VAL . 87.8 m -54.17 -56.26 19.91 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 174.215 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.416 ' NE ' HG12 ' A' ' 30' ' ' VAL . 19.2 mtt180 -58.64 -45.85 88.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.353 1.461 . . . . 0.0 113.72 -175.89 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -34.47 75.44 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 179.995 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.36 -45.77 37.26 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.889 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.57 HG21 HG21 ' A' ' 23' ' ' VAL . 39.8 t -58.48 -48.26 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.288 177.474 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 40.2 mt-10 -60.12 -44.79 94.61 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.561 2.344 . . . . 0.0 114.569 -178.641 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.88 65.43 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.617 176.366 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.25 -40.98 75.02 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 112.686 -2.052 . . . . 0.0 113.024 176.596 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.6 mtt -60.58 -51.47 69.26 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 125.818 1.647 . . . . 0.0 115.196 -176.943 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.85 98.54 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 113.189 -1.823 . . . . 0.0 111.835 179.585 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -65.03 -40.97 95.61 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 112.523 -2.126 . . . . 0.0 113.954 -176.83 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.415 HD11 ' CB ' ' A' ' 12' ' ' TYR . 43.5 mt -86.25 22.55 1.76 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.827 1.651 . . . . 0.0 115.251 -178.271 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.3 29.55 3.85 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 126.019 1.728 . . . . 0.0 113.376 177.528 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 61.4 t80 -87.27 -176.22 5.57 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.859 -1.518 . . . . 0.0 110.228 -170.978 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.422 ' N ' ' CG ' ' A' ' 47' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.804 0 CA-C-O 117.941 -1.028 . . . . 0.0 109.388 -173.207 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.469 0.7 OUTLIER . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.339 2.0 p -67.94 105.11 1.9 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.7 mt -43.56 -21.96 0.04 OUTLIER 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -177.453 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -57.28 -31.43 65.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 120.851 0.358 . . . . 0.0 111.931 169.908 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.486 ' OD2' HD22 ' A' ' 45' ' ' LEU . 13.0 t0 -58.82 -51.09 71.49 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.873 0.869 . . . . 0.0 110.895 170.84 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.8 t -59.14 -43.35 89.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 176.218 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.47 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -55.22 -55.45 31.16 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.944 1.697 . . . . 0.0 112.707 175.619 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -42.21 92.66 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.952 2.101 . . . . 0.0 114.229 -179.536 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.436 ' CB ' HD11 ' A' ' 45' ' ' LEU . 36.5 t80 -66.23 -34.27 77.63 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.119 0.887 . . . . 0.0 110.515 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.21 34.84 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 113.822 -1.536 . . . . 0.0 110.571 179.374 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.63 29.0 60.24 Favored Glycine 0 CA--C 1.546 1.99 0 C-N-CA 127.192 2.329 . . . . 0.0 112.71 172.782 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.32 138.71 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 123.636 0.774 . . . . 0.0 110.483 -167.843 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -46.2 130.26 10.32 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 127.101 2.161 . . . . 0.0 107.139 178.768 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -50.01 -31.63 13.29 Favored 'General case' 0 N--CA 1.503 2.208 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.995 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -50.81 -44.8 59.13 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 124.642 1.214 . . . . 0.0 112.377 177.231 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.621 ' O ' HG23 ' A' ' 23' ' ' VAL 0.756 0.6 OUTLIER -67.79 -40.45 83.92 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.868 . . . . . . . . 4 4 . 1 . 030 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.612 ' O ' HG23 ' A' ' 24' ' ' VAL . 71.6 t -60.98 -50.47 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.221 0.608 . . . . 0.0 110.861 -176.09 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 56.2 p -58.73 -43.44 90.18 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.422 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -59.48 -46.13 89.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 110.621 -2.99 . . . . 0.0 115.861 168.494 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.628 HG11 HG21 ' A' ' 38' ' ' VAL . 63.0 t -59.0 -43.47 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.658 1.183 . . . . 0.0 108.869 -178.175 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 20' ' ' VAL . 90.9 t -50.54 -48.07 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 112.901 -1.954 . . . . 0.0 112.977 -171.228 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.272 97.2 m-20 -99.9 25.82 6.94 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 172.149 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 65.91 5.12 3.28 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 127.51 2.324 . . . . 0.0 116.964 173.837 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 37.94 37.05 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.489 2.716 . . . . 0.0 115.719 -176.049 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.5 p 60.29 -49.54 0.09 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 126.486 1.915 . . . . 0.0 115.774 -163.252 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.266 74.3 m80 -147.83 101.01 3.27 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -175.635 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.43 158.07 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 O-C-N 119.877 -1.764 . . . . 0.0 114.222 170.005 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -57.7 133.31 55.24 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.345 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.22 -54.88 42.04 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -177.155 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.98 -38.74 8.06 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 118.553 2.797 . . . . 0.0 118.553 175.798 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 49.5 m -62.57 -49.02 76.93 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.45 -1.704 . . . . 0.0 107.282 177.987 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.5 OUTLIER -57.57 -46.2 84.26 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 178.076 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.94 -37.09 71.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -178.44 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -77.24 -47.28 20.6 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 112.435 -2.166 . . . . 0.0 111.373 -179.365 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.628 HG21 HG11 ' A' ' 23' ' ' VAL . 47.9 t -62.79 -47.47 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 124.682 1.193 . . . . 0.0 108.009 178.308 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 49.2 mt-10 -54.58 -42.06 70.59 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 128.796 2.838 . . . . 0.0 111.73 -179.974 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.53 66.68 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 112.005 -2.361 . . . . 0.0 110.815 176.666 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.61 -39.03 79.3 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 112.93 -1.941 . . . . 0.0 112.18 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 31.2 mtt -61.04 -49.07 78.89 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.638 -1.164 . . . . 0.0 114.031 -173.044 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.78 98.09 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 112.336 -2.211 . . . . 0.0 111.687 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.97 -37.78 88.46 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 112.292 -2.231 . . . . 0.0 112.785 -178.706 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.486 HD22 ' OD2' ' A' ' 8' ' ' ASP . 47.8 mt -102.03 22.84 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.605 1.962 . . . . 0.0 113.822 -174.29 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 55.16 28.46 11.07 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 174.393 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -99.44 167.49 10.59 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 113.594 -1.639 . . . . 0.0 110.159 -173.053 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.555 1.146 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.421 -168.394 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.386 0.4 OUTLIER . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 . . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.9 p -90.31 120.77 31.73 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.776 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.493 HD22 HG12 ' A' ' 20' ' ' VAL . 18.8 mt -35.64 -22.19 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.978 0 C-N-CA 129.444 3.098 . . . . 0.0 118.666 -174.529 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.447 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 56.8 m-85 -56.27 -36.17 68.27 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.026 0.53 . . . . 0.0 110.793 170.353 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.477 ' OD2' HD22 ' A' ' 45' ' ' LEU . 18.7 t70 -60.75 -49.88 75.7 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 117.946 -1.026 . . . . 0.0 113.194 173.619 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.6 t -56.96 -41.9 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.079 0.952 . . . . 0.0 113.335 172.168 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.02 -53.67 54.28 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 112.836 -1.984 . . . . 0.0 112.349 -179.244 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.447 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.62 -38.64 84.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.718 2.007 . . . . 0.0 114.031 178.164 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.428 ' CB ' HD11 ' A' ' 45' ' ' LEU . 56.2 t80 -66.14 -35.56 80.8 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.192 0.997 . . . . 0.0 110.763 176.58 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.47 -10.62 51.35 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.262 178.292 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.73 25.94 74.98 Favored Glycine 0 N--CA 1.479 1.514 0 C-N-CA 126.795 2.14 . . . . 0.0 112.204 174.109 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.6 p -119.56 132.02 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 123.785 0.834 . . . . 0.0 109.909 -168.683 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.7 p -38.7 124.64 1.37 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 128.933 2.893 . . . . 0.0 107.204 177.626 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.255 36.5 t80 -46.08 -37.45 6.83 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 116.661 2.097 . . . . 0.0 116.661 -171.517 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -52.3 -40.0 61.25 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -178.142 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.488 ' O ' HG23 ' A' ' 23' ' ' VAL . 73.2 p -53.44 -50.15 65.85 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.436 1.094 . . . . 0.0 112.802 175.537 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.663 ' O ' HG23 ' A' ' 24' ' ' VAL . 86.5 t -64.17 -55.44 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.657 -170.588 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.323 13.6 m -62.73 -33.3 74.85 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -43.44 98.81 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 117.225 2.306 . . . . 0.0 117.225 167.697 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.622 HG21 HG21 ' A' ' 38' ' ' VAL . 17.9 t -58.01 -49.01 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 127.157 2.183 . . . . 0.0 108.836 177.656 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 20' ' ' VAL . 69.8 t -56.65 -44.61 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 CA-C-N 110.849 -2.887 . . . . 0.0 111.528 -169.678 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -96.62 11.4 35.42 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 113.444 -1.707 . . . . 0.0 114.178 176.857 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.279 21.8 tt0 60.11 20.74 9.97 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.272 2.629 . . . . 0.0 115.859 177.244 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.8 37.91 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 110.456 -3.065 . . . . 0.0 117.815 -176.639 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.4 t 65.78 -54.3 0.37 Allowed 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.667 1.587 . . . . 0.0 112.233 -163.751 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.256 69.6 m80 -144.82 89.95 2.02 Favored 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.442 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.647 HG13 ' HD2' ' A' ' 35' ' ' ARG . 7.9 p -100.67 146.82 8.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 119.985 -1.697 . . . . 0.0 114.028 174.296 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.05 138.51 58.19 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 174.929 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.98 -55.69 29.91 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -172.778 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.625 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -49.01 -36.01 16.7 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 117.694 2.479 . . . . 0.0 117.694 178.525 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.5 m -60.76 -48.69 80.66 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.417 176.811 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.647 ' HD2' HG13 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -61.49 -39.82 92.35 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 177.797 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -34.41 69.62 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -178.254 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -77.78 -47.68 18.4 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 111.783 -2.462 . . . . 0.0 110.824 -179.941 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.622 HG21 HG21 ' A' ' 23' ' ' VAL . 39.7 t -63.26 -35.87 73.81 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.03 179.958 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 47.8 mt-10 -61.5 -45.58 93.61 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 130.495 3.518 . . . . 0.0 113.394 -176.643 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.21 82.85 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.007 174.988 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 38' ' ' VAL . . . -55.45 -44.72 76.65 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 112.009 -2.36 . . . . 0.0 113.156 175.959 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.9 mtt -59.36 -50.54 73.58 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.4 1.88 . . . . 0.0 114.892 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.62 89.07 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 112.892 -1.958 . . . . 0.0 112.584 179.866 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -66.54 -36.81 83.59 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 113.021 -1.9 . . . . 0.0 113.058 -179.931 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.477 HD22 ' OD2' ' A' ' 8' ' ' ASP . 38.6 mt -92.15 7.09 44.09 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 114.257 177.265 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.337 2.4 p-10 62.42 -49.68 0.17 Allowed 'General case' 0 C--N 1.346 0.428 0 C-N-CA 130.656 3.582 . . . . 0.0 117.374 -173.822 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . 0.268 7.4 t80 29.93 -91.23 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 110.565 -3.016 . . . . 0.0 116.597 -179.271 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.259 0.0 OUTLIER . . . . . 0 N--CA 1.509 2.517 0 C-N-CA 129.362 3.065 . . . . 0.0 111.779 -155.486 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.512 1.2 t . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 103.875 -2.639 . . . . 0.0 103.875 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 p -94.6 141.13 28.96 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-O 118.65 -0.69 . . . . 0.0 109.232 -173.685 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.454 HD21 ' CE2' ' A' ' 47' ' ' TYR . 10.8 mt -57.61 -13.48 3.96 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 120.499 3.518 . . . . 0.0 120.499 -158.023 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -57.85 -33.43 68.64 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 119.881 1.219 . . . . 0.0 111.622 175.561 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -65.9 -47.61 74.23 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.457 176.978 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.3 t -59.23 -43.84 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.577 0.751 . . . . 0.0 112.207 175.17 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.38 -50.55 73.25 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.07 1.348 . . . . 0.0 113.213 179.101 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -37.68 81.24 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 127.558 2.343 . . . . 0.0 114.196 177.424 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -63.94 -36.21 83.21 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.237 1.015 . . . . 0.0 109.767 175.751 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.12 -15.81 30.86 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.541 -179.142 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.23 19.05 78.85 Favored Glycine 0 N--CA 1.485 1.926 0 C-N-CA 127.451 2.453 . . . . 0.0 113.711 173.899 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -127.43 121.27 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 C-N-CA 124.08 0.952 . . . . 0.0 109.717 -166.536 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -17.06 138.22 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.846 0 C-N-CA 129.533 3.133 . . . . 0.0 112.02 -178.861 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -55.74 -27.8 52.56 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 118.527 -2.608 . . . . 0.0 115.177 170.423 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -54.29 -51.28 65.09 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 116.994 -1.479 . . . . 0.0 111.822 171.646 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.546 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.0 -50.45 73.36 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 179.275 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.613 ' O ' HG23 ' A' ' 24' ' ' VAL 0.293 71.8 t -63.19 -47.39 92.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.493 -173.58 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.6 p -59.2 -42.77 91.72 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -177.93 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 19' ' ' THR . 55.0 mtp85 -59.13 -50.77 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 110.007 -3.27 . . . . 0.0 115.004 168.647 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 19' ' ' THR . 88.6 t -59.28 -44.61 92.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 124.299 1.04 . . . . 0.0 109.281 -176.442 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 20' ' ' VAL . 47.2 t -54.13 -50.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.006 -165.271 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.399 58.2 m-20 -105.31 42.0 1.29 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 172.34 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.52 ' HA ' HH22 ' A' ' 35' ' ' ARG 0.424 17.7 tt0 73.01 -3.28 2.47 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 121.346 3.832 . . . . 0.0 121.346 165.702 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.31 30.72 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 112.077 -2.329 . . . . 0.0 115.372 -176.546 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.8 p 60.96 -53.41 0.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.36 1.864 . . . . 0.0 114.322 -158.648 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -150.99 141.8 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 117.631 -1.175 . . . . 0.0 108.73 -178.964 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.442 HG11 HG22 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -150.33 159.79 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 121.08 1.764 . . . . 0.0 113.713 164.346 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -51.32 139.29 19.46 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 175.569 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.86 -57.56 11.56 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.568 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -41.94 -41.19 2.4 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 177.684 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.6 m -58.5 -48.89 79.3 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 114.256 -1.338 . . . . 0.0 108.676 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.52 HH22 ' HA ' ' A' ' 26' ' ' GLN . 40.2 mtt-85 -60.47 -46.4 90.22 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 125.539 1.536 . . . . 0.0 113.964 -179.956 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -32.04 70.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -178.318 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ttpt -80.46 -41.62 24.08 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 111.338 -2.665 . . . . 0.0 112.516 -178.904 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.47 HG21 HG11 ' A' ' 23' ' ' VAL . 98.4 t -61.79 -51.32 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 126.326 1.85 . . . . 0.0 107.611 172.315 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.08 -41.06 91.63 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.54 1.936 . . . . 0.0 115.133 -175.955 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.3 -51.1 62.91 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 112.329 -2.214 . . . . 0.0 110.751 174.063 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.19 -41.53 84.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.297 -1.774 . . . . 0.0 113.559 176.554 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 mtt -62.58 -44.59 95.94 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -179.894 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.62 98.31 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.875 178.411 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -64.57 -37.86 89.03 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.006 -1.906 . . . . 0.0 112.925 179.855 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 40.8 mt -95.91 16.21 18.35 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.082 2.553 . . . . 0.0 115.135 178.612 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.328 0.1 OUTLIER 45.63 30.11 0.75 Allowed 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.588 2.811 . . . . 0.0 118.588 -178.199 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.454 ' CE2' HD21 ' A' ' 6' ' ' LEU . 84.1 t80 -93.7 88.26 5.76 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 112.25 -2.25 . . . . 0.0 111.422 -163.807 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.509 2.482 0 CA-C-N 111.378 -2.646 . . . . 0.0 113.278 153.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.3 tpt . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HE3' HD12 ' A' ' 6' ' ' LEU . 0.2 OUTLIER 159.49 162.71 0.03 OUTLIER Pre-proline 0 CA--C 1.566 1.575 0 C-N-CA 128.024 2.53 . . . . 0.0 113.21 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . 0.266 24.7 Cg_exo -53.98 -28.4 49.54 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 N-CA-C 120.25 3.135 . . . . 0.0 120.25 -176.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.423 0.8 OUTLIER -161.43 141.08 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 105.465 -2.05 . . . . 0.0 105.465 -179.371 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 1.1 p -60.0 97.02 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 127.053 2.141 . . . . 0.0 107.415 174.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.415 HD12 ' HE3' ' A' ' 2' ' ' LYS . 24.3 mt -39.95 -19.96 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 119.085 2.994 . . . . 0.0 119.085 -177.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -54.85 -35.22 63.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.228 0.611 . . . . 0.0 111.353 166.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -58.01 -48.87 78.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.071 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -58.25 -46.35 88.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 173.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.64 -50.73 69.42 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 112.629 -2.078 . . . . 0.0 111.917 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -43.39 75.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.83 2.452 . . . . 0.0 113.844 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -66.98 -33.7 76.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.266 1.026 . . . . 0.0 110.384 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.08 -9.26 57.03 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.081 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.54 24.45 76.2 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 126.821 2.153 . . . . 0.0 112.477 170.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.9 p -122.77 134.19 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 124.183 0.993 . . . . 0.0 110.665 -170.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.4 p -41.08 128.54 2.8 Favored 'General case' 0 N--CA 1.51 2.558 0 C-N-CA 127.648 2.379 . . . . 0.0 107.751 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -42.98 -31.31 0.5 Allowed 'General case' 0 N--CA 1.523 3.186 0 N-CA-C 116.658 2.096 . . . . 0.0 116.658 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -48.25 -45.16 34.06 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 125.175 1.547 . . . . 0.0 112.149 177.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 23' ' ' VAL . 6.7 p -59.88 -53.98 51.5 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 178.047 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' HG23 ' A' ' 24' ' ' VAL 0.329 79.3 t -59.86 -50.97 78.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.705 0.802 . . . . 0.0 111.25 -163.785 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.508 49.4 m -66.3 -29.01 69.14 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -44.4 92.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 112.429 -2.169 . . . . 0.0 115.736 164.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 38' ' ' VAL . 75.4 t -60.94 -43.9 96.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.564 1.545 . . . . 0.0 108.4 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 20' ' ' VAL . 84.1 t -53.8 -49.07 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.334 -172.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -90.94 14.81 12.78 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 171.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 63.3 14.7 8.05 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.196 2.599 . . . . 0.0 117.819 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 29.06 40.96 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 110.53 -3.032 . . . . 0.0 116.326 -172.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p 56.59 -52.96 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.62 1.968 . . . . 0.0 115.919 -165.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -137.27 117.03 13.08 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 170.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -133.73 154.39 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 120.18 1.355 . . . . 0.0 113.215 169.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 p -59.94 128.62 37.77 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.706 0.802 . . . . 0.0 112.757 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.79 -53.79 36.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -174.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.87 -36.95 8.08 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 42.1 m -60.63 -49.25 78.29 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.509 1.524 . . . . 0.0 108.142 175.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.3 mtp-105 -60.41 -43.49 96.67 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.214 1.806 . . . . 0.0 113.182 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -35.06 70.84 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -77.89 -46.23 21.92 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 112.071 -2.331 . . . . 0.0 111.604 -179.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.464 HG21 HG11 ' A' ' 23' ' ' VAL . 51.1 t -62.52 -47.29 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 C-N-CA 126.169 1.788 . . . . 0.0 108.039 177.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.24 -43.8 79.03 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 128.888 2.875 . . . . 0.0 111.57 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -52.63 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 112.235 -2.257 . . . . 0.0 110.673 176.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.58 -39.68 68.05 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 112.903 -1.953 . . . . 0.0 113.174 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.407 ' SD ' ' HA ' ' A' ' 49' ' ' PRO . 10.1 mtt -59.87 -52.81 63.85 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 117.428 2.381 . . . . 0.0 117.428 -173.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.04 96.52 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 112.412 -2.176 . . . . 0.0 112.866 178.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.92 -33.1 75.04 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 111.324 -2.671 . . . . 0.0 113.987 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 65.2 mt -98.78 21.11 11.9 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.996 1.718 . . . . 0.0 113.878 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.17 24.14 7.73 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.409 ' CZ ' ' HB2' ' A' ' 51' ' ' ARG . 40.7 t80 -99.74 157.26 16.61 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -172.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.556 HG22 HH11 ' A' ' 51' ' ' ARG 0.358 7.2 mm -127.34 119.64 21.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 N-CA-C 118.806 2.891 . . . . 0.0 118.806 -177.208 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.544 ' HD3' ' HA ' ' A' ' 48' ' ' ILE 0.367 0.1 OUTLIER -14.54 -62.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.881 2 C-N-CA 126.819 5.013 . . . . 0.0 123.011 -162.334 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -112.84 45.13 1.38 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 117.887 2.551 . . . . 0.0 117.887 -172.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.556 HH11 HG22 ' A' ' 48' ' ' ILE . 3.4 mmp_? -88.78 79.01 7.53 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.925 -172.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 1.9 m -74.65 166.57 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 114.196 -1.365 . . . . 0.0 111.571 167.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.52 73.28 1.93 Allowed 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 123.159 1.457 . . . . 0.0 113.126 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -144.58 92.94 2.35 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 112.58 -2.1 . . . . 0.0 111.199 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.75 -50.42 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 109.566 -3.47 . . . . 0.0 109.994 174.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.6 mt . . . . . 0 N--CA 1.492 1.661 0 CA-C-N 114.275 -1.329 . . . . 0.0 113.827 175.881 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.654 ' HG3' ' HA ' ' A' ' 5' ' ' THR . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.839 0 N-CA-C 117.206 2.298 . . . . 0.0 117.206 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.629 ' HD2' HE21 ' A' ' 55' ' ' GLN 0.331 22.7 tptm -111.52 -60.24 0.04 OUTLIER Pre-proline 0 N--CA 1.486 1.33 0 CA-C-O 115.984 -1.96 . . . . 0.0 113.838 -177.657 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -74.76 -29.95 8.13 Favored 'Trans proline' 0 N--CA 1.488 1.162 0 CA-C-N 121.986 1.745 . . . . 0.0 115.736 -177.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.443 0.5 OUTLIER -159.33 153.23 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 O-C-N 124.758 1.286 . . . . 0.0 107.699 -170.139 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.654 ' HA ' ' HG3' ' A' ' 1' ' ' MET . 2.6 p -78.56 114.75 17.75 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 102.706 -3.072 . . . . 0.0 102.706 -174.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.525 HD21 ' CZ ' ' A' ' 47' ' ' TYR . 24.3 mt -48.69 -19.91 0.41 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 70.5 m-85 -54.74 -35.52 63.81 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.382 0.673 . . . . 0.0 111.318 167.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.45 ' OD2' HD22 ' A' ' 45' ' ' LEU . 36.6 t0 -60.76 -47.69 85.19 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.992 172.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HA ' HD13 ' A' ' 45' ' ' LEU . 93.7 t -59.26 -43.06 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.83 -52.84 61.59 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 111.582 -2.553 . . . . 0.0 111.877 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.481 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.4 OUTLIER -65.39 -39.47 92.26 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.387 1.875 . . . . 0.0 113.868 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.427 ' CB ' HD11 ' A' ' 45' ' ' LEU . 33.9 t80 -66.97 -34.32 77.5 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.156 0.91 . . . . 0.0 110.829 177.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.45 -13.46 34.77 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 125.018 1.327 . . . . 0.0 112.099 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.39 26.3 72.27 Favored Glycine 0 CA--C 1.546 2.002 0 C-N-CA 126.674 2.083 . . . . 0.0 112.985 173.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -125.96 136.14 61.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 121.448 0.642 . . . . 0.0 109.865 -171.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.8 p -36.65 128.65 0.82 Allowed 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 128.694 2.798 . . . . 0.0 108.131 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -49.23 -36.55 20.48 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.605 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.522 0.0 OUTLIER -59.48 -27.19 65.9 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 121.734 3.975 . . . . 0.0 121.734 172.695 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 44.3 p -62.58 -52.82 61.88 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.457 1.098 . . . . 0.0 111.796 163.433 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.648 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.4 t -59.28 -50.29 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.969 1.308 . . . . 0.0 108.532 -173.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.7 p -55.69 -42.47 75.25 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.683 1.193 . . . . 0.0 113.901 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.605 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 40.8 mtt85 -62.06 -47.41 84.8 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 111.817 -2.447 . . . . 0.0 116.328 170.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.498 HG11 HG21 ' A' ' 38' ' ' VAL . 49.1 t -58.28 -41.38 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 C-N-CA 127.048 2.139 . . . . 0.0 107.556 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 20' ' ' VAL . 57.5 t -56.8 -42.55 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.286 -170.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.284 85.6 m-20 -101.31 22.99 11.61 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 168.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.389 9.3 pt20 58.47 -0.36 0.12 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 130.988 3.715 . . . . 0.0 119.404 -177.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.09 33.08 0.14 Allowed 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 112.14 -2.3 . . . . 0.0 114.716 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p 59.96 -54.04 0.07 Allowed 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 126.999 2.12 . . . . 0.0 114.432 -159.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -144.41 116.37 8.32 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-N 113.606 -1.634 . . . . 0.0 111.985 -172.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.2 t -146.43 156.49 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 120.254 1.388 . . . . 0.0 113.083 168.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -45.57 133.82 7.55 Favored 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.89 -53.44 52.61 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -49.11 -35.59 16.73 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 117.827 2.529 . . . . 0.0 117.827 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 56.7 m -60.05 -50.24 74.5 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -58.48 -42.5 87.69 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.81 -39.78 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -74.34 -43.79 55.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.531 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.498 HG21 HG11 ' A' ' 23' ' ' VAL . 45.7 t -63.08 -49.1 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 125.83 1.652 . . . . 0.0 108.052 177.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.87 -41.38 82.35 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.251 2.62 . . . . 0.0 114.886 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -49.31 75.1 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 111.311 -2.677 . . . . 0.0 110.325 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.61 -39.86 85.65 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 112.638 -2.074 . . . . 0.0 113.308 175.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.421 ' SD ' ' HG3' ' A' ' 49' ' ' PRO . 25.7 mtt -58.89 -51.59 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -174.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.68 97.68 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 112.248 -2.251 . . . . 0.0 111.88 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -62.85 -42.51 99.77 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 111.534 -2.575 . . . . 0.0 112.249 -178.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 9' ' ' VAL . 51.8 mt -93.09 23.21 4.44 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.355 1.862 . . . . 0.0 114.02 -177.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 50.4 34.15 8.73 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.955 2.206 . . . . 0.0 116.955 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.525 ' CZ ' HD21 ' A' ' 6' ' ' LEU . 32.0 t80 -96.17 160.69 14.31 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 113.986 -1.461 . . . . 0.0 112.754 -173.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.445 HG23 HD21 ' A' ' 50' ' ' ASN . 0.0 OUTLIER -136.38 115.43 10.77 Favored Pre-proline 0 CA--C 1.548 0.898 0 CA-C-N 112.556 -2.111 . . . . 0.0 109.048 -176.297 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.421 ' HG3' ' SD ' ' A' ' 42' ' ' MET . 22.9 Cg_exo -44.77 87.64 0.02 OUTLIER 'Trans proline' 0 CA--C 1.559 1.745 1 C-N-CA 126.427 4.751 . . . . 0.0 110.746 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.445 HD21 HG23 ' A' ' 48' ' ' ILE 0.28 0.0 OUTLIER -163.97 -61.88 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.261 1 N-CA-C 123.144 4.498 . . . . 0.0 123.144 -173.092 . . . . . . . . 5 4 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.632 ' NH2' ' H ' ' A' ' 53' ' ' ALA 0.293 0.0 OUTLIER 54.57 104.41 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 117.2 2.296 . . . . 0.0 117.2 -172.718 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -136.03 90.59 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 O-C-N 119.886 -1.759 . . . . 0.0 109.307 165.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.632 ' H ' ' NH2' ' A' ' 51' ' ' ARG . . . -73.49 80.69 1.45 Allowed 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 123.538 1.637 . . . . 0.0 110.878 174.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.09 49.75 1.23 Allowed 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 124.411 2.053 . . . . 0.0 112.718 -174.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.629 HE21 ' HD2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -163.02 -50.08 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 110.481 -3.054 . . . . 0.0 110.414 -177.206 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.8 mp . . . . . 0 N--CA 1.481 1.085 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 163.27 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.4 tpp . . . . . 0 CA--C 1.555 1.14 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.434 ' NZ ' HD12 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -132.18 151.93 79.25 Favored Pre-proline 0 CA--C 1.562 1.418 0 CA-C-O 115.57 -2.157 . . . . 0.0 107.367 174.358 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -62.74 -12.7 30.05 Favored 'Trans proline' 0 N--CA 1.487 1.128 0 CA-C-N 124.457 2.627 . . . . 0.0 118.596 -174.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER -154.81 150.33 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 N-CA-C 103.448 -2.797 . . . . 0.0 103.448 174.856 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.257 80.3 m -61.86 110.46 1.55 Allowed 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 105.202 -2.148 . . . . 0.0 105.202 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.434 HD12 ' NZ ' ' A' ' 2' ' ' LYS . 40.4 mt -51.85 -17.46 0.97 Allowed 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.586 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.373 23.1 m-85 -57.78 -29.38 64.8 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 120.28 1.4 . . . . 0.0 112.687 165.652 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -63.43 -50.96 67.72 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.399 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -56.89 -43.04 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 CA-C-O 121.302 0.572 . . . . 0.0 112.418 175.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.437 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -61.12 -50.77 71.86 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 112.436 -2.165 . . . . 0.0 111.847 -176.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.586 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -68.78 -40.65 79.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.624 1.97 . . . . 0.0 115.182 175.781 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -62.79 -33.93 76.21 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.048 1.339 . . . . 0.0 110.079 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.68 -22.64 17.43 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 113.891 -1.504 . . . . 0.0 111.663 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.53 25.35 56.91 Favored Glycine 0 CA--C 1.554 2.524 0 C-N-CA 125.699 1.619 . . . . 0.0 113.18 173.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.538 HG22 HG21 ' A' ' 19' ' ' THR . 6.9 p -126.25 94.5 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.222 0 C-N-CA 122.992 0.517 . . . . 0.0 110.066 -167.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.6 p -7.62 127.11 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.734 0 C-N-CA 127.334 2.254 . . . . 0.0 113.672 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -50.17 -38.89 41.88 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 117.924 2.565 . . . . 0.0 117.924 -171.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -51.2 -40.11 57.98 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 118.906 0.775 . . . . 0.0 112.472 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.538 HG21 HG22 ' A' ' 15' ' ' VAL . 20.4 m -55.39 -53.26 58.48 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.835 2.054 . . . . 0.0 112.169 171.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.675 ' O ' HG23 ' A' ' 24' ' ' VAL . 73.6 t -63.73 -53.42 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-O 118.675 -0.679 . . . . 0.0 109.698 -173.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.413 3.2 m -60.22 -34.09 73.17 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 117.198 2.295 . . . . 0.0 117.198 -177.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 mtp85 -59.06 -49.54 77.51 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.249 -1.796 . . . . 0.0 115.36 166.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.827 HG11 HG21 ' A' ' 38' ' ' VAL . 29.5 t -57.82 -47.24 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 126.533 1.933 . . . . 0.0 108.749 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 20' ' ' VAL . 39.3 t -57.35 -42.07 79.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 O-C-N 126.594 2.434 . . . . 0.0 112.299 -166.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.47 ' OD1' HG23 ' A' ' 52' ' ' VAL . 5.9 m-20 -94.54 15.01 19.04 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 125.209 1.568 . . . . 0.0 112.773 175.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 69.03 9.63 7.51 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.15 2.18 . . . . 0.0 116.571 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.66 38.63 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.789 -2.46 . . . . 0.0 117.197 -173.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.4 p 58.88 -50.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 126.343 1.857 . . . . 0.0 115.758 -164.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -146.86 93.8 2.33 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.44 HG11 ' HD3' ' A' ' 35' ' ' ARG . 11.1 p -116.63 155.34 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.58 124.87 21.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.82 -63.56 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.695 ' HE3' ' H ' ' A' ' 33' ' ' LYS 0.362 0.1 OUTLIER -42.6 -35.63 1.15 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 119.652 3.204 . . . . 0.0 119.652 173.078 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 m -65.46 -50.55 64.95 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 112.879 -1.964 . . . . 0.0 108.178 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.674 ' HD2' HG13 ' A' ' 23' ' ' VAL . 6.5 mmm180 -57.16 -45.79 83.32 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 178.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.59 -36.43 73.99 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.5 ttmt -76.06 -44.32 39.6 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 112.266 -2.243 . . . . 0.0 111.186 -177.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.827 HG21 HG11 ' A' ' 23' ' ' VAL . 55.1 t -63.91 -47.94 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 126.463 1.905 . . . . 0.0 108.18 177.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 46.2 mt-10 -54.55 -44.84 73.21 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.452 2.701 . . . . 0.0 111.405 -178.074 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.89 69.53 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.142 -2.299 . . . . 0.0 111.0 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.52 -41.37 89.83 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 113.206 -1.816 . . . . 0.0 114.019 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.549 ' SD ' ' HG3' ' A' ' 49' ' ' PRO . 26.5 mtt -62.07 -44.83 95.82 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 119.949 -1.719 . . . . 0.0 112.962 -174.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.52 93.49 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 126.271 2.232 . . . . 0.0 111.496 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -65.91 -34.18 77.53 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.914 -2.403 . . . . 0.0 113.351 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.5 mt -97.24 13.92 27.8 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.294 2.237 . . . . 0.0 114.486 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.37 33.75 21.48 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 117.573 2.435 . . . . 0.0 117.573 175.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -92.1 152.68 19.81 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.925 -171.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.294 0.0 OUTLIER -126.65 109.65 22.85 Favored Pre-proline 0 N--CA 1.474 0.74 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.694 -179.217 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.549 ' HG3' ' SD ' ' A' ' 42' ' ' MET . 71.7 Cg_exo -50.61 85.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.982 3.788 . . . . 0.0 116.103 -169.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.44 ' HB3' ' H ' ' A' ' 51' ' ' ARG . 0.2 OUTLIER -179.92 -110.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.944 2.498 . . . . 0.0 110.697 158.297 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.44 ' H ' ' HB3' ' A' ' 50' ' ' ASN 0.493 52.2 mtp85 39.24 -10.26 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 121.51 3.893 . . . . 0.0 121.51 -171.097 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.47 HG23 ' OD1' ' A' ' 25' ' ' ASN . 2.7 m -77.36 8.84 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 CA-C-N 113.714 -1.584 . . . . 0.0 115.123 145.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -118.77 87.97 2.84 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 140.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -48.86 114.16 0.93 Allowed 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 111.438 -2.619 . . . . 0.0 116.467 -171.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 56.18 42.67 27.86 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 112.918 -1.946 . . . . 0.0 113.954 175.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.492 ' H ' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 117.188 2.292 . . . . 0.0 117.188 -176.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.574 ' HA ' HG23 ' A' ' 52' ' ' VAL . 23.1 mmt . . . . . 0 N--CA 1.48 1.042 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HE3' ' H ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -164.33 168.57 9.04 Favored Pre-proline 0 CA--C 1.567 1.612 0 CA-C-O 116.205 -1.855 . . . . 0.0 110.907 169.642 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -105.05 -11.81 0.09 OUTLIER 'Trans proline' 0 CA--C 1.543 0.957 0 N-CA-C 117.035 1.898 . . . . 0.0 117.035 175.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.53 1.1 t -164.79 153.0 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 -164.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 40.0 p -95.32 145.33 25.18 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.262 0.937 . . . . 0.0 109.556 -175.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.851 ' HG ' HE22 ' A' ' 54' ' ' GLN . 4.6 mt -59.94 -14.9 17.94 Favored 'General case' 0 N--CA 1.506 2.343 0 N-CA-C 117.095 2.258 . . . . 0.0 117.095 -163.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.491 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 47.2 m-85 -55.87 -38.42 70.1 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.468 1.485 . . . . 0.0 111.448 174.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -64.73 -44.51 89.94 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.767 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.423 ' HA ' HD13 ' A' ' 45' ' ' LEU . 81.1 t -59.64 -43.61 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-N 118.747 0.703 . . . . 0.0 112.886 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.9 69.94 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 113.173 -1.83 . . . . 0.0 113.394 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.491 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.5 OUTLIER -66.75 -39.55 87.94 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.473 1.909 . . . . 0.0 114.274 174.585 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -63.43 -33.7 76.13 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.414 1.086 . . . . 0.0 110.31 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.28 -19.58 19.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.106 1.362 . . . . 0.0 112.216 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.83 25.1 56.92 Favored Glycine 0 CA--C 1.549 2.216 0 C-N-CA 126.613 2.054 . . . . 0.0 113.399 174.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.471 HG22 HG21 ' A' ' 19' ' ' THR 0.268 3.9 p -129.83 119.16 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.33 0 C-N-CA 124.914 1.285 . . . . 0.0 108.24 -166.482 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.7 p -27.47 143.55 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.344 0 C-N-CA 128.647 2.779 . . . . 0.0 111.849 -174.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' A' ' 6' ' ' LEU . 64.2 t80 -57.62 -34.33 69.19 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 119.238 -2.164 . . . . 0.0 114.665 175.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.266 14.8 tp60 -56.41 -45.95 80.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 117.434 -1.27 . . . . 0.0 112.596 173.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' HG23 ' A' ' 23' ' ' VAL . 86.4 m -53.31 -54.17 40.35 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.885 1.274 . . . . 0.0 111.388 175.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' HG23 ' A' ' 24' ' ' VAL . 70.6 t -64.18 -49.26 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.837 -176.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.281 69.6 p -57.42 -39.38 76.07 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 119.196 3.036 . . . . 0.0 119.196 -174.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 19' ' ' THR . 36.6 mtp85 -61.58 -51.18 69.6 Favored 'General case' 0 C--N 1.319 -0.72 1 CA-C-N 106.857 -4.701 . . . . 0.0 114.198 167.123 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 19' ' ' THR . 95.1 t -58.58 -43.01 86.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.861 1.265 . . . . 0.0 109.764 -176.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 20' ' ' VAL . 75.9 t -49.14 -53.22 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 112.705 -2.043 . . . . 0.0 111.816 -171.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.331 93.8 m-20 -107.37 37.43 2.4 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 113.67 -1.605 . . . . 0.0 114.589 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.253 1.2 tp-100 73.92 -5.46 2.03 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 129.289 3.036 . . . . 0.0 117.873 166.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 36.69 36.32 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 113.302 -1.772 . . . . 0.0 115.256 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.0 p 55.31 -48.37 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -151.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.262 71.7 m80 -157.57 130.91 7.77 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -170.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -145.5 150.68 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 116.967 2.21 . . . . 0.0 116.967 162.331 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.3 p -51.47 139.47 19.88 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -57.48 9.34 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -173.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.523 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -40.2 -43.22 1.63 Allowed 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 176.436 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.8 m -57.79 -48.79 78.69 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 126.528 1.931 . . . . 0.0 108.577 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 43.7 mtt-85 -65.33 -44.8 86.63 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 117.475 2.398 . . . . 0.0 117.475 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.21 -29.94 64.15 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -80.31 -42.28 23.31 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 111.381 -2.645 . . . . 0.0 112.048 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.54 -49.7 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 125.686 1.595 . . . . 0.0 109.204 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -55.63 -46.84 77.34 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.605 3.162 . . . . 0.0 111.757 -176.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -51.17 64.02 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.339 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.97 -42.05 84.23 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 112.974 -1.921 . . . . 0.0 114.598 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -56.09 -45.2 79.49 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 178.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.09 -43.74 91.1 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.646 -2.07 . . . . 0.0 113.071 177.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -66.1 -38.46 88.27 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 112.759 -2.019 . . . . 0.0 113.014 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 9' ' ' VAL . 30.3 mt -85.3 13.66 6.25 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 127.089 2.156 . . . . 0.0 113.842 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.401 0.2 OUTLIER 44.99 31.5 0.71 Allowed 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 115.98 1.844 . . . . 0.0 115.98 -176.579 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -98.59 101.14 12.47 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.058 -160.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -28.1 117.82 0.26 Allowed Pre-proline 0 N--CA 1.502 2.173 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 167.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -65.86 64.99 0.43 Allowed 'Trans proline' 0 CA--C 1.549 1.235 0 C-N-CA 122.75 2.3 . . . . 0.0 116.529 170.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -167.83 164.04 14.09 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 112.087 -2.324 . . . . 0.0 109.134 161.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HG3' HD11 ' A' ' 6' ' ' LEU . 0.9 OUTLIER -124.1 74.23 1.28 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 168.626 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.574 HG23 ' HA ' ' A' ' 1' ' ' MET . 0.6 OUTLIER -90.88 103.13 14.12 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.331 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 -176.494 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 53.67 82.83 0.08 Allowed 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 122.787 1.28 . . . . 0.0 111.927 -177.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.851 HE22 ' HG ' ' A' ' 6' ' ' LEU . 10.3 tt0 -81.69 117.23 21.86 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 113.932 -1.486 . . . . 0.0 108.632 174.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.538 ' H ' ' HE3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -89.48 75.3 7.61 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 111.477 -2.601 . . . . 0.0 112.046 -178.036 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 N--CA 1.489 1.496 0 CA-C-N 109.66 -3.427 . . . . 0.0 115.507 -174.69 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -129.9 157.7 76.03 Favored Pre-proline 0 CA--C 1.551 0.985 0 N-CA-C 117.956 2.576 . . . . 0.0 117.956 -175.028 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HA ' ' OE1' ' A' ' 55' ' ' GLN . 42.3 Cg_exo -67.7 -36.84 17.79 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 CA-C-N 121.038 1.406 . . . . 0.0 115.467 167.15 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.434 0.5 OUTLIER -155.74 153.26 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.685 -170.726 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -77.56 107.0 9.71 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 101.388 -3.56 . . . . 0.0 101.388 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.412 HD11 ' OH ' ' A' ' 47' ' ' TYR . 76.8 mt -51.14 -10.24 0.07 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 120.161 3.393 . . . . 0.0 120.161 -175.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -53.75 -31.9 50.23 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.644 0.656 . . . . 0.0 112.221 162.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.76 -52.74 62.99 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 176.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.15 -43.23 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 172.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.05 -51.09 71.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 113.119 -1.855 . . . . 0.0 111.876 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -39.5 91.24 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.219 2.207 . . . . 0.0 114.146 174.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -65.79 -34.05 77.28 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.141 0.977 . . . . 0.0 110.909 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.39 -13.63 37.31 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.829 1.251 . . . . 0.0 111.332 177.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.9 23.12 64.67 Favored Glycine 0 N--CA 1.491 2.32 0 C-N-CA 127.199 2.333 . . . . 0.0 113.387 172.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.49 124.28 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.514 1.126 . . . . 0.0 111.331 -168.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -32.2 129.63 0.18 Allowed 'General case' 0 N--CA 1.526 3.336 0 C-N-CA 125.347 1.459 . . . . 0.0 109.631 175.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -45.26 -34.57 2.93 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 118.318 2.711 . . . . 0.0 118.318 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -50.58 -30.2 12.66 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.436 ' O ' HG23 ' A' ' 23' ' ' VAL . 13.9 p -66.77 -56.67 9.43 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 168.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.661 ' O ' HG23 ' A' ' 24' ' ' VAL . 78.5 t -57.47 -53.48 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 C-N-CA 123.901 0.88 . . . . 0.0 110.237 -164.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 2.0 m -60.93 -35.04 75.68 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -64.51 -47.33 79.3 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 19' ' ' THR . 93.0 t -59.56 -40.9 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.207 1.403 . . . . 0.0 108.851 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 20' ' ' VAL . 91.9 t -51.14 -46.18 31.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 O-C-N 125.461 1.726 . . . . 0.0 111.492 -171.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.303 20.3 m120 -107.42 32.4 4.69 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 173.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 64.52 0.34 1.08 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 130.089 3.355 . . . . 0.0 118.95 175.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.59 35.25 0.18 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 113.064 -1.88 . . . . 0.0 114.698 -173.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.9 p 62.52 -44.95 0.18 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -158.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.298 69.1 m80 -165.51 116.75 1.09 Allowed 'General case' 0 CA--C 1.561 1.395 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 -168.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.561 HG12 ' NH1' ' A' ' 35' ' ' ARG . 1.0 OUTLIER -136.4 162.67 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 159.584 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 p -45.94 135.61 7.13 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.67 -61.1 2.3 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -171.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.3 pptp? -39.69 -37.47 0.52 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 117.82 2.526 . . . . 0.0 117.82 176.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -61.41 -50.03 74.5 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.447 1.499 . . . . 0.0 108.866 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.561 ' NH1' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.82 -43.84 97.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 178.486 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.99 -35.46 76.88 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -80.18 -46.04 17.04 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 112.657 -2.065 . . . . 0.0 112.243 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 HG21 ' A' ' 23' ' ' VAL . 79.7 t -59.91 -49.93 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.527 1.131 . . . . 0.0 108.953 173.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -56.35 -41.54 76.27 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.816 2.046 . . . . 0.0 114.91 -178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.93 -53.28 52.72 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 111.679 -2.51 . . . . 0.0 110.469 175.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.55 -40.45 78.9 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 113.298 -1.773 . . . . 0.0 113.476 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.0 mtt -59.44 -48.55 81.2 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -176.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.88 -41.05 95.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 112.175 -2.284 . . . . 0.0 112.996 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -65.6 -37.18 85.89 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.292 -1.776 . . . . 0.0 113.286 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.9 mt -90.81 14.33 13.89 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.538 2.335 . . . . 0.0 112.878 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.275 3.7 p-10 53.92 19.05 1.82 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 120.029 3.344 . . . . 0.0 120.029 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.412 ' OH ' HD11 ' A' ' 6' ' ' LEU . 42.4 t80 -87.45 91.82 8.87 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 112.243 -2.253 . . . . 0.0 110.887 -169.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -22.2 118.85 0.15 Allowed Pre-proline 0 N--CA 1.51 2.557 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.236 153.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -52.96 36.48 0.02 OUTLIER 'Trans proline' 0 CA--C 1.54 0.789 1 N-CA-C 123.582 4.416 . . . . 0.0 123.582 173.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -178.53 123.75 0.1 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.124 1.37 . . . . 0.0 110.804 169.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.27 0.0 OUTLIER -76.25 35.85 0.14 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 120.386 3.476 . . . . 0.0 120.386 -176.141 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 13.8 m -116.58 53.81 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 CA-C-N 113.702 -1.59 . . . . 0.0 111.412 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -137.43 -11.85 1.61 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -171.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 44.42 -91.4 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 CA-C-O 117.1 -1.428 . . . . 0.0 113.537 -163.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.441 ' OE1' ' HA ' ' A' ' 3' ' ' PRO 0.624 1.8 mp0 -108.47 69.72 0.73 Allowed 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 116.653 2.094 . . . . 0.0 116.653 -172.95 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 N--CA 1.491 1.622 1 CA-C-N 101.822 -6.99 . . . . 0.0 117.098 -177.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.412 ' HA ' ' NH2' ' A' ' 51' ' ' ARG 0.284 0.0 OUTLIER -147.64 155.31 45.15 Favored Pre-proline 0 CA--C 1.55 0.963 0 N-CA-C 117.36 2.356 . . . . 0.0 117.36 -178.7 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.494 ' HD2' HH12 ' A' ' 51' ' ' ARG . 48.0 Cg_exo -68.87 -50.7 0.54 Allowed 'Trans proline' 0 N--CA 1.486 1.033 0 CA-C-N 121.469 1.56 . . . . 0.0 111.744 161.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.378 1.2 t -156.51 146.99 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 CA-C-O 122.134 0.969 . . . . 0.0 108.606 -177.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.417 1.2 m -51.85 109.17 0.34 Allowed 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 131.014 3.725 . . . . 0.0 107.701 175.196 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -48.71 -24.46 1.39 Allowed 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 117.726 2.491 . . . . 0.0 117.726 171.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.262 54.0 m-85 -61.62 -31.57 71.66 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 168.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.66 -46.56 87.64 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 118.154 -0.927 . . . . 0.0 110.464 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.402 ' HA ' HD13 ' A' ' 45' ' ' LEU . 60.9 t -56.94 -42.74 79.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 174.351 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.59 -54.9 39.85 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.809 1.644 . . . . 0.0 112.709 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -36.61 84.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.157 1.783 . . . . 0.0 113.387 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -64.93 -37.38 87.45 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.873 0.844 . . . . 0.0 109.859 177.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.66 -10.86 50.09 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.604 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.54 24.19 73.39 Favored Glycine 0 N--CA 1.487 2.061 0 C-N-CA 127.528 2.49 . . . . 0.0 113.431 172.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -125.98 122.49 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.026 0.93 . . . . 0.0 111.879 -167.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.7 p -29.41 121.42 0.15 Allowed 'General case' 0 N--CA 1.524 3.249 0 C-N-CA 127.929 2.491 . . . . 0.0 107.95 171.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -49.85 -27.47 5.14 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -46.1 -40.51 11.0 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.94 1.4 . . . . 0.0 112.133 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 23' ' ' VAL . 10.4 p -61.07 -55.24 34.92 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 173.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' HG23 ' A' ' 24' ' ' VAL 0.255 74.2 t -59.96 -46.65 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.617 1.167 . . . . 0.0 109.648 -169.683 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.9 p -59.77 -45.87 90.93 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.5 mtp85 -57.5 -46.47 83.73 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.595 -2.093 . . . . 0.0 114.843 170.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.591 HG21 HG21 ' A' ' 38' ' ' VAL . 79.0 t -60.18 -44.94 96.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.724 1.209 . . . . 0.0 109.089 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 20' ' ' VAL . 82.2 t -52.92 -46.17 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 O-C-N 126.213 2.196 . . . . 0.0 111.269 -169.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.251 16.6 m120 -106.57 27.68 8.58 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 65.7 9.08 5.66 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 118.518 2.785 . . . . 0.0 118.518 171.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 34.25 33.68 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 128.266 2.626 . . . . 0.0 116.423 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 58.84 -42.75 0.07 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 -160.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -149.0 92.78 2.01 Favored 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.7 p -110.18 151.92 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 N-CA-C 117.223 2.305 . . . . 0.0 117.223 171.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -65.07 136.41 56.71 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 176.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.64 -43.38 96.96 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -175.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.792 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -49.85 -45.14 50.12 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 173.746 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.9 m -64.34 -47.47 79.25 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 112.658 -2.064 . . . . 0.0 108.386 177.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -56.45 -42.46 78.2 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.126 1.37 . . . . 0.0 114.631 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -60.96 -39.83 91.01 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 113.394 -1.73 . . . . 0.0 113.733 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -72.99 -43.59 62.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.661 1.985 . . . . 0.0 111.031 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.591 HG21 HG21 ' A' ' 23' ' ' VAL . 60.8 t -66.08 -48.98 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.087 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.7 mt-10 -52.49 -45.07 66.03 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 130.913 3.685 . . . . 0.0 110.354 -178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.71 -51.14 66.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.172 176.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -46.15 87.16 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.339 -1.755 . . . . 0.0 113.306 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.41 -45.38 80.69 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.679 1.592 . . . . 0.0 112.972 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.57 -46.45 88.3 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 112.903 -1.953 . . . . 0.0 112.34 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -64.43 -38.49 91.2 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.034 -2.348 . . . . 0.0 112.837 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 9' ' ' VAL . 11.4 mt -87.32 11.92 13.2 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.939 2.496 . . . . 0.0 114.185 -178.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.41 0.2 OUTLIER 52.47 23.58 2.6 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.196 2.598 . . . . 0.0 113.388 -176.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -96.56 87.63 4.44 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.386 -1.446 . . . . 0.0 110.52 -159.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -10.08 110.89 0.04 OUTLIER Pre-proline 0 N--CA 1.519 2.987 0 CA-C-N 113.178 -1.828 . . . . 0.0 113.509 153.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -63.48 50.71 0.14 Allowed 'Trans proline' 0 CA--C 1.542 0.878 0 N-CA-C 119.764 2.948 . . . . 0.0 119.764 175.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -179.75 148.02 0.31 Allowed 'General case' 0 CA--C 1.564 1.491 0 C-N-CA 127.368 2.267 . . . . 0.0 111.321 163.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.494 HH12 ' HD2' ' A' ' 3' ' ' PRO 0.261 0.0 OUTLIER -68.77 95.66 0.69 Allowed 'General case' 0 N--CA 1.487 1.375 0 CA-C-N 119.588 1.085 . . . . 0.0 113.795 175.201 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.6 m -83.98 54.96 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 CA-C-O 122.547 1.165 . . . . 0.0 111.235 -177.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.15 148.31 51.99 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 114.064 -1.425 . . . . 0.0 110.55 176.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 51.99 76.8 0.16 Allowed 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 123.343 1.544 . . . . 0.0 113.185 -175.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.465 ' H ' ' CD ' ' A' ' 55' ' ' GLN . 0.5 OUTLIER -81.24 31.03 0.33 Allowed 'General case' 0 N--CA 1.49 1.563 0 CA-C-N 109.413 -3.54 . . . . 0.0 113.567 178.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.5 mt . . . . . 0 N--CA 1.481 1.121 0 CA-C-N 113.14 -1.845 . . . . 0.0 113.939 -175.295 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 116.629 2.085 . . . . 0.0 116.629 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.447 ' HD3' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -161.29 146.07 10.35 Favored Pre-proline 0 CA--C 1.581 2.151 0 CA-C-O 115.745 -2.074 . . . . 0.0 114.171 -163.923 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -70.49 -2.2 10.32 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 N-CA-C 121.239 3.515 . . . . 0.0 121.239 -171.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.447 ' O ' ' HD3' ' A' ' 2' ' ' LYS 0.414 0.5 OUTLIER -156.11 147.33 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 179.527 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.308 4.2 p -70.39 97.6 1.29 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -177.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.4 mt -41.49 -14.27 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 -175.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.463 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 49.3 m-85 -53.74 -33.3 55.28 Favored 'General case' 0 CA--C 1.561 1.368 0 O-C-N 123.514 0.508 . . . . 0.0 110.913 165.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -59.07 -52.4 65.89 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 118.474 -0.774 . . . . 0.0 113.024 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 66.5 t -57.99 -45.04 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.506 0.722 . . . . 0.0 112.855 174.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.93 -49.18 78.81 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 113.444 -1.707 . . . . 0.0 112.016 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.463 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.4 OUTLIER -67.82 -43.61 79.2 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.139 1.776 . . . . 0.0 115.198 176.864 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -32.38 74.03 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.792 0.837 . . . . 0.0 111.311 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.7 -17.39 26.84 Favored 'General case' 0 CA--C 1.562 1.408 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.062 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.03 23.42 69.03 Favored Glycine 0 N--CA 1.49 2.264 0 C-N-CA 125.721 1.629 . . . . 0.0 113.524 173.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.449 HG22 HG21 ' A' ' 19' ' ' THR 0.253 4.5 p -123.28 126.07 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.426 0 C-N-CA 124.627 1.171 . . . . 0.0 107.929 -170.119 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' HB ' ' A' ' 19' ' ' THR . 83.2 p -33.24 139.48 0.05 Allowed 'General case' 0 N--CA 1.528 3.432 0 C-N-CA 126.21 1.804 . . . . 0.0 111.269 -177.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.365 55.2 t80 -40.45 -65.87 0.37 Allowed 'General case' 0 N--CA 1.519 3.019 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.48 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.401 0.8 OUTLIER -58.0 -23.47 54.18 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 121.785 3.994 . . . . 0.0 121.785 -177.39 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.516 ' O ' HG23 ' A' ' 23' ' ' VAL . 83.4 m -53.64 -48.43 69.38 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.595 163.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.584 ' O ' HG23 ' A' ' 24' ' ' VAL . 98.9 t -65.57 -51.31 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.199 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.253 1.3 m -57.26 -36.03 70.47 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -178.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.54 ' HG3' HH11 ' A' ' 22' ' ' ARG . 10.8 mtt85 -59.21 -49.24 78.6 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 166.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 38' ' ' VAL . 77.3 t -59.41 -41.0 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.454 -176.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 20' ' ' VAL . 92.1 t -54.68 -50.23 61.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.319 0 CA-C-N 112.974 -1.921 . . . . 0.0 112.409 -167.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.398 55.9 m-20 -100.6 29.74 4.31 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 170.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.81 14.65 7.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 129.16 2.984 . . . . 0.0 118.445 169.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.04 47.46 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 111.036 -2.802 . . . . 0.0 115.413 -173.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.254 91.5 p 57.32 -59.86 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 126.288 1.835 . . . . 0.0 115.214 -161.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -141.16 94.6 2.72 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -177.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.28 150.68 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 p -60.89 142.06 56.63 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -38.58 -79.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.125 2.17 . . . . 0.0 115.682 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -34.37 55.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 38' ' ' VAL . 47.8 m -61.74 -49.28 77.04 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.618 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.415 ' HB3' ' OE1' ' A' ' 39' ' ' GLU . 12.2 mtm105 -58.39 -53.37 59.02 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.305 1.594 . . . . 0.0 115.305 173.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -50.85 -38.57 49.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -76.82 -47.88 20.13 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 111.242 -2.708 . . . . 0.0 113.127 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 23' ' ' VAL . 43.2 t -61.18 -48.54 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.377 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.415 ' OE1' ' HB3' ' A' ' 35' ' ' ARG . 47.0 mt-10 -57.46 -45.83 84.32 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 128.161 2.584 . . . . 0.0 114.973 -178.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.12 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 112.855 -1.975 . . . . 0.0 110.665 176.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.42 -36.94 74.38 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 112.763 -2.017 . . . . 0.0 115.081 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 20.5 mtt -60.65 -53.33 58.72 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -171.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.31 97.31 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 113.499 -1.682 . . . . 0.0 113.311 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.63 -39.29 93.44 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.264 -2.244 . . . . 0.0 113.693 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.2 mt -94.3 25.3 3.91 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.933 1.693 . . . . 0.0 112.682 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.3 p30 59.54 21.57 10.12 Favored 'General case' 0 CA--C 1.57 1.741 0 C-N-CA 125.473 1.509 . . . . 0.0 114.32 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -93.19 166.57 12.26 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.956 0.902 . . . . 0.0 110.009 -175.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -145.56 124.78 6.77 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.702 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER -38.66 177.7 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 124.606 3.538 . . . . 0.0 117.85 178.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 58.91 -46.2 0.06 Allowed 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 130.037 3.335 . . . . 0.0 116.63 -165.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.834 HH21 ' HG3' ' A' ' 55' ' ' GLN 0.285 22.2 mtp85 -45.6 73.56 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 119.072 2.99 . . . . 0.0 119.072 -170.21 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.0 m -124.6 40.11 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-N 111.633 -2.53 . . . . 0.0 112.851 154.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -176.42 -146.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 112.82 -1.991 . . . . 0.0 109.596 -162.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 57.74 -76.94 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.169 2.188 . . . . 0.0 116.257 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.834 ' HG3' HH21 ' A' ' 51' ' ' ARG 0.265 0.0 OUTLIER -97.7 72.77 2.31 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 124.468 2.08 . . . . 0.0 110.494 171.027 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.1 mt . . . . . 0 N--CA 1.479 0.986 0 CA-C-N 111.536 -2.574 . . . . 0.0 114.868 -162.895 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.7 mtm . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 116.785 2.142 . . . . 0.0 116.785 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.66 ' HG3' ' HE1' ' A' ' 47' ' ' TYR . 44.5 tttt -21.63 98.22 0.06 OUTLIER Pre-proline 0 CA--C 1.573 1.849 0 C-N-CA 127.184 2.194 . . . . 0.0 112.997 -165.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -97.69 29.53 0.16 Allowed 'Trans proline' 0 CA--C 1.54 0.782 0 N-CA-C 119.776 2.952 . . . . 0.0 119.776 -148.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.457 1.1 t 173.11 150.99 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 129.564 3.146 . . . . 0.0 103.374 -166.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.8 p -101.99 145.44 29.28 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 117.57 -1.652 . . . . 0.0 108.944 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.475 ' HG ' ' HE3' ' A' ' 2' ' ' LYS . 10.3 mt -57.24 -9.58 1.01 Allowed 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -165.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -58.82 -37.56 76.67 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.926 0.784 . . . . 0.0 111.514 170.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.434 ' OD2' HD22 ' A' ' 45' ' ' LEU . 54.1 t0 -62.31 -48.43 79.9 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 118.062 -0.971 . . . . 0.0 111.603 176.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.21 -40.89 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 N-CA-C 112.235 0.458 . . . . 0.0 112.235 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.47 -55.26 36.9 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 125.827 1.651 . . . . 0.0 114.716 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -41.68 94.36 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 127.153 2.181 . . . . 0.0 113.841 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CB ' HD11 ' A' ' 45' ' ' LEU . 35.7 t80 -65.91 -31.47 72.43 Favored 'General case' 0 CA--C 1.551 0.981 0 O-C-N 124.411 1.07 . . . . 0.0 110.592 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.84 -16.86 22.59 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.111 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.94 23.2 59.92 Favored Glycine 0 CA--C 1.547 2.04 0 C-N-CA 126.496 1.998 . . . . 0.0 113.459 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.272 9.9 p -128.54 129.0 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -167.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.8 p -35.44 146.86 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 128.283 2.633 . . . . 0.0 112.181 -172.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -59.37 -32.8 70.46 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 119.192 -2.192 . . . . 0.0 114.648 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.271 27.2 tp60 -55.28 -38.93 69.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 117.473 -1.251 . . . . 0.0 113.01 171.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.459 ' O ' HG23 ' A' ' 23' ' ' VAL . 20.3 m -59.9 -53.39 58.49 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.469 0.708 . . . . 0.0 110.917 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.591 ' O ' HG23 ' A' ' 24' ' ' VAL 0.377 62.7 t -65.52 -43.11 94.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.826 -171.579 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.9 p -58.31 -48.1 81.6 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.452 HH11 ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -55.07 -53.6 53.82 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 110.932 -2.849 . . . . 0.0 113.491 170.597 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.763 HG11 HG21 ' A' ' 38' ' ' VAL . 76.4 t -62.24 -44.81 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.991 -174.295 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 20' ' ' VAL . 41.9 t -64.28 -41.64 93.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 CA-C-N 113.771 -1.558 . . . . 0.0 111.23 -168.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -77.22 5.07 9.1 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 113.787 -1.551 . . . . 0.0 113.832 169.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.512 ' OE1' ' HD2' ' A' ' 35' ' ' ARG . 14.9 mm100 69.97 3.68 4.45 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.895 2.478 . . . . 0.0 114.653 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.61 42.35 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 128.745 2.818 . . . . 0.0 116.898 -173.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.259 84.8 p 65.41 -62.19 0.23 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.584 1.954 . . . . 0.0 112.266 -164.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.8 m170 -138.2 137.57 37.7 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 124.2 0.938 . . . . 0.0 109.357 172.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.42 ' CG1' ' HD3' ' A' ' 35' ' ' ARG 0.253 1.4 p -138.21 153.84 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 120.278 1.399 . . . . 0.0 113.671 175.381 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -55.66 126.41 25.31 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.01 -60.88 1.27 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.1 -31.82 69.26 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.7 m -60.5 -48.17 82.92 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.145 1.378 . . . . 0.0 107.506 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.512 ' HD2' ' OE1' ' A' ' 26' ' ' GLN . 2.8 mtp85 -61.14 -44.66 96.98 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 116.773 2.138 . . . . 0.0 116.773 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.61 -34.36 71.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.864 178.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -80.28 -43.52 21.17 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.534 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.763 HG21 HG11 ' A' ' 23' ' ' VAL . 64.1 t -60.82 -48.28 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.549 1.54 . . . . 0.0 107.778 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.57 -40.76 88.4 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.916 2.086 . . . . 0.0 112.623 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.29 -49.66 70.94 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 113.783 -1.553 . . . . 0.0 111.137 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.01 -40.85 77.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 112.055 -2.339 . . . . 0.0 113.432 169.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 28.6 ttm -61.78 -46.24 90.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.632 1.573 . . . . 0.0 112.189 -172.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.44 -48.55 79.17 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.097 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.98 -39.15 93.83 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 113.19 -1.823 . . . . 0.0 113.561 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.444 HD11 ' CB ' ' A' ' 12' ' ' TYR . 61.6 mt -92.03 22.79 4.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -176.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 p30 57.03 19.35 4.6 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 117.624 2.453 . . . . 0.0 117.624 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.66 ' HE1' ' HG3' ' A' ' 2' ' ' LYS . 41.5 t80 -85.12 100.11 11.5 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.136 -1.393 . . . . 0.0 112.325 -163.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -31.21 112.3 0.32 Allowed Pre-proline 0 N--CA 1.491 1.594 0 CA-C-O 116.41 -1.757 . . . . 0.0 113.024 160.282 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 48' ' ' ILE 0.259 44.3 Cg_exo -57.86 32.39 0.04 OUTLIER 'Trans proline' 0 N--CA 1.487 1.112 1 N-CA-C 124.801 4.885 . . . . 0.0 124.801 -166.884 . . . . . . . . 4 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 177.9 104.97 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 175.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 9.61 88.32 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 115.702 1.742 . . . . 0.0 115.702 144.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.478 HG23 ' H ' ' A' ' 2' ' ' LYS . 1.5 m -119.99 -169.85 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 113.703 -1.59 . . . . 0.0 109.545 174.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -36.58 134.62 0.46 Allowed 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.475 -0.765 . . . . 0.0 111.694 164.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -113.45 158.52 20.57 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.659 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.417 ' H ' ' CD ' ' A' ' 55' ' ' GLN . 0.7 OUTLIER -40.19 98.29 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.336 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.806 149.251 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 73.1 mt . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -173.731 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ttp . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 115.549 1.685 . . . . 0.0 115.549 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -131.56 -174.24 0.38 Allowed Pre-proline 0 CA--C 1.556 1.186 0 CA-C-O 114.735 -2.555 . . . . 0.0 110.234 -175.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -52.81 -38.09 77.49 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 CA-C-N 124.92 2.793 . . . . 0.0 114.983 177.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.481 1.1 t -165.21 129.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 100.523 -3.88 . . . . 0.0 100.523 173.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.7 p -81.31 139.05 35.62 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.895 -1.128 . . . . 0.0 108.491 -162.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.471 HD21 ' CE2' ' A' ' 47' ' ' TYR . 53.8 mt -62.09 -6.2 2.8 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 120.909 3.67 . . . . 0.0 120.909 -155.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.257 70.4 m-85 -57.69 -37.91 74.26 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.319 1.418 . . . . 0.0 111.611 173.357 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.497 ' OD2' HD22 ' A' ' 45' ' ' LEU . 11.1 t70 -55.94 -53.29 58.58 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.1 t -59.95 -44.32 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.129 0.572 . . . . 0.0 111.818 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.07 77.7 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.058 1.343 . . . . 0.0 112.818 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.481 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.9 OUTLIER -69.42 -41.71 76.01 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.91 2.084 . . . . 0.0 114.185 178.095 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -63.96 -35.11 79.61 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.539 1.136 . . . . 0.0 110.003 177.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.81 -19.77 24.28 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.298 1.439 . . . . 0.0 111.528 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.72 28.21 61.53 Favored Glycine 0 N--CA 1.488 2.153 0 C-N-CA 125.721 1.629 . . . . 0.0 112.772 174.179 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.522 HG22 HG21 ' A' ' 19' ' ' THR 0.27 5.1 p -132.31 123.4 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.191 0 C-N-CA 124.82 1.248 . . . . 0.0 107.707 -170.531 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.7 p -32.46 145.09 0.02 OUTLIER 'General case' 0 N--CA 1.528 3.431 0 C-N-CA 128.005 2.522 . . . . 0.0 111.803 -171.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -57.89 -35.92 71.68 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 119.067 -2.27 . . . . 0.0 115.313 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -57.32 -40.23 77.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 118.772 -0.632 . . . . 0.0 112.187 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.558 ' O ' HG23 ' A' ' 23' ' ' VAL . 57.4 m -55.24 -50.2 70.06 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.685 0.794 . . . . 0.0 110.122 173.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.492 ' O ' HG23 ' A' ' 24' ' ' VAL 0.332 74.2 t -66.54 -42.39 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.174 0.59 . . . . 0.0 112.459 -174.611 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.6 p -63.28 -47.38 82.59 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.406 ' NH2' ' HB1' ' A' ' 27' ' ' ALA . 15.4 mtp85 -51.61 -47.19 63.72 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.395 -2.184 . . . . 0.0 112.996 168.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.577 HG21 HG21 ' A' ' 38' ' ' VAL . 78.6 t -60.18 -48.41 88.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-O 122.035 0.921 . . . . 0.0 110.076 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.603 HG11 ' HG3' ' A' ' 51' ' ' ARG . 61.9 t -59.76 -47.98 89.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 112.859 -1.973 . . . . 0.0 111.222 -172.179 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -84.99 23.13 1.26 Allowed 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.914 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.271 0.0 OUTLIER 59.22 7.79 0.96 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.382 2.673 . . . . 0.0 116.249 174.047 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.406 ' HB1' ' NH2' ' A' ' 22' ' ' ARG . . . 29.47 36.25 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 128.548 2.739 . . . . 0.0 116.075 -167.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p 59.33 -46.88 0.07 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 126.639 1.975 . . . . 0.0 115.759 -162.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -144.1 95.57 2.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.4 p -111.93 150.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -65.77 142.22 58.05 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.25 -69.47 0.11 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -49.62 -36.65 25.1 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 117.779 2.511 . . . . 0.0 117.779 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.2 m -58.82 -52.27 66.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.603 -1.635 . . . . 0.0 108.333 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.0 mtm105 -56.6 -47.52 79.42 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 175.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.09 -34.38 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -178.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.73 -42.95 57.34 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 112.542 -2.117 . . . . 0.0 112.02 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.577 HG21 HG21 ' A' ' 23' ' ' VAL . 60.4 t -64.62 -48.9 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 112.897 -1.956 . . . . 0.0 109.56 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -57.32 -47.15 82.28 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.655 2.782 . . . . 0.0 112.368 -178.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.34 -48.3 80.43 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 112.749 -2.023 . . . . 0.0 110.892 177.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.26 -43.63 88.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.527 -2.124 . . . . 0.0 114.703 175.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.9 mtt -59.28 -46.31 88.87 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.21 -44.35 95.55 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.881 -1.509 . . . . 0.0 112.437 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -61.54 -34.52 75.68 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.107 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.497 HD22 ' OD2' ' A' ' 8' ' ' ASP . 54.5 mt -99.79 13.08 34.94 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.625 2.37 . . . . 0.0 115.269 -177.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.378 0.2 OUTLIER 54.74 18.41 2.1 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 126.778 2.031 . . . . 0.0 115.763 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.471 ' CE2' HD21 ' A' ' 6' ' ' LEU . 61.4 t80 -83.83 102.29 12.24 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.428 -1.42 . . . . 0.0 108.467 -171.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.455 HD12 ' OD1' ' A' ' 50' ' ' ASN . 0.3 OUTLIER -42.75 125.82 3.1 Favored Pre-proline 0 N--CA 1.5 2.048 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.459 168.136 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -54.81 56.17 0.03 OUTLIER 'Trans proline' 0 CA--C 1.552 1.376 0 C-N-CA 124.581 3.521 . . . . 0.0 119.001 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.455 ' OD1' HD12 ' A' ' 48' ' ' ILE . 0.2 OUTLIER 177.34 148.61 0.14 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 128.259 2.623 . . . . 0.0 115.807 169.664 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.603 ' HG3' HG11 ' A' ' 24' ' ' VAL . 1.1 mtm105 -78.91 92.35 4.9 Favored 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 175.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 56' ' ' LEU . 5.5 m -76.33 66.35 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 176.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -41.12 -57.21 2.13 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 119.188 3.033 . . . . 0.0 119.188 -159.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -85.1 58.01 4.78 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 121.861 0.838 . . . . 0.0 112.476 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 52.02 33.8 12.62 Favored 'General case' 0 N--CA 1.518 2.927 0 CA-C-N 113.768 -1.56 . . . . 0.0 111.147 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 52' ' ' VAL . 29.5 mt . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -158.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.552 ' HA ' HE22 ' A' ' 55' ' ' GLN . 75.7 mtm . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HE2' HG22 ' A' ' 5' ' ' THR . 3.9 mppt? 65.04 166.98 0.11 Allowed Pre-proline 0 CA--C 1.567 1.629 0 CA-C-N 113.792 -1.549 . . . . 0.0 112.996 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -79.83 -19.57 9.65 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 N-CA-C 116.458 1.676 . . . . 0.0 116.458 163.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.47 0.5 OUTLIER -160.4 138.77 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 178.462 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.487 HG22 ' HE2' ' A' ' 2' ' ' LYS . 14.4 p -87.38 142.25 28.02 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.919 -168.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mt -58.94 -12.04 4.07 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 121.511 3.893 . . . . 0.0 121.511 -158.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -60.64 -34.14 73.83 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.557 0.617 . . . . 0.0 110.544 173.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.423 ' OD1' HD22 ' A' ' 45' ' ' LEU . 4.9 t70 -59.4 -50.55 73.51 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 170.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.49 -42.59 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 174.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.93 51.69 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 112.934 -1.939 . . . . 0.0 112.992 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -39.53 93.24 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.57 1.948 . . . . 0.0 114.309 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.483 ' CB ' HD11 ' A' ' 45' ' ' LEU . 41.5 t80 -64.44 -36.12 83.13 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.184 0.994 . . . . 0.0 110.39 176.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.98 -13.94 37.73 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.645 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.75 25.42 69.74 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 127.753 2.597 . . . . 0.0 113.31 172.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.25 128.62 71.73 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 CA-C-O 121.08 0.467 . . . . 0.0 111.894 -167.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.8 p -28.74 124.25 0.12 Allowed 'General case' 0 N--CA 1.52 3.053 0 C-N-CA 128.639 2.775 . . . . 0.0 109.323 174.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -45.31 -39.38 6.57 Favored 'General case' 0 N--CA 1.529 3.476 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.344 0.0 OUTLIER -54.05 -34.7 60.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 118.734 2.864 . . . . 0.0 118.734 -178.912 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' HG23 ' A' ' 23' ' ' VAL . 69.4 p -59.06 -47.11 86.42 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.755 1.222 . . . . 0.0 112.044 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.611 ' O ' HG23 ' A' ' 24' ' ' VAL . 92.6 t -66.02 -54.31 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.546 1.139 . . . . 0.0 109.675 -177.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.511 20.1 m -64.11 -26.89 68.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 19' ' ' THR . 26.2 mtp85 -61.27 -48.43 81.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 110.542 -3.026 . . . . 0.0 115.273 163.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.604 HG21 HG21 ' A' ' 38' ' ' VAL . 54.2 t -57.65 -46.5 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.417 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 20' ' ' VAL . 85.9 t -55.4 -48.04 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.852 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -104.93 19.7 20.11 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.26 2.9 mp0 64.92 14.8 9.53 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 174.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.426 ' HB1' ' CZ ' ' A' ' 22' ' ' ARG . . . 44.36 6.28 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 110.524 -3.035 . . . . 0.0 119.066 175.23 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.2 t 65.04 -51.76 0.34 Allowed 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 124.224 1.01 . . . . 0.0 110.867 -155.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -130.1 101.94 6.03 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.159 175.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -108.7 134.61 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 176.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.0 p -72.43 133.95 45.14 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.9 -63.38 1.11 Allowed 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.375 0.0 OUTLIER -45.38 -33.38 2.52 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 117.492 2.404 . . . . 0.0 117.492 178.673 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 38' ' ' VAL . 28.8 m -62.56 -49.73 74.1 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 -176.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -56.64 -45.16 81.76 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.202 1.801 . . . . 0.0 112.884 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.44 -38.21 83.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 113.759 -1.564 . . . . 0.0 113.844 -175.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 ttpt -78.19 -44.96 24.35 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 126.93 2.092 . . . . 0.0 110.415 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.604 HG21 HG21 ' A' ' 23' ' ' VAL . 49.0 t -62.05 -45.71 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.647 1.579 . . . . 0.0 108.233 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.01 -43.12 69.82 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.228 3.011 . . . . 0.0 113.058 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.43 -50.02 71.43 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 111.548 -2.569 . . . . 0.0 110.96 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.92 -45.7 86.14 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.758 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.563 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -58.69 -47.53 84.22 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.069 2.148 . . . . 0.0 113.885 -177.919 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.33 85.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 113.145 -1.843 . . . . 0.0 111.527 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -66.54 -37.4 84.91 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.317 -178.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.483 HD11 ' CB ' ' A' ' 12' ' ' TYR . 57.5 mt -88.83 14.28 10.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 178.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 53.48 28.54 7.76 Favored 'General case' 0 CA--C 1.57 1.725 0 C-N-CA 126.602 1.961 . . . . 0.0 113.62 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.563 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 27.7 t80 -89.51 169.27 11.5 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.543 -168.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.384 0.0 OUTLIER -126.46 100.23 29.28 Favored Pre-proline 0 N--CA 1.476 0.828 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.469 ' O ' HG13 ' A' ' 24' ' ' VAL 0.389 0.0 OUTLIER -4.2 -83.59 0.0 OUTLIER 'Trans proline' 0 N--CA 1.485 1.027 1 C-N-CA 126.829 5.019 . . . . 0.0 121.016 -175.277 . . . . . . . . 5 4 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -86.25 42.59 1.0 Allowed 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 -167.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.632 HH11 ' HB3' ' A' ' 53' ' ' ALA . 47.1 ptt85 46.29 109.36 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 127.46 2.304 . . . . 0.0 116.669 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.5 m -83.84 71.0 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 119.703 -1.873 . . . . 0.0 106.781 169.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.632 ' HB3' HH11 ' A' ' 51' ' ' ARG . . . -119.67 25.85 9.74 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 113.498 -1.683 . . . . 0.0 114.606 -174.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.498 HE21 ' CZ ' ' A' ' 51' ' ' ARG . 17.2 mp0 -111.25 25.45 11.72 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 122.215 1.007 . . . . 0.0 112.31 -175.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.552 HE22 ' HA ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -140.25 61.75 1.52 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 124.345 2.021 . . . . 0.0 110.444 -176.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 56' ' ' LEU . 5.7 mp . . . . . 0 N--CA 1.486 1.37 0 CA-C-N 111.21 -2.723 . . . . 0.0 114.273 -172.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.304 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 116.833 2.16 . . . . 0.0 116.833 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -171.91 152.35 2.96 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-O 115.662 -2.113 . . . . 0.0 116.379 179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.651 ' HD3' ' HG3' ' A' ' 51' ' ' ARG . 84.7 Cg_exo -56.91 -22.55 46.62 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 C-N-CA 123.376 2.718 . . . . 0.0 118.65 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.408 ' O ' ' HG2' ' A' ' 2' ' ' LYS 0.429 0.5 OUTLIER -150.5 143.76 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 104.886 -2.265 . . . . 0.0 104.886 177.847 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.499 ' HA ' ' HE2' ' A' ' 2' ' ' LYS 0.274 1.1 p -66.96 97.08 0.46 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -178.65 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.423 ' HG ' ' HG3' ' A' ' 2' ' ' LYS . 21.4 mt -36.35 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.623 0 N-CA-C 118.882 2.919 . . . . 0.0 118.882 -176.181 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.419 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 51.7 m-85 -54.94 -33.46 62.27 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.574 1.079 . . . . 0.0 110.863 167.206 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -56.44 -52.79 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.939 172.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.53 -44.89 90.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.652 0.66 . . . . 0.0 112.003 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.11 -50.03 74.9 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.37 -178.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.419 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.7 OUTLIER -67.76 -43.23 80.34 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.339 1.856 . . . . 0.0 115.497 174.916 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -65.47 -34.63 78.73 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.468 1.107 . . . . 0.0 111.131 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -17.95 25.36 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.801 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.46 26.02 68.9 Favored Glycine 0 N--CA 1.485 1.935 0 C-N-CA 125.822 1.677 . . . . 0.0 113.038 174.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.577 HG22 HG21 ' A' ' 19' ' ' THR . 5.4 p -129.64 108.38 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -169.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.8 p -17.27 145.93 0.0 OUTLIER 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 127.051 2.14 . . . . 0.0 114.516 -174.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -52.32 -46.67 66.1 Favored 'General case' 0 N--CA 1.52 3.042 0 O-C-N 119.758 -1.839 . . . . 0.0 114.129 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.54 -41.94 61.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.435 1.084 . . . . 0.0 112.516 177.135 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.577 HG21 HG22 ' A' ' 15' ' ' VAL . 52.2 m -57.33 -50.7 72.1 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.296 1.039 . . . . 0.0 111.998 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 24' ' ' VAL . 88.5 t -65.16 -51.0 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.044 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m -58.02 -32.79 68.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.385 1.074 . . . . 0.0 112.645 -177.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.9 mtp85 -65.28 -49.44 69.54 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 168.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.541 HG21 HG21 ' A' ' 38' ' ' VAL . 58.3 t -62.08 -38.11 80.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.707 -178.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 20' ' ' VAL . 51.3 t -48.65 -54.33 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.578 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.445 ' HA ' ' ND2' ' A' ' 50' ' ' ASN . 47.3 m-80 -87.37 16.15 5.67 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.175 179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.678 ' HA ' HH12 ' A' ' 35' ' ' ARG 0.375 0.2 OUTLIER 69.19 -1.42 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 130.212 3.405 . . . . 0.0 118.494 177.758 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 5.83 51.32 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 109.738 -3.392 . . . . 0.0 118.086 -164.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t 63.58 -57.29 0.19 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 110.95 -2.841 . . . . 0.0 115.427 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -130.59 21.64 5.1 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -163.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.321 93.6 t -74.06 111.68 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 N-CA-C 119.509 3.152 . . . . 0.0 119.509 -160.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 m -13.16 132.34 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.27 -2.241 . . . . 0.0 116.074 -174.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.64 -55.43 11.29 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -172.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.16 -49.48 42.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 117.936 2.569 . . . . 0.0 117.936 173.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 38' ' ' VAL . 61.6 m -55.96 -49.53 73.3 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.254 1.021 . . . . 0.0 108.609 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.678 HH12 ' HA ' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -58.42 -47.68 83.15 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 176.663 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.05 79.83 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -79.65 -42.21 25.29 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 112.662 -2.063 . . . . 0.0 112.534 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.541 HG21 HG21 ' A' ' 23' ' ' VAL . 59.9 t -60.84 -50.81 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 174.472 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -55.9 -44.24 78.01 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.631 2.773 . . . . 0.0 112.738 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.8 -51.27 65.54 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.673 -2.058 . . . . 0.0 110.83 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.46 84.37 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 112.935 -1.939 . . . . 0.0 113.356 175.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.406 ' HG3' HG12 ' A' ' 38' ' ' VAL . 4.9 mtt -59.17 -49.32 78.3 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -174.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.87 98.12 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 111.865 -2.425 . . . . 0.0 113.131 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.12 -38.15 87.48 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 112.525 -2.125 . . . . 0.0 114.022 -176.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.2 mt -94.91 21.82 7.17 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 126.717 2.007 . . . . 0.0 113.314 -174.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.59 25.98 13.86 Favored 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.473 ' HE1' ' HB2' ' A' ' 2' ' ' LYS . 44.1 t80 -98.48 166.45 11.35 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.075 -1.42 . . . . 0.0 108.311 -171.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.22 119.63 10.44 Favored Pre-proline 0 CA--C 1.55 0.952 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.995 -174.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -41.46 138.85 2.07 Favored 'Trans proline' 0 CA--C 1.554 1.514 0 C-N-CA 124.43 3.42 . . . . 0.0 113.932 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.445 ' ND2' ' HA ' ' A' ' 25' ' ' ASN . 4.9 t-20 41.11 66.31 0.68 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -165.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.651 ' HG3' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -119.98 81.42 1.73 Allowed 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 169.632 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.524 HG13 HG11 ' A' ' 24' ' ' VAL . 1.1 m -106.16 176.4 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.545 170.077 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.72 82.25 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 123.209 1.481 . . . . 0.0 113.777 175.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.439 ' HB2' ' NH2' ' A' ' 51' ' ' ARG . 37.8 mt-30 -125.82 14.36 8.01 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 113.535 -1.666 . . . . 0.0 112.464 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -90.08 64.97 6.36 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 124.42 2.057 . . . . 0.0 111.544 -178.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.7 mp . . . . . 0 N--CA 1.483 1.204 0 CA-C-N 111.625 -2.534 . . . . 0.0 113.737 -176.776 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 115.867 1.803 . . . . 0.0 115.867 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.472 ' HA ' ' HB3' ' A' ' 51' ' ' ARG . 58.3 pttt -166.55 114.32 0.72 Allowed Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 116.198 -1.858 . . . . 0.0 106.333 177.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -75.13 26.27 0.37 Allowed 'Trans proline' 0 C--N 1.355 0.875 0 N-CA-C 120.947 3.403 . . . . 0.0 120.947 -161.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.387 0.5 OUTLIER -178.11 151.47 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.123 0 CA-C-N 111.115 -2.766 . . . . 0.0 106.705 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 5.0 p -80.93 102.97 10.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 102.636 -3.098 . . . . 0.0 102.636 177.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -46.36 -13.79 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.829 0 N-CA-C 118.681 2.845 . . . . 0.0 118.681 -174.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 47.9 m-85 -53.99 -32.75 55.04 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 118.44 0.564 . . . . 0.0 111.2 165.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.433 ' OD2' HD22 ' A' ' 45' ' ' LEU . 10.4 t70 -57.9 -50.27 73.92 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.2 t -59.27 -43.32 89.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 118.492 0.587 . . . . 0.0 111.771 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.19 -49.94 75.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.638 -175.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.414 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -68.79 -41.77 78.3 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.894 2.078 . . . . 0.0 114.718 175.378 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -63.9 -33.66 76.21 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.975 0.91 . . . . 0.0 110.88 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.89 -18.73 22.44 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-N 113.497 -1.683 . . . . 0.0 111.037 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.24 26.78 56.96 Favored Glycine 0 N--CA 1.487 2.088 0 C-N-CA 126.383 1.945 . . . . 0.0 113.703 173.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.61 HG21 HG23 ' A' ' 34' ' ' THR . 9.1 p -125.6 114.84 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 124.326 1.051 . . . . 0.0 110.932 -170.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -21.73 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 128.636 2.774 . . . . 0.0 110.989 175.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -42.23 -40.55 2.44 Favored 'General case' 0 N--CA 1.52 3.052 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -50.35 -38.91 44.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.582 1.176 . . . . 0.0 113.611 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.645 ' O ' HG23 ' A' ' 23' ' ' VAL 0.256 24.3 p -62.7 -51.23 68.03 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 173.283 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.411 76.5 t -59.54 -41.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.867 0.867 . . . . 0.0 112.53 -167.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.72 -38.12 89.91 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 19' ' ' THR . 22.2 mtp85 -62.97 -38.54 91.51 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 172.351 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.809 HG21 HG21 ' A' ' 38' ' ' VAL . 97.2 t -56.97 -47.82 82.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 126.717 2.007 . . . . 0.0 108.824 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.408 HG13 ' HA ' ' A' ' 50' ' ' ASN . 55.3 t -59.37 -55.96 20.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 109.285 -3.598 . . . . 0.0 114.303 -169.041 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -82.92 0.5 44.09 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 125.464 1.728 . . . . 0.0 114.336 175.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 55.0 36.93 28.05 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 124.744 2.212 . . . . 0.0 110.184 -170.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.381 . . -68.79 84.14 0.3 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 118.821 2.897 . . . . 0.0 118.821 -165.049 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 57.8 p 80.43 -88.76 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.728 169.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -112.36 44.05 1.51 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.862 HG23 ' HE ' ' A' ' 35' ' ' ARG . 4.3 p -34.07 135.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 111.931 -2.395 . . . . 0.0 113.246 151.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.73 ' H ' ' CZ ' ' A' ' 35' ' ' ARG . 45.4 t -111.23 126.43 54.86 Favored 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -170.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.03 -59.66 1.67 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -47.37 83.41 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.61 HG23 HG21 ' A' ' 15' ' ' VAL . 28.6 m -58.4 -48.26 81.22 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 112.605 -2.088 . . . . 0.0 105.599 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.862 ' HE ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -57.4 -39.42 76.07 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 113.798 -1.546 . . . . 0.0 115.06 -174.791 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -62.58 -40.82 98.12 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.453 -1.703 . . . . 0.0 114.269 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -75.56 -40.97 56.02 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.47 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.809 HG21 HG21 ' A' ' 23' ' ' VAL . 20.6 t -62.2 -48.92 86.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 127.486 2.314 . . . . 0.0 106.638 176.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -55.6 -43.31 75.93 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 128.409 2.683 . . . . 0.0 113.786 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.19 -51.65 62.71 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 110.73 -2.941 . . . . 0.0 110.4 172.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.87 -54.77 40.63 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.828 ' HB2' ' HB3' ' A' ' 47' ' ' TYR 0.36 0.0 OUTLIER -64.29 -25.55 68.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 -174.66 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.17 -47.62 73.39 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.82 172.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.95 -34.2 75.68 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.588 1.555 . . . . 0.0 112.558 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.433 HD22 ' OD2' ' A' ' 8' ' ' ASP . 36.6 mt -95.68 7.24 46.84 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.304 2.642 . . . . 0.0 115.344 -176.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.416 0.2 OUTLIER 60.4 14.57 4.83 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 178.712 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.828 ' HB3' ' HB2' ' A' ' 42' ' ' MET . 83.6 t80 -73.44 105.37 4.78 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -52.0 119.58 14.54 Favored Pre-proline 0 N--CA 1.495 1.78 0 C-N-CA 118.484 -1.286 . . . . 0.0 112.741 163.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -47.52 139.0 18.24 Favored 'Trans proline' 0 CA--C 1.556 1.612 0 C-N-CA 123.127 2.551 . . . . 0.0 112.773 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.408 ' HA ' HG13 ' A' ' 24' ' ' VAL . 0.5 OUTLIER 59.44 53.15 5.33 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 118.091 2.626 . . . . 0.0 118.091 -177.431 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.472 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -95.8 53.7 1.44 Allowed 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 161.019 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.508 ' HA ' HE22 ' A' ' 55' ' ' GLN . 54.9 t -135.99 84.69 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 N-CA-C 102.482 -3.155 . . . . 0.0 102.482 161.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -161.93 -63.83 0.05 Allowed 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 110.999 -2.819 . . . . 0.0 107.895 -167.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.465 ' NE2' ' HE ' ' A' ' 51' ' ' ARG . 31.5 mt-30 -92.68 43.6 1.13 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 124.141 1.924 . . . . 0.0 115.181 -169.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.508 HE22 ' HA ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -165.52 -55.44 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 111.024 -2.807 . . . . 0.0 110.05 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 76.4 mt . . . . . 0 N--CA 1.493 1.692 0 CA-C-N 114.813 -1.085 . . . . 0.0 112.529 166.636 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.439 ' H3 ' HG22 ' A' ' 52' ' ' VAL . 4.3 ppp? . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 77.4 tttt 61.36 61.95 2.73 Favored Pre-proline 0 CA--C 1.568 1.662 0 C-N-CA 122.639 0.376 . . . . 0.0 111.45 156.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -84.2 -21.02 3.93 Favored 'Trans proline' 0 N--CA 1.485 0.986 0 C-N-CA 117.521 -1.186 . . . . 0.0 114.438 141.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.416 0.4 OUTLIER -159.18 154.53 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 174.044 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.443 HG22 HD11 ' A' ' 56' ' ' LEU . 1.4 p -90.83 135.68 33.57 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 103.324 -2.843 . . . . 0.0 103.324 -179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.758 HD11 ' HG2' ' A' ' 51' ' ' ARG . 20.1 mt -54.91 -18.55 5.1 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 128.945 2.898 . . . . 0.0 116.053 -162.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -55.03 -33.57 62.78 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 119.566 1.076 . . . . 0.0 111.142 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -65.55 -47.83 74.52 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.169 176.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.5 t -55.79 -45.9 79.66 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 124.516 1.126 . . . . 0.0 112.625 173.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.05 -54.98 36.18 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 126.172 1.789 . . . . 0.0 112.671 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -38.07 89.75 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.123 1.769 . . . . 0.0 113.728 177.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.23 -34.8 78.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.022 1.329 . . . . 0.0 110.7 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.62 -4.57 55.11 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.13 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 70.15 23.45 77.21 Favored Glycine 0 N--CA 1.492 2.374 0 C-N-CA 127.274 2.368 . . . . 0.0 113.089 172.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.252 8.8 p -123.73 137.02 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -166.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 p -55.03 138.12 44.73 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.842 1.257 . . . . 0.0 109.013 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.672 ' HE1' ' HB2' ' A' ' 6' ' ' LEU . 72.9 t80 -49.95 -28.56 6.95 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -172.177 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 -46.96 -47.38 21.8 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 124.853 1.345 . . . . 0.0 112.292 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 23' ' ' VAL . 65.3 p -58.78 -51.81 68.4 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.638 ' O ' HG23 ' A' ' 24' ' ' VAL . 89.1 t -62.96 -51.82 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.817 1.647 . . . . 0.0 109.549 -173.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.8 t -59.13 -41.23 87.73 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 19' ' ' THR . 19.6 mtp85 -60.25 -45.2 94.08 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 113.804 -1.543 . . . . 0.0 114.854 173.027 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.626 HG21 HG21 ' A' ' 38' ' ' VAL . 42.6 t -57.56 -44.04 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.631 1.972 . . . . 0.0 109.277 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 20' ' ' VAL . 75.0 t -58.07 -42.05 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 CA-C-N 111.315 -2.675 . . . . 0.0 112.491 -171.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.581 HD21 ' CZ ' ' A' ' 51' ' ' ARG . 6.6 m120 -91.38 4.22 52.97 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 113.529 -1.668 . . . . 0.0 113.354 173.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.433 ' OE1' HG12 ' A' ' 30' ' ' VAL . 1.1 tm0? 58.1 17.18 4.31 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 128.852 2.861 . . . . 0.0 114.63 -173.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.59 38.55 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 110.615 -2.993 . . . . 0.0 116.307 -174.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 97.6 p 55.36 -28.86 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 119.246 3.054 . . . . 0.0 119.246 -160.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -161.85 80.04 0.56 Allowed 'General case' 0 CA--C 1.564 1.501 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 -161.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.433 HG12 ' OE1' ' A' ' 26' ' ' GLN . 8.8 p -117.27 147.26 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 120.452 -1.405 . . . . 0.0 114.674 -179.02 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.4 p -63.06 135.11 57.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.042 0.937 . . . . 0.0 113.458 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.15 -66.23 0.43 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.309 1.6 pptp? -48.02 -33.22 7.64 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 120.299 3.444 . . . . 0.0 120.299 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -61.77 -49.67 75.45 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.608 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 14.2 mtm105 -57.83 -46.89 84.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.39 -36.09 70.84 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -75.54 -44.1 45.27 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.493 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.626 HG21 HG21 ' A' ' 23' ' ' VAL . 48.7 t -63.93 -45.24 97.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.415 176.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 45.5 mt-10 -55.39 -43.78 75.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 129.532 3.133 . . . . 0.0 111.784 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.11 -50.93 66.36 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.469 -1.696 . . . . 0.0 111.583 175.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.36 89.02 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 113.547 -1.66 . . . . 0.0 114.137 176.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.409 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 0.7 OUTLIER -57.61 -45.21 85.64 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.926 1.69 . . . . 0.0 114.356 179.833 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.98 -46.31 85.18 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 113.553 -1.658 . . . . 0.0 111.035 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -64.81 -37.27 87.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 113.122 -1.854 . . . . 0.0 113.726 -178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.9 mt -96.37 17.82 15.2 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.94 2.496 . . . . 0.0 114.391 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.383 0.2 OUTLIER 51.41 21.74 1.28 Allowed 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 127.402 2.281 . . . . 0.0 115.772 177.436 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.409 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 27.8 t80 -74.72 154.72 38.29 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.436 -0.79 . . . . 0.0 110.54 -168.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -110.68 93.56 17.09 Favored Pre-proline 0 N--CA 1.473 0.718 0 CA-C-N 112.181 -2.282 . . . . 0.0 111.813 -179.023 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.634 ' O ' HG13 ' A' ' 24' ' ' VAL 0.267 0.1 OUTLIER -9.57 -73.49 0.0 OUTLIER 'Trans proline' 0 N--CA 1.482 0.843 1 C-N-CA 126.797 4.998 . . . . 0.0 117.059 -169.259 . . . . . . . . 5 4 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.265 0.2 OUTLIER -80.42 120.48 24.49 Favored 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 174.687 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.758 ' HG2' HD11 ' A' ' 6' ' ' LEU 0.367 0.0 OUTLIER -72.36 89.15 1.21 Allowed 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 172.478 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.439 HG22 ' H3 ' ' A' ' 1' ' ' MET . 3.5 m -85.86 40.21 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 118.072 2.619 . . . . 0.0 118.072 -160.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -167.51 28.53 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 112.647 -2.07 . . . . 0.0 111.774 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.596 HE22 HH21 ' A' ' 51' ' ' ARG . 4.9 tp-100 49.07 -95.75 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.475 1.51 . . . . 0.0 111.267 -167.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.474 ' H ' ' HB3' ' A' ' 54' ' ' GLN . 17.6 tt0 66.26 -45.03 0.41 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.939 1.696 . . . . 0.0 111.604 -173.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.443 HD11 HG22 ' A' ' 5' ' ' THR . 1.0 OUTLIER . . . . . 0 N--CA 1.484 1.236 0 C-N-CA 125.605 1.562 . . . . 0.0 114.041 -177.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HB3' ' NE2' ' A' ' 55' ' ' GLN . 57.5 ttp . . . . . 0 CA--C 1.565 1.555 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.588 ' HD2' ' HB2' ' A' ' 53' ' ' ALA . 19.4 ptmt 175.55 142.77 0.22 Allowed Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.927 2.091 . . . . 0.0 107.928 165.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -64.21 -26.94 64.43 Favored 'Trans proline' 0 C--N 1.357 0.978 0 CA-C-N 122.772 2.026 . . . . 0.0 116.905 -153.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.487 0.8 OUTLIER -167.77 145.16 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 102.121 -3.289 . . . . 0.0 102.121 -175.324 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -93.85 134.16 36.51 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.079 -1.013 . . . . 0.0 108.39 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.486 HD21 ' CZ ' ' A' ' 47' ' ' TYR . 14.6 mt -48.45 -17.69 0.18 Allowed 'General case' 0 N--CA 1.511 2.603 0 N-CA-C 118.454 2.761 . . . . 0.0 118.454 -163.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 45.5 m-85 -58.1 -35.38 71.35 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.78 0.718 . . . . 0.0 111.316 172.03 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -64.18 -45.77 86.92 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 117.525 -1.226 . . . . 0.0 111.339 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.63 ' HA ' HD13 ' A' ' 45' ' ' LEU . 71.2 t -57.61 -42.22 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 CA-C-N 119.052 0.842 . . . . 0.0 112.987 174.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.484 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -62.18 -52.98 61.62 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 111.646 -2.525 . . . . 0.0 111.748 -176.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.405 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.67 -38.07 83.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.202 2.201 . . . . 0.0 113.204 177.491 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.427 ' CB ' HD11 ' A' ' 45' ' ' LEU . 30.1 t80 -64.35 -35.39 80.73 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.417 1.487 . . . . 0.0 109.521 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.15 -18.32 24.67 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.876 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.44 29.54 57.95 Favored Glycine 0 N--CA 1.49 2.24 0 C-N-CA 126.391 1.948 . . . . 0.0 113.003 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.1 p -125.36 137.9 56.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 123.908 0.883 . . . . 0.0 109.028 -170.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.0 p -43.41 122.07 2.48 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 127.038 2.135 . . . . 0.0 107.852 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -33.05 -48.76 0.22 Allowed 'General case' 0 N--CA 1.524 3.241 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.554 0.0 OUTLIER -57.84 -20.98 40.11 Favored 'General case' 0 C--N 1.314 -0.963 1 N-CA-C 124.232 4.901 . . . . 0.0 124.232 -179.956 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' HG23 ' A' ' 23' ' ' VAL 0.696 0.7 OUTLIER -76.56 -43.56 38.43 Favored 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 160.753 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' HG23 ' A' ' 24' ' ' VAL . 77.4 t -59.72 -49.39 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.635 -176.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.3 p -58.01 -44.43 87.26 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -173.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -60.36 -47.39 86.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 108.695 -3.866 . . . . 0.0 114.852 168.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 19' ' ' THR . 91.4 t -59.19 -40.66 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -176.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 20' ' ' VAL . 68.5 t -53.62 -50.0 52.89 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 CA-C-N 113.914 -1.493 . . . . 0.0 112.966 -172.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.525 ' ND2' HH12 ' A' ' 51' ' ' ARG 0.308 62.7 m-20 -99.34 27.78 4.98 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 123.103 1.43 . . . . 0.0 114.706 170.519 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 71.31 -16.58 0.36 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 131.589 3.956 . . . . 0.0 116.583 173.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 45.18 37.93 2.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.113 2.165 . . . . 0.0 111.781 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.2 p 57.55 -46.34 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.751 -2.022 . . . . 0.0 115.821 -150.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -154.73 109.82 3.07 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.192 -165.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.638 ' H ' ' NH2' ' A' ' 35' ' ' ARG . 25.3 t -132.97 132.55 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 120.628 1.558 . . . . 0.0 114.763 157.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -16.16 135.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 175.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 35' ' ' ARG . . . -59.93 -49.08 79.08 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.559 1.144 . . . . 0.0 113.416 -173.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -44.2 43.65 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 175.097 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.0 m -62.03 -51.27 68.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 113.068 -1.878 . . . . 0.0 108.273 175.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.638 ' NH2' ' H ' ' A' ' 30' ' ' VAL . 38.3 mtt-85 -53.87 -46.81 71.42 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.386 1.074 . . . . 0.0 113.856 178.002 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.88 -37.42 76.52 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.792 -1.095 . . . . 0.0 113.539 -176.274 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -76.44 -45.3 32.02 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.741 -2.027 . . . . 0.0 111.908 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.4 t -61.29 -47.91 91.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-N 113.884 -1.507 . . . . 0.0 108.513 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -58.53 -46.12 87.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.009 3.324 . . . . 0.0 111.503 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.54 -48.98 73.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 113.434 -1.712 . . . . 0.0 110.873 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.8 -43.94 86.01 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 112.95 -1.932 . . . . 0.0 112.661 173.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.499 ' HG2' ' HD2' ' A' ' 47' ' ' TYR . 9.9 mtt -55.04 -46.65 75.33 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 125.436 1.495 . . . . 0.0 112.169 -178.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -47.45 83.26 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 112.951 -1.931 . . . . 0.0 111.731 -175.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -61.03 -40.31 93.09 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 112.413 -2.176 . . . . 0.0 112.916 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 9' ' ' VAL . 19.4 mt -87.13 6.23 33.81 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 128.393 2.677 . . . . 0.0 116.645 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.43 0.2 OUTLIER 52.6 23.1 2.45 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 128.09 2.556 . . . . 0.0 113.792 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.499 ' HD2' ' HG2' ' A' ' 42' ' ' MET . 51.8 t80 -82.05 97.96 8.4 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 118.614 -2.554 . . . . 0.0 110.824 -172.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -32.91 121.7 0.43 Allowed Pre-proline 0 N--CA 1.494 1.726 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.633 155.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -65.54 48.17 0.2 Allowed 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.073 2.515 . . . . 0.0 118.0 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -171.73 93.33 0.15 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.046 -1.888 . . . . 0.0 114.341 176.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.525 HH12 ' ND2' ' A' ' 25' ' ' ASN . 5.0 ttp-105 -9.4 96.91 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.357 0 CA-C-N 113.779 -1.555 . . . . 0.0 111.417 146.226 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 16.1 m -107.31 39.39 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 174.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.588 ' HB2' ' HD2' ' A' ' 2' ' ' LYS . . . -86.39 16.16 4.75 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 111.921 -2.4 . . . . 0.0 113.232 -175.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -94.94 64.11 2.8 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 124.467 2.08 . . . . 0.0 114.116 -169.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.523 ' NE2' ' HB3' ' A' ' 1' ' ' MET . 0.8 OUTLIER -171.71 -24.75 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.705 1 CA-C-N 107.9 -4.227 . . . . 0.0 113.727 178.857 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 N--CA 1.484 1.261 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 169.945 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.8 mtt . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.5 mtpt -166.08 54.44 0.33 Allowed Pre-proline 0 N--CA 1.488 1.429 0 C-N-CA 126.793 2.037 . . . . 0.0 107.301 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.86 -28.86 79.13 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 122.463 2.109 . . . . 0.0 116.724 -165.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.327 0.5 OUTLIER -150.53 118.89 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 113.901 -1.5 . . . . 0.0 109.665 175.998 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 p -67.81 147.15 52.96 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -152.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.542 ' HB2' ' HE2' ' A' ' 17' ' ' TYR . 11.8 mt -48.89 -17.54 0.2 Allowed 'General case' 0 N--CA 1.517 2.889 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 -162.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.425 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 30.3 m-85 -60.83 -40.58 93.32 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 118.596 0.635 . . . . 0.0 111.241 179.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.427 ' OD2' HD22 ' A' ' 45' ' ' LEU . 6.4 t70 -51.81 -55.86 17.37 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.299 1.04 . . . . 0.0 112.057 166.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.6 t -58.94 -39.72 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 7' ' ' TYR . . . -58.07 -55.57 33.18 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 126.384 1.873 . . . . 0.0 112.701 172.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -38.37 89.3 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.52 1.928 . . . . 0.0 114.237 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.422 ' CG ' HD11 ' A' ' 45' ' ' LEU . 43.2 t80 -64.57 -37.28 87.02 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.466 1.107 . . . . 0.0 109.808 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.17 -12.33 44.23 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.829 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 26.61 67.57 Favored Glycine 0 CA--C 1.549 2.169 0 C-N-CA 127.533 2.492 . . . . 0.0 113.337 172.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.0 p -124.06 132.08 71.9 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 123.909 0.883 . . . . 0.0 110.663 -171.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -36.79 127.76 0.86 Allowed 'General case' 0 N--CA 1.522 3.137 0 C-N-CA 126.638 1.975 . . . . 0.0 108.952 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.542 ' HE2' ' HB2' ' A' ' 6' ' ' LEU . 58.7 t80 -48.05 -33.0 7.41 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 115.848 1.795 . . . . 0.0 115.848 176.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -52.38 -46.19 66.11 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-O 117.115 -1.421 . . . . 0.0 111.315 175.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.574 ' O ' HG23 ' A' ' 23' ' ' VAL 0.905 0.6 OUTLIER -67.86 -40.01 83.68 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.963 2.209 . . . . 0.0 116.963 176.544 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.65 ' O ' HG23 ' A' ' 24' ' ' VAL 0.278 78.2 t -59.61 -46.79 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 117.294 -1.336 . . . . 0.0 110.279 -177.614 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.347 3.5 m -68.08 -29.7 68.71 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 120.358 3.466 . . . . 0.0 120.358 -174.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 19' ' ' THR . 33.7 mtp85 -63.91 -52.18 61.08 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 110.808 -2.905 . . . . 0.0 113.184 162.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.736 HG22 HG21 ' A' ' 30' ' ' VAL . 62.8 t -62.39 -42.27 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 C-N-CA 124.488 1.115 . . . . 0.0 110.255 -172.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 20' ' ' VAL . 52.3 t -51.65 -54.87 10.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 O-C-N 125.418 1.699 . . . . 0.0 111.112 -162.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.289 85.8 m-20 -105.89 42.01 1.32 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 113.948 -1.478 . . . . 0.0 112.858 176.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.384 10.6 pt20 80.97 -9.97 1.27 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.546 3.539 . . . . 0.0 118.417 163.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.36 30.55 0.08 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.717 2.007 . . . . 0.0 115.075 -168.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.9 p 61.02 -44.82 0.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 115.98 1.845 . . . . 0.0 115.98 -155.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.276 78.4 m80 -152.53 126.4 9.0 Favored 'General case' 0 CA--C 1.558 1.275 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -170.04 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.736 HG21 HG22 ' A' ' 23' ' ' VAL . 3.7 p -141.53 162.75 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.568 0 CA-C-N 120.157 1.344 . . . . 0.0 112.656 170.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -59.45 130.03 44.88 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 170.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.93 -59.53 4.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -175.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.6 tptp -41.41 -41.3 1.98 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.7 m -58.51 -47.0 85.59 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 113.639 -1.619 . . . . 0.0 109.173 -178.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.6 mmt85 -55.34 -45.19 76.43 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -35.13 76.05 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -78.55 -42.3 29.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 112.477 -2.147 . . . . 0.0 112.217 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.401 HG21 HG11 ' A' ' 23' ' ' VAL . 84.3 t -60.83 -50.8 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.007 1.723 . . . . 0.0 108.059 173.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -54.95 -44.9 74.77 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 125.327 1.451 . . . . 0.0 112.922 -178.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.89 -49.26 71.18 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 112.479 -2.146 . . . . 0.0 111.213 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.17 -45.59 83.52 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 113.581 -1.645 . . . . 0.0 113.249 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.489 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.1 mmt -60.11 -47.39 86.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.667 -1.151 . . . . 0.0 114.019 -177.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 113.27 -1.786 . . . . 0.0 111.449 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -64.78 -40.62 95.56 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.027 -2.351 . . . . 0.0 112.358 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.427 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.3 mt -85.78 6.67 26.93 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 127.81 2.444 . . . . 0.0 112.517 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.474 0.2 OUTLIER 44.16 34.05 0.92 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -171.257 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 60.7 t80 -98.34 88.46 4.16 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 111.324 -2.671 . . . . 0.0 108.778 -166.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -6.64 114.56 0.03 OUTLIER Pre-proline 0 N--CA 1.496 1.853 0 CA-C-N 111.65 -2.523 . . . . 0.0 114.219 155.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -68.29 57.92 0.94 Allowed 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 122.339 2.026 . . . . 0.0 116.668 173.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -169.96 -177.28 2.55 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.636 1.974 . . . . 0.0 110.786 168.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.442 ' HD2' HD11 ' A' ' 6' ' ' LEU . 0.6 OUTLIER -132.92 96.48 3.79 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.362 1.065 . . . . 0.0 108.538 177.803 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.84 135.79 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 N-CA-C 104.211 -2.515 . . . . 0.0 104.211 163.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.85 100.61 0.96 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 119.298 0.954 . . . . 0.0 110.962 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -74.02 -38.16 64.13 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 113.115 -1.857 . . . . 0.0 110.834 171.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.512 ' H ' ' CD ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -89.58 77.76 7.15 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 113.136 -1.847 . . . . 0.0 106.118 173.088 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 N--CA 1.483 1.215 0 CA-C-N 111.577 -2.556 . . . . 0.0 115.165 173.082 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.507 ' HG2' ' HG3' ' A' ' 54' ' ' GLN . 23.7 ptt? . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 115.646 1.721 . . . . 0.0 115.646 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.526 ' HG2' ' HG ' ' A' ' 6' ' ' LEU 0.349 0.2 OUTLIER 49.33 127.63 0.0 OUTLIER Pre-proline 0 CA--C 1.577 2.005 0 N-CA-C 118.965 2.95 . . . . 0.0 118.965 159.942 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -76.0 24.45 0.43 Allowed 'Trans proline' 0 C--N 1.361 1.197 0 N-CA-C 120.331 3.166 . . . . 0.0 120.331 -176.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.438 ' O ' ' HD3' ' A' ' 2' ' ' LYS 0.427 0.5 OUTLIER -176.7 148.12 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 N-CA-C 102.578 -3.119 . . . . 0.0 102.578 -176.862 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.337 0.8 OUTLIER -71.09 106.09 3.6 Favored 'General case' 0 CA--C 1.563 1.475 0 N-CA-C 101.75 -3.426 . . . . 0.0 101.75 -179.392 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.526 ' HG ' ' HG2' ' A' ' 2' ' ' LYS . 51.7 mt -45.48 -16.3 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.894 0 N-CA-C 118.341 2.719 . . . . 0.0 118.341 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.61 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.314 56.4 m-85 -54.54 -32.5 58.37 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.621 1.555 . . . . 0.0 111.447 166.395 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.516 ' OD2' HD22 ' A' ' 45' ' ' LEU . 23.3 t0 -60.19 -49.67 76.71 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.327 175.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.98 -46.25 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 174.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.75 -49.51 77.44 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 111.67 -2.513 . . . . 0.0 111.66 -176.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.61 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.7 OUTLIER -67.89 -43.09 80.14 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.629 2.372 . . . . 0.0 114.678 177.243 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -63.24 -32.89 74.41 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.864 0.728 . . . . 0.0 110.601 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.75 -16.44 25.43 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 113.94 -1.482 . . . . 0.0 111.723 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.77 25.78 66.5 Favored Glycine 0 CA--C 1.55 2.24 0 C-N-CA 126.56 2.028 . . . . 0.0 113.618 173.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.428 HG22 HG21 ' A' ' 19' ' ' THR 0.276 4.3 p -129.94 125.12 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.511 0 C-N-CA 124.115 0.966 . . . . 0.0 108.394 -167.012 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -32.96 139.26 0.05 Allowed 'General case' 0 N--CA 1.526 3.37 0 C-N-CA 127.507 2.323 . . . . 0.0 111.274 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -52.52 -41.73 63.71 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-N 121.117 1.78 . . . . 0.0 115.047 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.606 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.529 3.2 pp0? -61.77 -30.51 70.84 Favored 'General case' 0 C--N 1.318 -0.77 1 N-CA-C 122.718 4.34 . . . . 0.0 122.718 175.331 . . . . . . . . 4 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 23' ' ' VAL . 87.4 m -55.19 -49.34 72.16 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 112.801 -2.0 . . . . 0.0 109.581 162.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.681 ' O ' HG23 ' A' ' 24' ' ' VAL 0.284 73.9 t -64.67 -48.06 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.772 -178.15 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.338 3.3 m -63.37 -33.24 75.12 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.606 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 20.7 mtt85 -60.9 -48.84 79.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.085 -1.87 . . . . 0.0 114.354 167.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.568 HG21 HG21 ' A' ' 38' ' ' VAL . 89.7 t -61.07 -39.98 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.695 1.198 . . . . 0.0 108.954 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 20' ' ' VAL . 42.1 t -55.28 -42.53 66.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-N 113.53 -1.668 . . . . 0.0 112.996 -170.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.12 19.4 19.62 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 171.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.28 0.7 OUTLIER 65.47 11.65 7.56 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 129.459 3.104 . . . . 0.0 118.731 176.723 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.73 42.08 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 110.57 -3.014 . . . . 0.0 116.096 -173.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.275 69.7 m 58.14 -44.45 0.05 Allowed 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 117.906 2.558 . . . . 0.0 117.906 -165.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -152.68 101.32 2.62 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.276 4.2 p -132.04 147.82 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -57.21 143.09 40.53 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -172.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.35 -67.16 0.31 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -40.63 66.77 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -177.123 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.556 ' O ' HG23 ' A' ' 38' ' ' VAL . 36.8 m -56.95 -52.47 65.09 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 113.058 -1.883 . . . . 0.0 106.938 177.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm105 -61.39 -48.55 80.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.792 1.237 . . . . 0.0 114.265 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.11 86.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.294 1.837 . . . . 0.0 114.826 -176.122 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -75.43 -42.84 52.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 112.059 -2.337 . . . . 0.0 110.761 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.568 HG21 HG21 ' A' ' 23' ' ' VAL . 38.9 t -63.78 -49.83 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 CA-C-N 114.187 -1.37 . . . . 0.0 107.76 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.39 -46.42 73.08 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 126.661 1.985 . . . . 0.0 112.599 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.61 80.75 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 112.361 -2.2 . . . . 0.0 111.134 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.23 -39.97 80.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.584 -2.098 . . . . 0.0 113.293 173.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 30.5 mtt -61.01 -52.11 66.39 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -172.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.28 -41.33 85.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.254 -1.793 . . . . 0.0 113.673 174.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -59.46 -37.83 79.2 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 113.402 -1.726 . . . . 0.0 113.45 -178.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.516 HD22 ' OD2' ' A' ' 8' ' ' ASP . 52.9 mt -91.99 26.06 2.6 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 52.38 33.6 13.28 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.82 1.772 . . . . 0.0 114.139 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 66.3 t80 -101.45 -177.49 3.45 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.423 1.489 . . . . 0.0 109.751 -174.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 47' ' ' TYR 0.258 0.0 OUTLIER -145.39 113.37 4.76 Favored Pre-proline 0 N--CA 1.485 1.31 0 CA-C-O 117.374 -1.298 . . . . 0.0 108.683 -177.24 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 48' ' ' ILE . 82.2 Cg_exo -54.38 34.79 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.454 2 N-CA-C 124.685 4.84 . . . . 0.0 124.685 -170.487 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.28 16.09 2.05 Favored 'General case' 0 N--CA 1.489 1.513 1 N-CA-C 121.998 4.073 . . . . 0.0 121.998 176.626 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.465 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.1 OUTLIER 33.31 74.96 0.05 Allowed 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 122.605 1.193 . . . . 0.0 111.247 -169.144 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.79 107.1 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 -170.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -40.06 125.45 1.97 Allowed 'General case' 0 N--CA 1.506 2.358 0 CA-C-O 123.695 1.712 . . . . 0.0 111.846 167.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.507 ' HG3' ' HG2' ' A' ' 1' ' ' MET . 0.9 OUTLIER 4.84 70.2 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 119.218 3.044 . . . . 0.0 119.218 -155.769 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.298 1.7 mp0 69.71 -25.01 0.15 Allowed 'General case' 0 N--CA 1.498 1.958 0 CA-C-N 110.785 -2.916 . . . . 0.0 115.757 172.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.0 tp . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 152.336 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.3 mtt . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.826 ' HG2' ' H ' ' A' ' 55' ' ' GLN . 1.0 OUTLIER -174.27 156.21 2.35 Favored Pre-proline 0 CA--C 1.563 1.452 0 C-N-CA 127.398 2.279 . . . . 0.0 108.583 179.481 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.472 ' HD3' ' HG3' ' A' ' 51' ' ' ARG . 23.4 Cg_exo -95.97 -25.58 0.11 Allowed 'Trans proline' 0 N--CA 1.488 1.178 0 CA-C-N 123.797 2.392 . . . . 0.0 115.426 -170.304 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER -155.02 137.78 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 -167.544 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.2 p -61.45 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 174.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.638 HD12 HE22 ' A' ' 55' ' ' GLN . 17.7 mt -35.17 -16.89 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.347 0 N-CA-C 119.596 3.184 . . . . 0.0 119.596 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.488 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 52.0 m-85 -53.34 -33.89 55.35 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.407 0.683 . . . . 0.0 110.899 164.255 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.455 ' OD2' HD22 ' A' ' 45' ' ' LEU . 14.1 t70 -57.23 -50.6 72.37 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 172.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.419 ' HA ' HD13 ' A' ' 45' ' ' LEU . 84.6 t -59.95 -43.12 91.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 123.252 0.621 . . . . 0.0 112.592 173.52 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.78 -55.11 39.4 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 112.065 -2.334 . . . . 0.0 112.175 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.488 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.9 OUTLIER -66.24 -40.59 90.33 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.717 2.007 . . . . 0.0 115.049 177.508 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -65.22 -35.76 82.05 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.964 0.887 . . . . 0.0 110.73 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.11 -19.33 27.17 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 113.632 -1.622 . . . . 0.0 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 26.19 57.93 Favored Glycine 0 CA--C 1.545 1.951 0 C-N-CA 126.793 2.139 . . . . 0.0 113.001 172.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.6 p -119.56 126.4 75.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 125.325 1.45 . . . . 0.0 110.605 -171.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.2 p -28.3 121.4 0.12 Allowed 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 129.154 2.982 . . . . 0.0 110.476 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -44.46 -45.1 8.97 Favored 'General case' 0 N--CA 1.521 3.091 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.426 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.665 0.6 OUTLIER -56.56 -18.63 12.4 Favored 'General case' 0 C--N 1.321 -0.643 1 N-CA-C 125.265 5.283 . . . . 0.0 125.265 176.22 . . . . . . . . 5 4 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.485 ' O ' HG23 ' A' ' 23' ' ' VAL . 71.0 p -64.66 -53.01 54.13 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 113.714 -1.584 . . . . 0.0 113.65 159.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.615 ' O ' HG23 ' A' ' 24' ' ' VAL 0.25 80.1 t -60.99 -50.86 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 O-C-N 121.106 -0.996 . . . . 0.0 110.87 -164.298 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.29 13.8 m -59.76 -35.18 74.08 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -179.27 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 19' ' ' THR . 11.2 mtt85 -67.23 -42.73 83.54 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 112.055 -2.339 . . . . 0.0 117.103 170.098 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.737 HG11 HG21 ' A' ' 38' ' ' VAL . 75.7 t -60.63 -43.13 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 125.813 1.645 . . . . 0.0 108.161 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.2 t -49.04 -49.45 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.289 0 O-C-N 125.708 1.88 . . . . 0.0 111.416 -171.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.377 81.8 m-20 -106.46 29.85 6.51 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 35.9 tt0 61.05 17.76 8.3 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 129.493 3.117 . . . . 0.0 115.604 170.372 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.58 39.88 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 111.735 -2.484 . . . . 0.0 116.998 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.257 86.1 p 61.01 -56.72 0.09 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 126.313 1.845 . . . . 0.0 113.663 -163.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.288 98.8 m-70 -138.26 115.49 11.04 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.969 167.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 p -127.17 156.11 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 172.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.9 p -54.63 134.71 47.01 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 174.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.99 -53.28 57.83 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -175.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -48.4 -41.71 29.79 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.442 ' O ' HG23 ' A' ' 38' ' ' VAL . 27.9 m -56.46 -48.72 76.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 114.271 -1.331 . . . . 0.0 107.881 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 2.4 mmm180 -59.22 -42.64 91.46 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 117.72 2.489 . . . . 0.0 117.72 177.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -36.07 76.13 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 113.479 -1.691 . . . . 0.0 115.445 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -77.99 -44.56 26.3 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 111.949 -2.387 . . . . 0.0 111.283 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.737 HG21 HG11 ' A' ' 23' ' ' VAL . 41.6 t -64.25 -45.36 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 113.803 -1.544 . . . . 0.0 108.636 177.285 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 51.9 mt-10 -58.44 -42.09 86.53 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.565 3.146 . . . . 0.0 112.985 -177.654 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -52.03 65.06 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 112.585 -2.098 . . . . 0.0 109.843 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.66 -38.15 74.6 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 113.285 -1.78 . . . . 0.0 114.999 175.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.449 ' SD ' ' HG3' ' A' ' 49' ' ' PRO . 36.3 mtt -59.81 -53.21 60.61 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -173.161 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.04 94.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 113.07 -1.877 . . . . 0.0 112.386 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.42 -37.29 86.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 112.619 -2.082 . . . . 0.0 113.732 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.455 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.5 mt -98.75 20.76 12.46 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 126.455 1.902 . . . . 0.0 113.539 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 56.72 25.24 9.91 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 116.52 2.045 . . . . 0.0 116.52 175.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.536 ' OH ' HD11 ' A' ' 6' ' ' LEU . 54.4 t80 -86.82 170.83 11.35 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.294 -172.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.25 113.41 3.84 Favored Pre-proline 0 CA--C 1.547 0.836 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.861 -170.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.449 ' HG3' ' SD ' ' A' ' 42' ' ' MET . 5.3 Cg_exo -68.6 57.77 1.03 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.615 2.21 . . . . 0.0 117.39 -171.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -175.46 83.75 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 113.737 -1.574 . . . . 0.0 110.419 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.472 ' HG3' ' HD3' ' A' ' 3' ' ' PRO 0.461 0.0 OUTLIER -124.91 87.57 2.74 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.848 -1.157 . . . . 0.0 110.824 -174.711 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.385 9.9 m -50.28 -48.43 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 N-CA-C 117.843 2.534 . . . . 0.0 117.843 -170.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -104.92 58.84 0.69 Allowed 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 124.339 2.018 . . . . 0.0 107.972 -175.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . 0.29 0.1 OUTLIER -55.04 113.34 1.32 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 111.224 -2.717 . . . . 0.0 113.674 -175.393 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.826 ' H ' ' HG2' ' A' ' 2' ' ' LYS . 2.0 mp0 58.92 30.44 20.17 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 110.962 -2.835 . . . . 0.0 113.632 -178.128 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.3 mt . . . . . 0 N--CA 1.474 0.727 0 CA-C-N 112.775 -2.012 . . . . 0.0 114.281 172.293 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.572 ' HA ' HE22 ' A' ' 55' ' ' GLN 0.303 15.3 ptt? . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.635 ' HZ2' ' HB3' ' A' ' 53' ' ' ALA . 10.5 mttt -155.41 146.81 16.79 Favored Pre-proline 0 CA--C 1.554 1.102 0 CA-C-O 118.14 -0.933 . . . . 0.0 111.367 175.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -46.63 140.2 12.61 Favored 'Trans proline' 0 CA--C 1.551 1.34 0 C-N-CA 124.012 3.141 . . . . 0.0 117.146 -135.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.476 ' O ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER 52.22 -6.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.728 1 N-CA-C 122.388 4.218 . . . . 0.0 122.388 171.011 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 4' ' ' VAL 0.31 7.0 t 71.82 149.59 0.09 Allowed 'General case' 0 N--CA 1.491 1.602 1 C-N-CA 133.92 4.888 . . . . 0.0 117.587 -177.862 . . . . . . . . 4 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.511 HD11 ' HG2' ' A' ' 51' ' ' ARG . 33.9 mt -62.55 -27.85 69.45 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -175.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -58.1 -37.54 74.71 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.876 0.871 . . . . 0.0 109.695 172.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.538 ' OD2' HD22 ' A' ' 45' ' ' LEU . 22.6 t70 -64.94 -49.51 70.08 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.885 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -43.34 90.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.404 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -57.1 -46.53 82.5 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.415 1.886 . . . . 0.0 113.214 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.54 -43.96 71.9 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 126.315 1.846 . . . . 0.0 115.673 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.43 ' CB ' HD11 ' A' ' 45' ' ' LEU . 37.5 t80 -64.55 -33.22 75.4 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.559 0.695 . . . . 0.0 110.546 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.38 -20.64 23.73 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.555 -1.657 . . . . 0.0 111.568 -179.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.18 27.9 61.18 Favored Glycine 0 N--CA 1.489 2.229 0 C-N-CA 125.524 1.535 . . . . 0.0 112.773 171.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.424 HG22 HG21 ' A' ' 19' ' ' THR 0.255 8.6 p -132.28 120.94 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.476 0.71 . . . . 0.0 109.727 -167.945 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.6 p -26.35 139.67 0.01 OUTLIER 'General case' 0 N--CA 1.524 3.27 0 C-N-CA 128.233 2.613 . . . . 0.0 110.623 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 6' ' ' LEU . 66.1 t80 -54.51 -34.8 62.31 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 119.483 -2.011 . . . . 0.0 114.728 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -53.51 -44.69 69.29 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.909 0.756 . . . . 0.0 111.62 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' HG23 ' A' ' 23' ' ' VAL . 36.6 m -55.13 -52.53 62.98 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.958 1.303 . . . . 0.0 111.127 176.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.65 ' O ' HG23 ' A' ' 24' ' ' VAL . 76.9 t -65.33 -50.83 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.393 -0.813 . . . . 0.0 110.911 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.384 7.6 m -63.15 -31.15 72.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 118.453 2.76 . . . . 0.0 118.453 -178.143 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.6 mtp85 -60.01 -48.85 80.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.356 -2.657 . . . . 0.0 115.121 164.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 38' ' ' VAL . 69.8 t -59.72 -45.11 94.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 124.949 1.3 . . . . 0.0 108.797 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 20' ' ' VAL . 94.8 t -53.14 -44.69 52.64 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 112.753 -2.021 . . . . 0.0 112.108 -171.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.285 96.1 m-20 -104.22 25.82 9.6 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 173.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.438 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER 58.87 19.99 7.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.668 2.787 . . . . 0.0 115.997 172.265 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.79 45.64 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 111.371 -2.65 . . . . 0.0 116.699 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 88.5 p 59.44 -52.93 0.06 Allowed 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 126.129 1.772 . . . . 0.0 114.802 -162.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.8 m170 -138.44 117.15 12.25 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.438 HG12 ' OE1' ' A' ' 26' ' ' GLN . 3.3 p -118.18 147.56 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 p -61.92 139.43 58.39 Favored 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.43 -66.53 0.39 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB2' ' HZ2' ' A' ' 33' ' ' LYS 0.271 0.0 OUTLIER -52.94 -34.07 53.74 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -179.317 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -62.48 -50.89 69.65 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -57.69 -46.91 83.7 Favored 'General case' 0 N--CA 1.434 -1.254 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 175.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.03 -36.35 65.42 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -175.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -74.56 -44.61 50.18 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.748 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 23' ' ' VAL . 61.1 t -66.6 -50.01 70.03 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 113.677 -1.602 . . . . 0.0 109.606 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -49.77 -45.59 49.82 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.648 3.179 . . . . 0.0 111.394 178.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.15 77.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 111.404 -2.634 . . . . 0.0 110.887 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.61 -46.67 88.82 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 113.356 -1.747 . . . . 0.0 114.965 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.55 -45.41 81.26 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.342 1.857 . . . . 0.0 113.662 -177.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.42 78.58 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.177 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.42 -43.28 94.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 112.612 -2.085 . . . . 0.0 113.104 -177.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.538 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.0 mt -81.15 14.09 2.5 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.333 1.2 p-10 50.28 41.85 24.88 Favored 'General case' 0 CA--C 1.574 1.893 0 CA-C-O 122.777 1.275 . . . . 0.0 113.338 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -105.11 179.41 4.28 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 114.83 -1.077 . . . . 0.0 108.916 -173.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.272 0.0 OUTLIER -148.73 108.65 3.53 Favored Pre-proline 0 N--CA 1.481 1.082 0 O-C-N 121.36 -0.838 . . . . 0.0 112.1 -174.976 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -47.82 104.04 0.07 OUTLIER 'Trans proline' 0 CA--C 1.555 1.534 1 C-N-CA 125.408 4.072 . . . . 0.0 111.321 -176.332 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.592 ' ND2' ' H ' ' A' ' 53' ' ' ALA . 27.5 p-10 172.15 -57.31 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 125.59 1.556 . . . . 0.0 114.061 168.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.511 ' HG2' HD11 ' A' ' 6' ' ' LEU 0.352 13.0 tpp85 71.72 -28.18 0.18 Allowed 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 126.912 2.085 . . . . 0.0 115.388 -173.781 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 9.5 p -66.08 -31.12 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 1 N-CA-C 123.365 4.58 . . . . 0.0 123.365 -179.348 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.635 ' HB3' ' HZ2' ' A' ' 2' ' ' LYS . . . -86.23 65.14 8.93 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-O 122.974 1.368 . . . . 0.0 110.412 -178.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 13.2 mt-30 -74.78 107.5 6.91 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 112.484 -2.143 . . . . 0.0 114.519 -173.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.572 HE22 ' HA ' ' A' ' 1' ' ' MET . 3.8 mp0 56.82 20.25 5.06 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 125.635 1.835 . . . . 0.0 113.7 -164.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.9 tp . . . . . 0 N--CA 1.479 1.02 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.869 -171.564 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.444 ' HA ' ' O ' ' A' ' 55' ' ' GLN . 58.0 mtt . . . . . 0 N--CA 1.485 1.295 0 N-CA-C 116.633 2.086 . . . . 0.0 116.633 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.435 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -167.51 155.5 8.51 Favored Pre-proline 0 CA--C 1.563 1.456 0 CA-C-O 115.991 -1.957 . . . . 0.0 110.584 -179.124 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -45.73 -43.7 18.57 Favored 'Trans proline' 0 N--CA 1.488 1.172 0 C-N-CA 123.435 2.756 . . . . 0.0 117.612 -157.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.8 OUTLIER -152.06 140.44 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 -177.716 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.307 2.7 p -71.07 94.14 1.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 105.616 -1.994 . . . . 0.0 105.616 -175.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.423 ' H ' ' HE3' ' A' ' 2' ' ' LYS . 28.9 mt -27.87 -16.66 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 1 N-CA-C 123.028 4.455 . . . . 0.0 123.028 177.547 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -56.5 -36.45 69.17 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 118.97 0.805 . . . . 0.0 111.158 165.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.02 -52.25 59.06 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 172.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.22 -45.93 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.166 0.987 . . . . 0.0 112.387 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.45 79.4 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.238 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -44.48 76.67 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 115.296 175.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.449 ' CB ' HD11 ' A' ' 45' ' ' LEU . 52.4 t80 -63.59 -33.53 75.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.993 1.317 . . . . 0.0 111.248 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.63 -15.35 25.44 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.92 -1.491 . . . . 0.0 111.21 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.95 26.69 68.32 Favored Glycine 0 N--CA 1.494 2.504 0 C-N-CA 125.949 1.738 . . . . 0.0 112.6 171.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.447 HG22 HG21 ' A' ' 19' ' ' THR . 8.5 p -131.78 117.68 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.478 1.111 . . . . 0.0 108.441 -168.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.7 p -22.24 142.87 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.984 0 C-N-CA 127.066 2.146 . . . . 0.0 112.73 -174.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.25 83.3 t80 -50.73 -42.89 57.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 119.919 -1.738 . . . . 0.0 114.295 171.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -52.52 -41.9 63.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 123.872 0.733 . . . . 0.0 112.754 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 23' ' ' VAL . 46.4 m -56.55 -51.86 66.97 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.75 175.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 24' ' ' VAL 0.328 86.9 t -64.91 -45.39 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 118.085 -0.959 . . . . 0.0 112.4 -173.599 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 3.7 m -63.57 -36.0 82.36 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -178.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -60.17 -47.45 85.89 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 167.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.78 HG11 HG21 ' A' ' 38' ' ' VAL . 73.3 t -59.98 -39.59 80.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.668 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.9 t -53.06 -50.94 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 CA-C-N 113.898 -1.501 . . . . 0.0 112.293 -171.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -84.45 7.46 19.68 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 171.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.557 ' HG2' ' HD3' ' A' ' 35' ' ' ARG . 0.9 OUTLIER 62.66 14.24 7.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 128.091 2.557 . . . . 0.0 113.781 -177.006 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.05 42.53 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 111.937 -2.392 . . . . 0.0 115.967 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.4 m 56.25 -36.1 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -165.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.281 79.1 m80 -157.29 103.25 1.97 Allowed 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 -178.14 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.98 156.88 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 120.093 -1.629 . . . . 0.0 114.53 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -60.57 136.26 58.0 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.435 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . . . -55.21 -53.84 50.96 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -175.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HE2' ' HB3' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -54.32 -38.97 66.59 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 177.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.7 m -62.07 -52.02 65.63 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.557 ' HD3' ' HG2' ' A' ' 26' ' ' GLN . 3.6 mtm105 -56.82 -45.07 82.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -61.38 -35.71 78.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.141 -1.845 . . . . 0.0 114.039 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -75.63 -42.12 52.44 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 111.712 -2.494 . . . . 0.0 111.046 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.78 HG21 HG11 ' A' ' 23' ' ' VAL . 46.3 t -61.77 -48.37 88.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 125.347 1.459 . . . . 0.0 107.399 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -55.02 -41.33 71.18 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 128.105 2.562 . . . . 0.0 113.78 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.42 -51.04 61.08 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 111.698 -2.501 . . . . 0.0 111.447 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.29 -43.41 88.02 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 113.689 -1.596 . . . . 0.0 113.936 178.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.551 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -58.02 -47.55 82.74 Favored 'General case' 0 CA--C 1.598 2.805 0 C-N-CA 128.805 2.842 . . . . 0.0 111.297 -176.926 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.01 82.9 Favored 'General case' 0 C--N 1.318 -0.767 0 O-C-N 126.439 2.337 . . . . 0.0 111.771 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -65.99 -41.41 91.15 Favored 'General case' 0 CA--C 1.586 2.346 0 C-N-CA 126.447 1.899 . . . . 0.0 111.94 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.449 HD11 ' CB ' ' A' ' 12' ' ' TYR . 56.4 mt -88.54 13.21 12.54 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.689 1.996 . . . . 0.0 114.649 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.267 2.2 p-10 56.76 32.33 21.05 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-N 114.202 -1.363 . . . . 0.0 114.535 176.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.551 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 6.7 t80 -94.79 174.28 7.18 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -175.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -147.92 115.76 4.08 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-O 118.367 -0.825 . . . . 0.0 109.138 -178.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -37.76 145.68 0.13 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 124.275 3.317 . . . . 0.0 114.402 -177.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 m120 36.79 37.68 0.07 Allowed 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 121.335 3.828 . . . . 0.0 121.335 -168.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.602 ' NH1' HE22 ' A' ' 55' ' ' GLN . 2.7 mmm180 -92.16 69.35 5.24 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.97 171.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.5 m -64.98 167.56 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.515 2.776 0 CA-C-N 112.517 -2.129 . . . . 0.0 111.005 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.65 113.8 1.98 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.994 -1.066 . . . . 0.0 113.307 171.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -127.17 -50.7 1.42 Allowed 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 113.287 -1.779 . . . . 0.0 110.549 -174.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.602 HE22 ' NH1' ' A' ' 51' ' ' ARG 0.265 7.0 mp0 -69.37 115.21 8.38 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 122.79 1.281 . . . . 0.0 114.37 166.898 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.4 tp . . . . . 0 CA--C 1.551 0.988 0 CA-C-N 112.859 -1.973 . . . . 0.0 114.608 -168.828 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.357 0 N-CA-C 118.312 2.708 . . . . 0.0 118.312 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.428 ' C ' ' H ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -165.52 5.51 0.0 OUTLIER Pre-proline 0 CA--C 1.562 1.408 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -174.81 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . 0.399 0.2 OUTLIER -1.73 -23.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.95 2 N-CA-C 126.923 5.701 . . . . 0.0 126.923 -130.266 . . . . . . . . 4 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.428 ' H ' ' C ' ' A' ' 2' ' ' LYS 0.466 0.4 OUTLIER -143.84 148.83 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 127.052 2.141 . . . . 0.0 106.517 -172.228 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.258 1.6 p -68.94 90.71 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.9 mt -34.99 -14.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 -175.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -56.24 -29.94 61.72 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.183 0.901 . . . . 0.0 112.826 164.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -54.86 -50.56 68.36 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 168.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.41 -44.21 95.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 123.09 0.556 . . . . 0.0 111.889 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.1 -48.7 80.63 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.17 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -42.41 88.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.519 1.928 . . . . 0.0 114.902 176.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.47 ' CB ' HD11 ' A' ' 45' ' ' LEU . 41.6 t80 -66.52 -32.68 74.19 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.913 1.285 . . . . 0.0 111.434 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.63 -8.24 47.77 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.686 1.194 . . . . 0.0 111.674 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.59 20.53 79.83 Favored Glycine 0 N--CA 1.496 2.7 0 C-N-CA 126.92 2.2 . . . . 0.0 113.04 171.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.23 127.19 65.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.239 0.616 . . . . 0.0 112.253 -164.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -27.95 128.72 0.06 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 127.717 2.407 . . . . 0.0 110.53 176.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -42.81 -36.0 1.34 Allowed 'General case' 0 N--CA 1.521 3.111 0 C-N-CA 124.998 1.319 . . . . 0.0 114.111 177.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -51.18 -43.67 61.37 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.247 177.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . 46.9 p -59.19 -54.31 48.34 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 176.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.506 ' O ' HG23 ' A' ' 24' ' ' VAL . 87.5 t -61.33 -49.64 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 125.248 1.419 . . . . 0.0 109.951 -172.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.0 p -53.54 -47.06 70.33 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.381 1.473 . . . . 0.0 113.674 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -60.37 -45.66 92.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 110.754 -2.93 . . . . 0.0 116.985 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.645 HG21 HG21 ' A' ' 38' ' ' VAL . 94.4 t -62.55 -39.88 86.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.242 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 20' ' ' VAL . 78.2 t -51.55 -55.09 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 113.312 -1.767 . . . . 0.0 112.486 -175.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.291 34.3 m120 -92.29 22.87 4.19 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 175.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 20.4 tt0 67.09 1.2 2.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 128.349 2.66 . . . . 0.0 117.433 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.21 35.81 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 111.675 -2.511 . . . . 0.0 116.827 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 59.24 -43.95 0.07 Allowed 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 117.97 2.582 . . . . 0.0 117.97 -167.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.274 69.3 m80 -152.49 103.59 2.83 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -174.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -123.29 151.7 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 171.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 p -67.48 145.93 54.48 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 -175.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.411 ' HB1' ' OE2' ' A' ' 36' ' ' GLU . . . -46.1 -73.87 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.569 ' H ' ' HE2' ' A' ' 33' ' ' LYS 0.292 0.0 OUTLIER -51.21 -28.9 12.56 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 119.832 3.271 . . . . 0.0 119.832 179.564 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 23.7 m -65.05 -56.97 9.96 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 175.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtm105 -55.35 -51.35 67.07 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.411 ' OE2' ' HB1' ' A' ' 32' ' ' ALA . 0.4 OUTLIER -54.65 -34.64 62.48 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -175.672 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.19 -51.06 11.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.806 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.645 HG21 HG21 ' A' ' 23' ' ' VAL . 48.5 t -58.8 -46.39 90.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 125.86 1.664 . . . . 0.0 108.177 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.0 -44.11 91.61 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.147 2.179 . . . . 0.0 116.208 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.9 -50.01 70.41 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.626 -2.079 . . . . 0.0 110.511 174.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.15 -37.88 75.53 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 112.283 -2.235 . . . . 0.0 114.866 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 35.0 mtt -59.56 -51.29 70.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.21 -40.38 95.91 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 112.43 -2.168 . . . . 0.0 111.818 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.13 -41.07 95.15 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.783 -2.008 . . . . 0.0 113.495 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.47 HD11 ' CB ' ' A' ' 12' ' ' TYR . 63.1 mt -98.94 25.14 6.93 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 127.031 2.132 . . . . 0.0 112.24 -175.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.41 21.12 10.75 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 117.698 2.481 . . . . 0.0 117.698 173.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -87.93 159.64 18.26 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.518 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.21 104.9 7.21 Favored Pre-proline 0 N--CA 1.478 0.944 0 CA-C-N 112.347 -2.206 . . . . 0.0 108.504 -171.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.502 ' O ' ' HB2' ' A' ' 50' ' ' ASN . 12.3 Cg_exo -36.14 109.61 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.68 1 C-N-CA 125.771 4.314 . . . . 0.0 113.499 -173.479 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.502 ' HB2' ' O ' ' A' ' 49' ' ' PRO . 5.2 m-20 134.35 -53.28 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 C-N-CA 127.512 2.325 . . . . 0.0 113.904 157.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -4.82 89.68 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 127.129 2.172 . . . . 0.0 111.294 161.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.3 m -63.28 142.83 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -148.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.72 75.12 3.38 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 124.232 1.968 . . . . 0.0 113.627 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.446 ' HB2' ' NE2' ' A' ' 55' ' ' GLN . 95.4 mt-30 -119.12 -47.82 2.46 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 111.521 -2.581 . . . . 0.0 108.746 177.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.446 ' NE2' ' HB2' ' A' ' 54' ' ' GLN . 0.3 OUTLIER -90.86 84.4 5.81 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 124.265 1.983 . . . . 0.0 110.655 172.236 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.657 ' H ' HD12 ' A' ' 56' ' ' LEU . 1.3 mp . . . . . 0 N--CA 1.48 1.026 0 CA-C-N 110.535 -3.03 . . . . 0.0 115.461 -157.939 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.451 ' HB2' ' HG3' ' A' ' 55' ' ' GLN . 91.7 mtp . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 116.182 1.919 . . . . 0.0 116.182 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.758 ' HB2' ' HG2' ' A' ' 55' ' ' GLN . 11.9 mttm -164.51 -170.06 0.23 Allowed Pre-proline 0 CA--C 1.562 1.437 0 CA-C-O 116.44 -1.743 . . . . 0.0 110.244 175.598 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -58.13 94.49 0.07 OUTLIER 'Trans proline' 0 C--N 1.359 1.102 0 CA-C-N 122.674 1.991 . . . . 0.0 109.335 153.084 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.4 OUTLIER 68.96 112.61 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 127.403 2.281 . . . . 0.0 112.765 165.554 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -77.31 145.26 37.5 Favored 'General case' 0 CA--C 1.556 1.204 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 -169.15 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.607 HD12 HH22 ' A' ' 51' ' ' ARG . 14.2 mt -61.92 0.92 0.32 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 121.429 3.863 . . . . 0.0 121.429 -155.236 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -58.37 -38.18 76.76 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 119.539 1.063 . . . . 0.0 110.997 174.729 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.435 ' OD1' HD22 ' A' ' 45' ' ' LEU . 4.6 t70 -61.69 -46.96 87.48 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 114.935 -1.03 . . . . 0.0 113.14 173.566 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.23 -45.36 96.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.463 1.105 . . . . 0.0 112.827 174.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.458 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -55.12 -54.0 48.74 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.026 2.13 . . . . 0.0 112.35 176.247 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.28 -37.96 86.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.126 1.371 . . . . 0.0 114.266 177.855 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -67.98 -34.41 76.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 123.505 0.503 . . . . 0.0 110.317 179.34 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.57 -19.55 27.67 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.277 178.583 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.56 29.17 53.49 Favored Glycine 0 N--CA 1.486 2.016 0 C-N-CA 127.007 2.241 . . . . 0.0 113.704 174.28 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.296 8.5 p -130.21 130.58 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.623 0 C-N-CA 123.563 0.745 . . . . 0.0 109.12 -175.706 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.6 p -44.29 142.17 1.61 Allowed 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 128.658 2.783 . . . . 0.0 110.381 -173.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.483 ' CE1' ' HB2' ' A' ' 6' ' ' LEU . 74.3 t80 -48.84 -47.94 42.15 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 117.489 2.403 . . . . 0.0 117.489 -170.105 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.424 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.558 0.0 OUTLIER -56.57 -25.34 52.1 Favored 'General case' 0 C--N 1.322 -0.607 1 N-CA-C 124.359 4.948 . . . . 0.0 124.359 179.835 . . . . . . . . 5 4 . 1 . 021 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.55 ' O ' HG23 ' A' ' 23' ' ' VAL . 5.1 m -58.13 -53.13 61.74 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 111.608 -2.542 . . . . 0.0 111.512 165.501 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.558 ' O ' HG23 ' A' ' 24' ' ' VAL . 95.0 t -63.77 -49.57 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.46 -169.462 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.431 ' HA ' HH12 ' A' ' 51' ' ' ARG 0.446 1.0 OUTLIER -58.32 -37.95 76.14 Favored 'General case' 0 CA--C 1.466 -2.278 0 N-CA-C 119.106 3.002 . . . . 0.0 119.106 176.247 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.55 ' HG3' HH11 ' A' ' 22' ' ' ARG . 2.5 mtt85 -63.54 -44.38 94.35 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 110.412 -3.086 . . . . 0.0 114.78 169.012 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.678 HG11 HG21 ' A' ' 38' ' ' VAL . 99.4 t -61.19 -42.87 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.091 -1.413 . . . . 0.0 110.342 -176.6 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 20' ' ' VAL . 96.5 t -54.88 -50.01 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 112.899 -1.955 . . . . 0.0 112.395 -168.292 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -91.72 17.48 8.89 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 171.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.454 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.4 OUTLIER 67.49 11.74 8.53 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.99 2.916 . . . . 0.0 114.85 172.326 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.9 40.03 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 127.723 2.409 . . . . 0.0 116.441 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.6 p 57.91 -34.67 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -160.227 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -157.6 99.32 1.72 Allowed 'General case' 0 CA--C 1.564 1.487 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -168.57 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.454 HG12 ' OE1' ' A' ' 26' ' ' GLN 0.258 4.6 p -137.96 152.88 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 175.551 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.5 p -61.29 145.32 51.8 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -173.72 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.36 -63.83 1.0 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.574 1.949 . . . . 0.0 113.359 -177.323 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 33' ' ' LYS 0.254 11.6 tptp -56.96 -42.01 79.35 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.885 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.6 m -57.82 -50.49 73.09 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 113.344 -1.753 . . . . 0.0 108.054 178.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.56 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 15.8 mtm105 -57.05 -48.88 77.47 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 174.567 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.47 -34.47 74.07 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 113.708 -1.587 . . . . 0.0 114.896 -176.199 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -78.47 -43.19 27.72 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.212 2.205 . . . . 0.0 111.001 -179.434 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.678 HG21 HG11 ' A' ' 23' ' ' VAL . 81.3 t -63.24 -46.79 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.095 174.909 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 31.9 mt-10 -52.76 -45.51 67.12 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 126.452 1.901 . . . . 0.0 111.966 179.083 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.56 -52.5 60.8 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 110.582 -3.008 . . . . 0.0 111.037 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.33 -52.16 65.82 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 112.85 -1.977 . . . . 0.0 115.674 178.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.543 ' HB2' ' HB3' ' A' ' 47' ' ' TYR 0.264 0.0 OUTLIER -59.98 -33.32 71.8 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -178.111 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.91 -50.62 63.82 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.542 179.471 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -62.76 -33.77 75.85 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.521 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.435 HD22 ' OD1' ' A' ' 8' ' ' ASP . 62.0 mt -99.14 14.64 28.66 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.425 2.29 . . . . 0.0 116.951 -177.974 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.353 0.2 OUTLIER 54.48 19.33 2.31 Favored 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 127.127 2.171 . . . . 0.0 116.776 176.309 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.543 ' HB3' ' HB2' ' A' ' 42' ' ' MET . 62.3 t80 -82.99 95.4 8.0 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.977 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.518 HD12 ' OD1' ' A' ' 50' ' ' ASN . 0.4 OUTLIER -51.67 124.32 26.08 Favored Pre-proline 0 N--CA 1.484 1.273 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 172.509 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -68.43 71.35 0.95 Allowed 'Trans proline' 0 CA--C 1.55 1.316 0 C-N-CA 122.972 2.448 . . . . 0.0 112.832 176.15 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.518 ' OD1' HD12 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -160.51 58.42 0.33 Allowed 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 123.467 1.603 . . . . 0.0 115.239 170.847 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.607 HH22 HD12 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -63.8 96.46 0.13 Allowed 'General case' 0 C--O 1.242 0.693 0 O-C-N 119.619 -1.926 . . . . 0.0 115.65 -160.961 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.639 HG22 ' HE2' ' A' ' 2' ' ' LYS . 8.4 m -69.6 68.52 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 126.864 2.066 . . . . 0.0 108.456 -174.628 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 98.71 -175.32 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 C-N-CA 128.048 2.539 . . . . 0.0 106.2 -176.904 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.588 ' HA ' ' HE ' ' A' ' 51' ' ' ARG . 30.3 tt0 -87.88 94.48 9.78 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 120.995 -1.066 . . . . 0.0 109.959 -175.959 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.758 ' HG2' ' HB2' ' A' ' 2' ' ' LYS 0.337 21.7 mp0 -54.7 86.06 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 117.914 2.561 . . . . 0.0 117.914 165.921 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 CA--C 1.542 0.654 0 CA-C-N 110.876 -2.875 . . . . 0.0 114.561 -178.085 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.609 ' HB2' ' HA ' ' A' ' 5' ' ' THR . 19.1 ptp . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.486 ' HB3' ' HD3' ' A' ' 3' ' ' PRO 0.26 43.8 tptt -69.28 -48.42 26.13 Favored Pre-proline 0 N--CA 1.489 1.521 0 CA-C-O 117.484 -1.246 . . . . 0.0 113.743 -175.17 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.486 ' HD3' ' HB3' ' A' ' 2' ' ' LYS . 45.5 Cg_exo -63.5 -27.18 70.09 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 C-N-CA 122.651 2.234 . . . . 0.0 117.13 173.019 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.331 0.3 OUTLIER -170.9 143.87 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.473 1.509 . . . . 0.0 108.795 -173.43 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.609 ' HA ' ' HB2' ' A' ' 1' ' ' MET . 2.5 p -75.85 120.63 21.47 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-N 120.878 1.672 . . . . 0.0 109.246 176.395 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.412 HD22 HG12 ' A' ' 20' ' ' VAL . 15.8 mt -31.35 -28.82 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.88 0 N-CA-C 121.27 3.804 . . . . 0.0 121.27 -178.215 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -54.2 -37.06 64.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.414 0.686 . . . . 0.0 109.152 173.353 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.463 ' OD2' HD22 ' A' ' 45' ' ' LEU . 21.7 t70 -60.58 -41.32 94.41 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 118.555 -0.736 . . . . 0.0 111.791 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.0 t -62.45 -50.82 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 170.813 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -48.75 -48.89 40.46 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.986 1.315 . . . . 0.0 112.19 175.823 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.54 -44.42 70.98 Favored 'General case' 0 C--N 1.316 -0.861 1 C-N-CA 132.539 4.335 . . . . 0.0 113.49 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.428 ' CB ' HD11 ' A' ' 45' ' ' LEU . 54.3 t80 -63.97 -34.59 78.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.022 0.929 . . . . 0.0 110.538 174.031 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.02 -12.5 38.39 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.522 -177.282 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.58 28.87 66.63 Favored Glycine 0 N--CA 1.495 2.599 0 C-N-CA 125.981 1.753 . . . . 0.0 113.82 177.115 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.405 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 9.3 p -124.85 142.22 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 122.49 1.138 . . . . 0.0 110.167 -170.409 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -55.82 128.69 36.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 129.328 3.051 . . . . 0.0 107.442 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -53.2 -31.67 44.19 Favored 'General case' 0 N--CA 1.509 2.487 0 N-CA-C 118.125 2.639 . . . . 0.0 118.125 -167.035 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -49.2 -44.56 43.25 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.354 -1.307 . . . . 0.0 113.827 175.626 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.637 ' O ' HG23 ' A' ' 23' ' ' VAL . 44.7 p -52.59 -48.82 66.01 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 124.018 0.824 . . . . 0.0 112.548 178.376 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.67 ' O ' HG23 ' A' ' 24' ' ' VAL . 85.4 t -68.46 -52.1 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 113.802 -1.545 . . . . 0.0 110.187 -174.925 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.8 m -59.05 -32.01 69.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.9 mtp85 -65.53 -46.98 77.47 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 111.26 -2.7 . . . . 0.0 113.937 170.898 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.773 HG21 HG21 ' A' ' 38' ' ' VAL . 92.7 t -58.59 -43.88 88.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.595 1.558 . . . . 0.0 108.018 -178.574 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 20' ' ' VAL . 58.1 t -55.45 -47.76 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 CA-C-N 111.951 -2.386 . . . . 0.0 111.54 -173.336 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.424 HD21 ' CZ ' ' A' ' 51' ' ' ARG . 10.2 m120 -95.67 13.88 24.89 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 176.159 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 62.23 16.9 8.8 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 116.605 2.076 . . . . 0.0 116.605 179.027 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.462 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . . . 36.48 22.77 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 110.582 -3.008 . . . . 0.0 118.22 178.685 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 t 63.69 -51.76 0.24 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 125.121 1.369 . . . . 0.0 112.346 -160.66 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -138.16 109.67 7.0 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 178.323 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.869 HG11 HH11 ' A' ' 35' ' ' ARG . 4.6 p -124.06 144.03 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.34 0 O-C-N 120.309 -1.494 . . . . 0.0 113.243 179.53 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.4 p -71.02 137.74 49.29 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 177.717 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -50.79 72.36 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.187 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.468 ' O ' ' HG2' ' A' ' 36' ' ' GLU 0.302 0.0 OUTLIER -59.57 -28.62 67.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 118.164 2.654 . . . . 0.0 118.164 177.545 . . . . . . . . 4 4 . 1 . 022 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.7 m -67.24 -50.28 61.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 112.585 -2.098 . . . . 0.0 107.567 174.246 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.869 HH11 HG11 ' A' ' 30' ' ' VAL . 13.6 mtp85 -59.06 -42.68 90.9 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.58 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 3.2 pt-20 -58.98 -35.23 72.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 113.659 -1.609 . . . . 0.0 113.956 -177.968 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -76.95 -44.23 32.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 110.991 -2.822 . . . . 0.0 112.529 -176.873 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.773 HG21 HG21 ' A' ' 23' ' ' VAL . 42.7 t -64.66 -46.34 92.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 112.305 -2.225 . . . . 0.0 108.967 177.292 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -56.54 -42.18 78.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.824 2.85 . . . . 0.0 111.272 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.0 69.29 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.513 -1.676 . . . . 0.0 111.47 174.527 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.47 91.88 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 113.432 -1.713 . . . . 0.0 115.203 176.958 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.82 -44.53 93.99 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -178.678 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.3 -46.4 88.92 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.495 1.122 . . . . 0.0 112.446 178.661 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -61.99 -39.55 92.6 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.592 -2.094 . . . . 0.0 113.803 177.825 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.463 HD22 ' OD2' ' A' ' 8' ' ' ASP . 26.2 mt -90.21 15.83 9.65 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.601 1.56 . . . . 0.0 114.201 178.225 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 49.62 31.56 4.34 Favored 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 127.189 2.196 . . . . 0.0 112.6 176.895 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.478 ' OH ' ' HB3' ' A' ' 51' ' ' ARG . 10.4 t80 -97.52 139.91 32.74 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 122.863 1.316 . . . . 0.0 108.773 -165.657 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.327 0.0 OUTLIER -90.19 100.83 2.87 Favored Pre-proline 0 N--CA 1.478 0.971 0 CA-C-N 110.807 -2.906 . . . . 0.0 114.5 176.277 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.412 ' O ' HG13 ' A' ' 24' ' ' VAL . 19.9 Cg_exo -26.26 -73.21 0.03 OUTLIER 'Trans proline' 0 N--CA 1.484 0.962 1 C-N-CA 126.127 4.551 . . . . 0.0 116.966 -174.662 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -88.31 32.95 0.75 Allowed 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 118.763 2.875 . . . . 0.0 118.763 -168.567 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.478 ' HB3' ' OH ' ' A' ' 47' ' ' TYR . 15.9 ptt-85 26.2 89.65 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 127.57 2.348 . . . . 0.0 116.486 179.683 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.7 m -86.47 46.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.699 -1.25 . . . . 0.0 110.901 -174.726 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 134.64 143.87 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 C-N-CA 130.115 3.366 . . . . 0.0 106.855 -164.956 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -127.07 145.77 50.61 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.31 175.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.276 0.0 OUTLIER -118.95 90.34 3.31 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 113.098 -1.865 . . . . 0.0 109.665 162.235 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 N--CA 1.491 1.612 0 CA-C-N 108.755 -3.839 . . . . 0.0 114.72 -171.149 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 2' ' ' LYS . 10.2 mmt . . . . . 0 CA--C 1.548 0.895 0 N-CA-C 118.879 2.918 . . . . 0.0 118.879 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 1' ' ' MET . 43.7 mttp 177.71 143.23 0.27 Allowed Pre-proline 0 N--CA 1.491 1.61 0 C-N-CA 126.353 1.861 . . . . 0.0 108.272 -174.995 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -79.55 -16.88 11.6 Favored 'Trans proline' 0 N--CA 1.485 1.009 0 N-CA-C 118.599 2.499 . . . . 0.0 118.599 158.829 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.442 0.5 OUTLIER -153.59 146.36 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 -174.853 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.294 1.3 p -68.62 100.48 1.13 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 -179.261 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.413 HD21 ' CE2' ' A' ' 47' ' ' TYR . 21.2 mt -43.86 -14.26 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.73 0 N-CA-C 117.602 2.445 . . . . 0.0 117.602 -176.449 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.418 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 2.3 m-30 -55.93 -35.45 66.65 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.019 0.527 . . . . 0.0 110.334 165.909 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.475 ' OD2' HD22 ' A' ' 45' ' ' LEU . 32.6 t70 -59.0 -47.64 84.46 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.8 0.84 . . . . 0.0 113.08 174.395 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.8 t -59.31 -45.86 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 172.104 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -48.07 81.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.348 -2.205 . . . . 0.0 112.123 -177.358 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.418 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.5 OUTLIER -67.53 -42.2 83.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.221 2.208 . . . . 0.0 115.453 177.038 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.4 ' CB ' HD11 ' A' ' 45' ' ' LEU . 46.5 t80 -64.79 -33.05 75.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 124.017 0.823 . . . . 0.0 110.712 177.379 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.12 -16.43 24.93 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.397 -179.768 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.36 25.35 68.48 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 126.747 2.118 . . . . 0.0 113.479 173.558 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.437 HG22 HG21 ' A' ' 19' ' ' THR . 5.4 p -126.0 111.32 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.445 0.698 . . . . 0.0 110.197 -167.264 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 91.7 p -16.83 135.65 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.19 0 C-N-CA 127.889 2.476 . . . . 0.0 111.724 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.309 31.6 t80 -47.83 -53.29 16.0 Favored 'General case' 0 N--CA 1.521 3.086 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 -175.763 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.57 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.366 1.6 pp0? -58.44 -24.77 61.1 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 179.593 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 94.6 m -56.1 -50.21 71.67 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.233 165.255 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 24' ' ' VAL 0.297 79.9 t -65.5 -43.65 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-O 118.542 -0.742 . . . . 0.0 110.733 -177.126 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.89 81.58 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.034 0.834 . . . . 0.0 112.446 -177.54 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.57 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 18.9 mtt85 -61.37 -45.97 92.13 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.013 1.857 . . . . 0.0 116.013 169.168 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.608 HG21 HG21 ' A' ' 38' ' ' VAL . 70.1 t -59.86 -41.25 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 125.019 1.328 . . . . 0.0 108.458 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 20' ' ' VAL . 82.3 t -53.27 -49.87 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 113.687 -1.597 . . . . 0.0 112.665 -171.115 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -92.09 14.34 16.26 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 171.61 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.526 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.3 OUTLIER 60.02 21.08 10.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.971 2.508 . . . . 0.0 113.823 178.072 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.17 45.16 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 111.674 -2.512 . . . . 0.0 116.574 -175.192 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.2 t 64.09 -57.36 0.22 Allowed 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 125.959 1.704 . . . . 0.0 111.929 -163.589 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -146.08 104.86 3.86 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 125.858 1.663 . . . . 0.0 107.646 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.526 HG12 ' OE1' ' A' ' 26' ' ' GLN . 9.8 p -113.51 157.61 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 120.891 1.678 . . . . 0.0 114.453 177.311 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -60.81 121.01 11.24 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.647 0.737 . . . . 0.0 112.913 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -41.24 -62.62 0.81 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -43.3 -43.13 4.78 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 179.529 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -59.85 -52.42 65.53 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 179.05 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.2 mtm105 -54.43 -47.67 72.56 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.575 1.695 . . . . 0.0 115.575 177.316 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.46 -36.5 69.12 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -176.635 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -76.72 -42.12 42.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 111.354 -2.657 . . . . 0.0 111.364 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.608 HG21 HG21 ' A' ' 23' ' ' VAL . 60.5 t -64.98 -49.53 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 C-N-CA 125.892 1.677 . . . . 0.0 108.029 176.379 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -52.54 -40.4 62.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 128.54 2.736 . . . . 0.0 112.875 179.082 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.51 -52.98 55.04 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.3 -2.227 . . . . 0.0 111.663 173.544 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.98 86.04 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 113.404 -1.725 . . . . 0.0 114.254 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.97 -45.48 86.66 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.501 1.92 . . . . 0.0 115.947 -177.985 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.83 -46.39 82.15 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 112.721 -2.036 . . . . 0.0 112.563 177.135 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.84 -35.44 80.67 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 111.964 -2.38 . . . . 0.0 113.926 -174.893 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.475 HD22 ' OD2' ' A' ' 8' ' ' ASP . 46.4 mt -91.56 18.39 7.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.528 1.931 . . . . 0.0 113.96 179.936 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.42 0.2 OUTLIER 52.03 36.96 20.03 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.789 1.235 . . . . 0.0 113.876 178.537 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.413 ' CE2' HD21 ' A' ' 6' ' ' LEU . 11.1 t80 -100.41 175.64 5.63 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -172.443 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.75 107.53 4.67 Favored Pre-proline 0 N--CA 1.478 0.932 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -176.578 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.537 ' O ' HG13 ' A' ' 24' ' ' VAL 0.318 0.0 OUTLIER -5.12 -60.25 0.0 OUTLIER 'Trans proline' 0 N--CA 1.481 0.756 1 C-N-CA 126.362 4.708 . . . . 0.0 120.472 -173.805 . . . . . . . . 5 4 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.625 HD21 ' NH2' ' A' ' 51' ' ' ARG . 12.5 t-20 -123.61 94.01 4.11 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 117.264 2.32 . . . . 0.0 117.264 -179.592 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.625 ' NH2' HD21 ' A' ' 50' ' ' ASN 0.42 1.5 tmm_? 36.82 -155.96 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 116.215 -1.85 . . . . 0.0 110.489 126.882 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.601 HG13 ' HB2' ' A' ' 54' ' ' GLN . 9.8 p 97.49 126.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 117.495 -3.253 . . . . 0.0 111.486 145.62 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.08 70.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 123.843 1.782 . . . . 0.0 115.372 168.146 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.601 ' HB2' HG13 ' A' ' 52' ' ' VAL . 41.9 mt-30 -148.4 -39.27 0.17 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 128.742 2.817 . . . . 0.0 110.8 176.054 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.484 0.0 OUTLIER -79.8 98.19 6.95 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 122.599 1.19 . . . . 0.0 113.156 170.62 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt . . . . . 0 N--CA 1.482 1.168 0 CA-C-N 110.406 -3.088 . . . . 0.0 114.238 -173.764 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptt? . . . . . 0 N--CA 1.487 1.382 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.504 ' HB3' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -126.45 111.01 23.26 Favored Pre-proline 0 CA--C 1.556 1.201 0 CA-C-O 116.306 -1.807 . . . . 0.0 106.169 178.274 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -72.85 132.6 18.72 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 CA-C-N 121.907 1.717 . . . . 0.0 111.219 172.932 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.36 0.5 OUTLIER 63.34 144.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 C-N-CA 129.103 2.961 . . . . 0.0 109.866 175.498 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.301 2.8 p -73.07 99.22 2.72 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.6 mt -41.0 -14.4 0.01 OUTLIER 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 118.546 2.795 . . . . 0.0 118.546 -176.956 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.502 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 56.2 m-85 -54.62 -33.17 60.06 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 119.096 0.862 . . . . 0.0 111.071 165.338 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.441 ' OD2' HD22 ' A' ' 45' ' ' LEU . 15.0 t70 -59.13 -48.82 80.2 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 118.408 -0.806 . . . . 0.0 113.09 173.877 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -58.05 -44.26 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 173.358 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.22 70.62 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 112.029 -2.351 . . . . 0.0 111.531 -177.261 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.502 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.1 -39.57 86.77 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.515 1.926 . . . . 0.0 114.282 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -66.34 -36.35 82.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-O 122.236 1.017 . . . . 0.0 110.881 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.61 -15.15 40.67 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.198 -1.819 . . . . 0.0 110.856 178.694 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 26.65 60.89 Favored Glycine 0 CA--C 1.544 1.888 0 C-N-CA 126.936 2.208 . . . . 0.0 113.128 170.576 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -124.36 128.75 73.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.25 0.62 . . . . 0.0 110.655 -167.243 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 74.7 p -33.08 122.14 0.38 Allowed 'General case' 0 N--CA 1.514 2.725 0 C-N-CA 127.445 2.298 . . . . 0.0 109.13 175.288 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.317 41.8 t80 -40.92 -47.8 3.04 Favored 'General case' 0 N--CA 1.522 3.147 0 N-CA-C 117.628 2.455 . . . . 0.0 117.628 -175.873 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.425 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.403 0.0 OUTLIER -57.53 -16.99 11.52 Favored 'General case' 0 C--N 1.32 -0.681 1 N-CA-C 122.073 4.101 . . . . 0.0 122.073 179.108 . . . . . . . . 5 4 . 1 . 024 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 23' ' ' VAL . 69.0 p -64.96 -52.61 55.34 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 114.203 -1.362 . . . . 0.0 112.866 162.014 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.677 ' O ' HG23 ' A' ' 24' ' ' VAL 0.27 73.7 t -60.99 -47.6 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.204 -171.39 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 p -57.12 -42.58 81.13 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 122.775 1.274 . . . . 0.0 112.411 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.425 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 17.1 mtt85 -67.7 -38.97 84.37 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 119.773 3.249 . . . . 0.0 119.773 173.912 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.813 HG11 HG21 ' A' ' 38' ' ' VAL . 24.7 t -55.11 -46.62 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 127.237 2.215 . . . . 0.0 107.979 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.677 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.2 t -55.7 -46.81 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 110.974 -2.83 . . . . 0.0 111.239 -168.006 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.282 13.8 m120 -99.07 26.81 5.52 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.87 -1.513 . . . . 0.0 114.437 176.65 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.454 ' C ' ' H ' ' A' ' 28' ' ' SER . 17.5 pt20 49.29 44.54 23.52 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-O 123.809 1.766 . . . . 0.0 112.905 171.543 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.296 . . -72.87 36.15 0.08 Allowed 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 110.211 -3.177 . . . . 0.0 118.858 -176.501 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.454 ' H ' ' C ' ' A' ' 26' ' ' GLN . 4.7 m 4.83 93.99 0.01 OUTLIER 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 108.854 -3.794 . . . . 0.0 117.902 176.617 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.7 m80 171.89 -68.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 102.67 -3.085 . . . . 0.0 102.67 -167.58 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -25.16 101.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 129.1 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 86.1 p -100.6 156.29 17.39 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 112.234 -2.257 . . . . 0.0 114.811 -177.048 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -15.21 -63.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.403 1.881 . . . . 0.0 115.28 167.646 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.82 -51.85 12.19 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 176.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 38' ' ' VAL . 76.3 m -59.56 -51.45 69.77 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.481 1.512 . . . . 0.0 107.012 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.495 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -54.87 -43.3 73.02 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.762 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.86 -39.4 85.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.309 -1.769 . . . . 0.0 114.744 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -79.11 -40.84 30.06 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 113.079 -1.873 . . . . 0.0 112.072 -177.487 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.813 HG21 HG11 ' A' ' 23' ' ' VAL . 44.7 t -61.17 -47.56 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.74 1.616 . . . . 0.0 106.771 172.706 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 53.2 mt-10 -55.73 -44.68 77.76 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.344 2.258 . . . . 0.0 111.499 -178.585 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -51.7 65.83 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.658 -2.065 . . . . 0.0 110.925 177.936 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.68 -40.7 80.01 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 113.205 -1.816 . . . . 0.0 113.603 176.193 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 mtt -58.25 -48.97 78.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -176.0 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.4 94.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.101 -2.318 . . . . 0.0 112.875 177.599 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -64.13 -34.47 78.12 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-N 112.332 -2.213 . . . . 0.0 113.684 -177.533 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.441 HD22 ' OD2' ' A' ' 8' ' ' ASP . 47.0 mt -94.48 18.0 12.08 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.867 1.667 . . . . 0.0 113.042 -178.486 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.69 21.41 5.85 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.693 2.397 . . . . 0.0 113.043 178.341 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -89.79 157.43 17.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -170.294 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.55 ' HA ' ' HD3' ' A' ' 49' ' ' PRO 0.429 24.5 mm -118.86 113.84 35.78 Favored Pre-proline 0 CA--C 1.535 0.396 1 N-CA-C 121.921 4.045 . . . . 0.0 121.921 178.112 . . . . . . . . 4 3 . 1 . 024 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.567 ' O ' HG13 ' A' ' 24' ' ' VAL 0.375 0.1 OUTLIER -12.97 -55.91 0.01 OUTLIER 'Trans proline' 0 N--CA 1.481 0.76 1 C-N-CA 127.791 5.661 . . . . 0.0 121.733 -164.901 . . . . . . . . 5 4 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -112.81 36.1 3.61 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 120.266 3.432 . . . . 0.0 120.266 -169.295 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 52' ' ' VAL . 7.6 mmp_? -114.12 104.73 12.41 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 114.656 -1.156 . . . . 0.0 113.152 -162.07 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 7.4 p -133.49 121.99 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 125.68 1.592 . . . . 0.0 111.288 1.59 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.62 83.24 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 CA-C-O 123.71 1.719 . . . . 0.0 112.111 166.859 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.43 ' HB3' HG13 ' A' ' 52' ' ' VAL . 41.6 tt0 -176.85 -65.49 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 111.491 -2.595 . . . . 0.0 110.168 -169.55 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -139.82 86.45 2.1 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 113.48 -1.691 . . . . 0.0 107.396 174.704 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.589 HD11 HG11 ' A' ' 24' ' ' VAL . 23.0 tp . . . . . 0 N--CA 1.48 1.067 1 CA-C-N 108.102 -4.135 . . . . 0.0 112.123 -155.282 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.584 ' HA ' ' HA ' ' A' ' 53' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 118.705 2.854 . . . . 0.0 118.705 . . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -165.72 165.18 11.27 Favored Pre-proline 0 CA--C 1.561 1.382 0 C-N-CA 127.107 2.163 . . . . 0.0 108.38 -177.015 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -74.87 -44.16 0.37 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 C-N-CA 122.586 2.191 . . . . 0.0 111.06 172.41 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.415 0.4 OUTLIER -144.8 148.92 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 127.374 2.269 . . . . 0.0 109.669 177.368 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.3 p -91.54 145.66 24.43 Favored 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.3 -165.521 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.473 HD22 HG12 ' A' ' 20' ' ' VAL . 8.2 mt -45.71 -27.88 0.9 Allowed 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -170.384 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -59.58 -39.61 84.7 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.816 0.735 . . . . 0.0 111.744 176.597 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.5 -48.31 74.81 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 171.121 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.0 t -60.0 -40.62 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 174.317 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.406 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -60.15 -50.54 73.29 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.643 -1.617 . . . . 0.0 113.201 177.563 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.69 -39.35 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.993 1.717 . . . . 0.0 113.72 177.212 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.403 ' CB ' HD11 ' A' ' 45' ' ' LEU . 36.5 t80 -67.27 -34.97 78.53 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.572 0.749 . . . . 0.0 111.212 177.479 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.42 -14.91 44.76 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.104 177.246 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.91 29.46 54.38 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 126.124 1.821 . . . . 0.0 112.655 170.831 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -132.4 134.37 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.981 0 CA-C-O 122.202 1.001 . . . . 0.0 109.651 -168.409 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.5 p -41.21 130.88 2.79 Favored 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 128.135 2.574 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.414 ' HE1' ' HB2' ' A' ' 6' ' ' LEU . 85.9 t80 -51.95 -29.54 20.88 Favored 'General case' 0 N--CA 1.51 2.528 0 N-CA-C 119.586 3.18 . . . . 0.0 119.586 -174.524 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -49.31 -41.52 38.59 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 116.479 -1.724 . . . . 0.0 113.374 172.889 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 43.5 p -63.22 -53.85 46.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 176.378 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.726 ' O ' HG23 ' A' ' 24' ' ' VAL . 82.4 t -62.38 -48.18 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.831 0.852 . . . . 0.0 110.207 -173.079 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.0 p -57.81 -42.45 84.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 116.609 2.078 . . . . 0.0 116.609 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 19' ' ' THR . 30.2 mtp85 -62.01 -45.59 92.91 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 109.995 -3.275 . . . . 0.0 115.157 171.212 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 38' ' ' VAL . 14.3 t -54.92 -48.31 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 127.405 2.282 . . . . 0.0 109.657 179.253 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.726 HG23 ' O ' ' A' ' 20' ' ' VAL . 48.3 t -57.26 -48.68 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 CA-C-N 109.945 -3.298 . . . . 0.0 112.937 -166.826 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.435 HD22 HH21 ' A' ' 51' ' ' ARG 0.301 79.9 m-20 -108.54 33.44 4.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.756 -1.565 . . . . 0.0 114.9 176.364 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 73.51 -5.49 1.97 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.902 2.881 . . . . 0.0 118.619 167.053 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.15 30.02 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.814 2.446 . . . . 0.0 115.266 -175.785 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.6 p 55.21 -44.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 -148.448 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.272 77.9 m80 -153.8 131.96 11.85 Favored 'General case' 0 CA--C 1.556 1.189 0 CA-C-O 117.64 -1.171 . . . . 0.0 109.875 -175.986 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.9 t -150.98 143.19 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.847 1.658 . . . . 0.0 113.887 159.244 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 p -23.34 131.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 119.387 3.106 . . . . 0.0 119.387 166.123 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 35' ' ' ARG . . . -66.45 -47.43 73.17 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.945 0.898 . . . . 0.0 112.791 -176.61 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.93 15.76 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 176.226 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -61.78 -49.61 75.65 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.931 1.692 . . . . 0.0 107.653 175.995 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.565 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 12.5 mmt85 -58.18 -46.77 85.17 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.688 1.995 . . . . 0.0 113.054 -178.941 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.26 -37.92 75.92 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 179.506 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -73.3 -43.26 61.26 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 112.27 -2.241 . . . . 0.0 111.87 178.695 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.562 HG21 HG11 ' A' ' 23' ' ' VAL . 85.8 t -63.6 -48.84 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 114.396 -1.275 . . . . 0.0 108.699 177.393 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.565 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 42.0 mt-10 -49.17 -46.81 45.95 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 128.981 2.912 . . . . 0.0 108.995 178.464 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.45 -54.23 31.41 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 112.706 -2.043 . . . . 0.0 111.359 -178.475 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.13 -42.41 69.48 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.275 -1.784 . . . . 0.0 114.23 174.332 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.603 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 3.0 mmt -59.62 -50.37 74.14 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 125.88 1.672 . . . . 0.0 111.587 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.98 -42.77 94.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.292 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.52 -32.93 74.59 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.501 179.566 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.403 HD11 ' CB ' ' A' ' 12' ' ' TYR . 29.6 mt -92.76 11.53 26.59 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 125.683 1.593 . . . . 0.0 113.727 177.576 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.408 0.2 OUTLIER 46.47 29.76 0.96 Allowed 'General case' 0 CA--C 1.564 1.487 0 C-N-CA 127.298 2.239 . . . . 0.0 113.715 -175.791 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.603 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 24.9 t80 -93.8 103.48 15.61 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.03 -1.044 . . . . 0.0 108.59 -168.037 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.56 HG21 HG13 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -49.78 118.84 9.07 Favored Pre-proline 0 N--CA 1.494 1.764 0 CA-C-N 113.534 -1.666 . . . . 0.0 113.799 169.395 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.48 44.19 0.71 Allowed 'Trans proline' 0 N--CA 1.485 1.019 0 C-N-CA 123.004 2.469 . . . . 0.0 118.318 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.45 85.76 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 113.097 -1.865 . . . . 0.0 108.059 -175.974 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.435 HH21 HD22 ' A' ' 25' ' ' ASN 0.309 0.0 OUTLIER -25.86 102.26 0.02 OUTLIER 'General case' 0 CA--C 1.57 1.721 0 N-CA-C 117.577 2.436 . . . . 0.0 117.577 -178.868 . . . . . . . . 4 4 . 1 . 025 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.56 HG13 HG21 ' A' ' 48' ' ' ILE . 2.6 m -69.71 77.69 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 C-N-CA 124.143 0.977 . . . . 0.0 108.687 173.687 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 1' ' ' MET . . . -69.4 77.34 0.39 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 122.585 1.183 . . . . 0.0 111.188 171.112 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -115.3 -52.79 2.65 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 111.629 -2.532 . . . . 0.0 112.393 174.98 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.303 0.0 OUTLIER -90.8 54.38 2.65 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 124.083 1.897 . . . . 0.0 112.126 167.314 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.465 ' H ' ' HG ' ' A' ' 56' ' ' LEU . 2.9 pp . . . . . 0 N--CA 1.478 0.959 0 CA-C-N 111.083 -2.78 . . . . 0.0 116.683 -170.518 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.457 ' HB3' HE22 ' A' ' 55' ' ' GLN . 9.3 tmm? . . . . . 0 N--CA 1.482 1.141 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.6 ' HB3' ' CZ ' ' A' ' 51' ' ' ARG 0.333 2.1 mptt -83.95 138.86 39.93 Favored Pre-proline 0 CA--C 1.552 1.051 0 CA-C-O 115.842 -2.028 . . . . 0.0 113.9 -167.299 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.435 ' HD2' HH12 ' A' ' 51' ' ' ARG . 44.9 Cg_exo -57.1 -52.7 6.1 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.698 2.265 . . . . 0.0 112.917 -168.72 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.465 1.1 t -168.31 148.27 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 103.474 -2.787 . . . . 0.0 103.474 -173.444 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 19.1 p -101.05 141.46 33.91 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.616 -0.677 . . . . 0.0 110.371 -176.924 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.572 HD22 HG12 ' A' ' 20' ' ' VAL . 21.6 mt -47.02 -23.84 0.53 Allowed 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 119.563 3.171 . . . . 0.0 119.563 -164.863 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -62.28 -35.59 79.47 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.14 0.882 . . . . 0.0 111.727 175.2 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.498 ' OD2' HD22 ' A' ' 45' ' ' LEU . 21.1 t70 -59.55 -46.92 87.49 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 118.383 -0.818 . . . . 0.0 112.885 171.283 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.9 t -58.61 -45.46 90.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 172.765 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.01 71.34 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.288 1.435 . . . . 0.0 112.598 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.58 -38.81 84.58 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.184 1.794 . . . . 0.0 115.766 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.407 ' CB ' HD11 ' A' ' 45' ' ' LEU . 48.6 t80 -64.82 -35.64 81.76 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.97 0.908 . . . . 0.0 110.346 176.58 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.38 -14.9 44.91 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.149 -1.387 . . . . 0.0 110.241 179.311 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.31 24.96 69.55 Favored Glycine 0 N--CA 1.48 1.582 0 C-N-CA 127.23 2.347 . . . . 0.0 113.275 172.443 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -121.02 124.72 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 124.188 0.995 . . . . 0.0 109.749 -167.812 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.4 p -31.12 123.27 0.22 Allowed 'General case' 0 N--CA 1.513 2.715 0 C-N-CA 127.207 2.203 . . . . 0.0 108.534 175.214 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -39.47 -33.18 0.15 Allowed 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 115.863 1.801 . . . . 0.0 115.863 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -48.11 -42.4 29.02 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 117.745 -1.121 . . . . 0.0 112.733 176.986 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.456 ' O ' HG23 ' A' ' 23' ' ' VAL . 2.3 p -60.83 -55.77 29.08 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 175.764 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.617 ' O ' HG23 ' A' ' 24' ' ' VAL 0.326 94.7 t -60.45 -44.61 96.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 C-N-CA 124.666 1.186 . . . . 0.0 110.092 -165.05 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.5 p -59.61 -49.35 78.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.198 0.999 . . . . 0.0 113.056 178.885 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 19' ' ' THR . 26.2 mtp85 -56.75 -44.53 81.83 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 111.998 -2.364 . . . . 0.0 113.857 173.278 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.486 HG21 HG21 ' A' ' 38' ' ' VAL . 43.7 t -59.57 -47.83 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.522 1.529 . . . . 0.0 109.069 -178.813 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 20' ' ' VAL . 50.5 t -60.02 -41.38 86.05 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 112.982 -1.917 . . . . 0.0 112.042 -167.776 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.26 90.1 m-20 -100.05 23.48 9.85 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 113.697 -1.592 . . . . 0.0 114.867 173.518 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.34 5.91 4.54 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 170.647 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.96 43.36 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 111.566 -2.561 . . . . 0.0 115.147 -167.904 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.0 p 57.34 -59.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 113.155 -1.839 . . . . 0.0 114.485 -160.261 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -140.16 108.41 5.8 Favored 'General case' 0 CA--C 1.559 1.297 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.145 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.3 p -121.51 157.66 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 171.606 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 p -68.96 131.44 45.09 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 116.462 2.023 . . . . 0.0 116.462 -175.13 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -24.65 -67.06 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 128.004 2.522 . . . . 0.0 117.026 176.053 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -53.36 -40.54 65.02 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -172.346 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -50.45 70.09 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 113.056 -1.884 . . . . 0.0 107.31 -178.108 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -63.45 -40.13 96.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -179.645 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.76 -36.56 83.45 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.744 -176.743 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.74 -41.45 53.29 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 112.883 -1.962 . . . . 0.0 110.965 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.486 HG21 HG21 ' A' ' 23' ' ' VAL . 47.7 t -64.83 -47.4 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.294 1.438 . . . . 0.0 109.099 176.075 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.2 mt-10 -52.48 -43.97 65.33 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 130.066 3.347 . . . . 0.0 109.693 179.095 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.76 -51.35 67.48 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.005 -1.907 . . . . 0.0 111.28 177.738 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.85 93.22 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 113.837 -1.529 . . . . 0.0 113.55 176.261 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 mtt -56.59 -45.78 81.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 127.573 2.349 . . . . 0.0 113.537 -178.8 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.52 -47.96 76.93 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 113.077 -1.874 . . . . 0.0 112.628 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -63.04 -39.34 94.46 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 112.348 -2.205 . . . . 0.0 113.142 -177.423 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.498 HD22 ' OD2' ' A' ' 8' ' ' ASP . 52.9 mt -84.76 7.81 19.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.32 2.248 . . . . 0.0 113.902 -177.5 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.403 0.5 OUTLIER 49.22 45.21 23.43 Favored 'General case' 0 CA--C 1.573 1.849 0 C-N-CA 125.304 1.442 . . . . 0.0 112.852 179.679 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.41 ' HE1' HH11 ' A' ' 51' ' ' ARG . 16.7 t80 -95.39 -167.29 1.59 Allowed 'General case' 0 CA--C 1.558 1.254 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.26 -167.519 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.3 103.32 3.13 Favored Pre-proline 0 N--CA 1.479 0.984 0 CA-C-O 117.708 -1.139 . . . . 0.0 109.571 179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.348 0.0 OUTLIER -8.69 -76.99 0.0 OUTLIER 'Trans proline' 0 N--CA 1.488 1.178 1 C-N-CA 125.777 4.318 . . . . 0.0 117.249 -177.278 . . . . . . . . 4 3 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.5 145.22 37.13 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 173.267 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.6 ' CZ ' ' HB3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -102.62 94.87 5.87 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 105.461 -2.051 . . . . 0.0 105.461 -167.191 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.0 m -77.84 74.31 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.563 1.467 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -171.953 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.79 115.54 6.03 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.814 0.816 . . . . 0.0 109.922 178.345 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.538 ' H ' ' HE3' ' A' ' 2' ' ' LYS . 9.4 tm0? -106.87 -60.98 1.6 Allowed 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 113.002 -1.908 . . . . 0.0 112.628 -171.276 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.457 HE22 ' HB3' ' A' ' 1' ' ' MET . 0.0 OUTLIER -68.66 90.83 0.41 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.915 0.864 . . . . 0.0 109.622 168.21 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.6 mt . . . . . 0 N--CA 1.487 1.416 0 CA-C-N 113.224 -1.807 . . . . 0.0 114.069 -173.45 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.445 ' HA ' HG22 ' A' ' 52' ' ' VAL . 17.5 mmt . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.432 ' HD2' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -172.03 114.55 0.4 Allowed Pre-proline 0 CA--C 1.567 1.614 0 C-N-CA 127.574 2.35 . . . . 0.0 105.769 179.038 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -84.31 -8.37 9.73 Favored 'Trans proline' 0 N--CA 1.486 1.031 0 N-CA-C 118.754 2.559 . . . . 0.0 118.754 170.905 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.445 1.1 t -162.07 145.53 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 N-CA-C 102.906 -2.998 . . . . 0.0 102.906 -178.362 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.491 HG22 ' HG2' ' A' ' 55' ' ' GLN . 34.9 p -93.94 134.94 35.8 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.197 -174.505 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.786 HD11 ' HG3' ' A' ' 51' ' ' ARG . 22.4 mt -51.36 -22.37 2.87 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 120.188 3.403 . . . . 0.0 120.188 -163.591 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -58.37 -32.36 68.49 Favored 'General case' 0 CA--C 1.551 1.0 0 O-C-N 123.406 0.441 . . . . 0.0 109.951 175.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -61.59 -52.33 64.83 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 118.01 -0.995 . . . . 0.0 113.26 171.406 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.6 t -56.59 -44.71 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 174.205 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.42 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -58.11 -51.9 67.79 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.353 2.661 . . . . 0.0 112.998 -178.118 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.77 -39.85 84.09 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.86 1.664 . . . . 0.0 113.909 177.456 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -67.17 -34.01 76.63 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.414 1.086 . . . . 0.0 111.155 177.074 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.86 -11.25 42.51 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.73 1.212 . . . . 0.0 111.291 178.357 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.49 17.57 77.91 Favored Glycine 0 N--CA 1.48 1.602 0 C-N-CA 126.511 2.005 . . . . 0.0 114.15 169.187 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -117.98 136.64 54.5 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 124.828 1.251 . . . . 0.0 110.07 -170.427 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -36.29 123.59 0.77 Allowed 'General case' 0 N--CA 1.52 3.029 0 C-N-CA 127.414 2.286 . . . . 0.0 108.872 -179.485 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -34.21 -46.75 0.26 Allowed 'General case' 0 N--CA 1.53 3.543 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 175.044 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.521 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.572 3.2 pp0? -59.6 -29.97 68.36 Favored 'General case' 0 C--N 1.322 -0.613 1 N-CA-C 124.455 4.983 . . . . 0.0 124.455 176.642 . . . . . . . . 4 3 . 1 . 027 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' HG23 ' A' ' 23' ' ' VAL . 70.1 p -59.18 -46.14 89.19 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.416 -1.266 . . . . 0.0 112.763 165.047 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.524 ' O ' HG23 ' A' ' 24' ' ' VAL . 92.5 t -66.06 -47.5 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.686 0.794 . . . . 0.0 110.275 -175.757 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.292 2.7 m -61.55 -34.67 75.96 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -177.836 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.566 ' HB2' ' O ' ' A' ' 19' ' ' THR . 17.3 mtt85 -60.81 -49.02 79.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 111.385 -2.643 . . . . 0.0 114.603 166.423 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 19' ' ' THR . 92.8 t -61.52 -45.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.113 -175.778 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 20' ' ' VAL . 30.1 t -57.97 -45.09 87.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 O-C-N 124.938 1.399 . . . . 0.0 111.477 -168.243 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -90.81 24.24 2.81 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 113.846 -1.525 . . . . 0.0 113.958 175.176 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.292 0.0 OUTLIER 62.98 1.85 0.92 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 129.953 3.301 . . . . 0.0 117.741 173.668 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.76 40.02 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 111.811 -2.45 . . . . 0.0 116.141 -170.921 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.25 98.4 p 61.23 -49.61 0.12 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -164.951 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -153.33 104.59 2.78 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -174.79 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 p -125.74 150.99 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 N-CA-C 116.495 2.035 . . . . 0.0 116.495 -179.595 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -59.65 137.48 58.02 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 116.977 2.214 . . . . 0.0 116.977 -176.009 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.24 -61.52 1.95 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.521 1.929 . . . . 0.0 114.868 177.102 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.72 -35.83 56.52 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 38' ' ' VAL . 24.7 m -69.27 -58.14 4.42 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.549 1.54 . . . . 0.0 107.346 174.661 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.458 ' HB3' ' OE2' ' A' ' 39' ' ' GLU . 7.9 mtm105 -53.5 -48.09 69.28 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -179.157 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -56.3 -36.84 69.1 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.735 2.014 . . . . 0.0 113.695 -174.108 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -77.62 -44.64 27.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 109.698 -3.41 . . . . 0.0 110.518 -176.956 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.539 HG21 HG21 ' A' ' 23' ' ' VAL . 42.0 t -65.34 -48.46 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.125 1.77 . . . . 0.0 108.234 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.458 ' OE2' ' HB3' ' A' ' 35' ' ' ARG . 41.4 mt-10 -59.15 -40.04 84.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 128.64 2.776 . . . . 0.0 115.645 179.123 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.9 58.12 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 111.98 -2.373 . . . . 0.0 110.029 172.766 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.54 -37.57 73.29 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 112.988 -1.914 . . . . 0.0 113.29 176.986 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.5 ' HG2' ' CD2' ' A' ' 47' ' ' TYR . 34.3 mtt -58.09 -55.98 27.96 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 -174.699 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -42.32 99.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.613 179.024 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.86 -37.07 85.41 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.307 -2.224 . . . . 0.0 112.501 -176.978 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -94.0 16.84 13.49 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.966 1.306 . . . . 0.0 114.269 -178.165 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.343 1.5 p-10 54.73 48.9 19.17 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-O 123.948 1.832 . . . . 0.0 113.745 178.871 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.552 ' OH ' HD21 ' A' ' 6' ' ' LEU . 73.5 t80 -105.86 157.87 17.16 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.368 -1.287 . . . . 0.0 112.462 -173.166 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.2 91.97 9.74 Favored Pre-proline 0 N--CA 1.489 1.496 0 CA-C-N 114.008 -1.451 . . . . 0.0 111.601 -173.827 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.404 ' HG3' ' SD ' ' A' ' 42' ' ' MET . 90.4 Cg_exo -43.73 109.33 0.14 Allowed 'Trans proline' 0 N--CA 1.479 0.676 1 C-N-CA 125.463 4.108 . . . . 0.0 113.969 -169.215 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -173.05 -70.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 119.344 3.091 . . . . 0.0 119.344 164.009 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.786 ' HG3' HD11 ' A' ' 6' ' ' LEU . 11.4 mmp_? 67.45 112.9 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 125.78 1.632 . . . . 0.0 113.154 179.073 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.445 HG22 ' HA ' ' A' ' 1' ' ' MET . 3.5 m -77.59 165.04 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 119.504 -0.878 . . . . 0.0 110.399 151.962 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.01 83.3 0.96 Allowed 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.934 1.349 . . . . 0.0 112.974 -175.291 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -118.71 -30.91 4.99 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 112.938 -1.937 . . . . 0.0 115.914 178.024 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.547 HE22 ' HD3' ' A' ' 51' ' ' ARG . 1.6 pp0? -162.55 47.56 0.16 Allowed 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 123.859 1.79 . . . . 0.0 110.267 -172.324 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.6 mt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 119.847 3.277 . . . . 0.0 119.847 -154.285 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.539 ' O ' HG11 ' A' ' 52' ' ' VAL . 80.9 mmm . . . . . 0 N--CA 1.485 1.306 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HG3' HG13 ' A' ' 52' ' ' VAL . 3.4 mppt? -112.67 148.0 38.34 Favored Pre-proline 0 CA--C 1.553 1.072 0 CA-C-O 116.004 -1.95 . . . . 0.0 111.559 179.651 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -61.81 -30.6 84.65 Favored 'Trans proline' 0 N--CA 1.487 1.097 0 CA-C-N 121.892 1.712 . . . . 0.0 115.101 -162.586 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.4 OUTLIER -137.94 150.09 25.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 CA-C-N 110.222 -3.172 . . . . 0.0 103.354 162.034 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 p -85.41 150.56 24.64 Favored 'General case' 0 CA--C 1.552 1.033 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 175.891 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.488 HD11 ' HB3' ' A' ' 51' ' ' ARG . 35.0 mt -46.41 -25.11 0.6 Allowed 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 119.996 3.332 . . . . 0.0 119.996 -166.811 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -60.54 -40.17 90.6 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 119.665 1.12 . . . . 0.0 112.155 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.57 -31.04 71.86 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.72 179.328 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.69 -50.31 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 168.238 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.68 -53.78 35.3 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.544 1.938 . . . . 0.0 112.249 176.767 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.39 -39.03 88.8 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.559 1.543 . . . . 0.0 112.298 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.482 ' CB ' HD11 ' A' ' 45' ' ' LEU . 32.4 t80 -65.1 -34.4 78.32 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 121.755 0.788 . . . . 0.0 109.906 177.189 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.53 -11.91 44.35 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.094 178.616 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 31.29 66.83 Favored Glycine 0 N--CA 1.483 1.818 0 C-N-CA 126.891 2.186 . . . . 0.0 112.24 171.544 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.12 128.49 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-O 121.78 0.8 . . . . 0.0 111.354 -168.579 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.4 p -34.57 122.22 0.52 Allowed 'General case' 0 N--CA 1.516 2.826 0 C-N-CA 128.095 2.558 . . . . 0.0 107.462 174.294 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -42.18 -43.3 3.3 Favored 'General case' 0 N--CA 1.538 3.931 0 N-CA-C 117.849 2.537 . . . . 0.0 117.849 -166.509 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.413 0.0 OUTLIER -57.43 -24.83 57.91 Favored 'General case' 0 C--N 1.318 -0.795 1 N-CA-C 123.437 4.606 . . . . 0.0 123.437 -178.214 . . . . . . . . 4 3 . 1 . 028 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.524 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.7 p -55.77 -54.71 41.09 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.801 0.688 . . . . 0.0 111.707 164.548 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.627 ' O ' HG23 ' A' ' 24' ' ' VAL . 82.1 t -59.74 -49.79 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.31 1.844 . . . . 0.0 108.623 -172.195 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 m -59.81 -37.53 79.4 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.239 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.525 ' HG3' HH11 ' A' ' 22' ' ' ARG . 11.0 mtt85 -67.29 -41.16 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 118.953 2.946 . . . . 0.0 118.953 170.27 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 38' ' ' VAL . 74.4 t -59.35 -41.44 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 126.379 1.872 . . . . 0.0 107.368 179.544 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 20' ' ' VAL . 58.4 t -59.28 -45.0 93.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 113.182 -1.826 . . . . 0.0 112.579 -169.852 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -83.84 4.4 29.44 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 170.3 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 66.31 14.18 9.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.016 2.127 . . . . 0.0 115.832 -177.047 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 24.02 40.46 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.834 2.454 . . . . 0.0 117.557 -171.41 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.258 96.0 p 58.46 -53.7 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -162.576 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -140.34 79.56 1.71 Allowed 'General case' 0 CA--C 1.571 1.776 0 C-N-CA 124.101 0.961 . . . . 0.0 109.909 -175.124 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -102.24 140.2 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 119.836 -1.79 . . . . 0.0 114.699 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.1 t -58.2 150.55 21.29 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -176.604 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.69 0.24 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.747 2.019 . . . . 0.0 113.491 -175.834 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -56.32 -30.93 63.21 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 120.401 3.482 . . . . 0.0 120.401 -178.807 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 36.6 m -62.73 -52.0 64.94 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 174.579 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.4 mtm105 -57.01 -44.3 82.68 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 176.608 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -36.63 72.56 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.769 1.627 . . . . 0.0 115.157 -176.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.6 ttpt -76.07 -42.31 47.82 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 110.934 -2.848 . . . . 0.0 110.987 -178.453 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 23' ' ' VAL . 74.9 t -65.67 -51.25 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.861 179.595 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -53.57 -46.73 70.4 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 129.825 3.25 . . . . 0.0 110.999 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.85 -49.65 71.92 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.439 -2.164 . . . . 0.0 111.879 176.532 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.18 -49.64 77.07 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.578 -1.647 . . . . 0.0 113.178 176.494 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.6 mtt -54.2 -45.54 72.22 Favored 'General case' 0 N--CA 1.497 1.903 0 C-N-CA 127.0 2.12 . . . . 0.0 111.061 -179.437 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.61 -47.77 82.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 125.843 1.964 . . . . 0.0 111.507 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -64.41 -40.55 95.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 113.044 -1.889 . . . . 0.0 113.584 177.548 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.482 HD11 ' CB ' ' A' ' 12' ' ' TYR . 61.6 mt -84.89 9.24 14.88 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 127.632 2.373 . . . . 0.0 115.103 179.978 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.274 0.6 OUTLIER 49.1 34.66 6.04 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 126.29 1.836 . . . . 0.0 114.048 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -80.34 161.29 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.461 -0.774 . . . . 0.0 111.077 -171.338 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.31 0.0 OUTLIER -115.97 93.87 39.63 Favored Pre-proline 0 N--CA 1.481 1.123 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.863 177.985 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' O ' HG13 ' A' ' 24' ' ' VAL 0.309 0.1 OUTLIER -15.76 -62.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.507 1 C-N-CA 126.487 4.791 . . . . 0.0 120.775 -169.606 . . . . . . . . 5 4 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -82.75 38.27 0.56 Allowed 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 118.11 2.633 . . . . 0.0 118.11 -173.362 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.488 ' HB3' HD11 ' A' ' 6' ' ' LEU . 0.0 OUTLIER 31.54 59.21 0.3 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 117.33 2.344 . . . . 0.0 117.33 -175.574 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.539 HG11 ' O ' ' A' ' 1' ' ' MET 0.371 28.3 m 50.72 14.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 N-CA-C 120.502 3.519 . . . . 0.0 120.502 -172.411 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.35 -55.76 5.64 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -178.606 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -98.85 66.92 1.64 Allowed 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 123.945 1.831 . . . . 0.0 110.57 -177.0 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 173.56 -31.35 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 109.913 -3.312 . . . . 0.0 110.732 -176.679 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 tp . . . . . 0 N--CA 1.475 0.798 0 O-C-N 123.923 0.764 . . . . 0.0 112.788 165.626 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.485 1.284 0 N-CA-C 116.962 2.208 . . . . 0.0 116.962 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.506 ' HE3' HG22 ' A' ' 5' ' ' THR . 46.2 pttt 177.95 138.33 0.24 Allowed Pre-proline 0 CA--C 1.567 1.606 0 C-N-CA 126.304 1.841 . . . . 0.0 109.299 176.923 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.44 ' HD3' HG22 ' A' ' 48' ' ' ILE . 12.2 Cg_exo -77.61 -26.74 6.78 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.217 1.944 . . . . 0.0 115.473 -166.184 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.405 0.3 OUTLIER -151.13 134.81 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 126.589 1.955 . . . . 0.0 109.007 -175.013 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.506 HG22 ' HE3' ' A' ' 2' ' ' LYS . 3.5 p -71.96 144.44 48.89 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 -169.559 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.709 HD11 ' HG2' ' A' ' 51' ' ' ARG . 41.7 mt -55.5 -23.7 27.55 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -162.747 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -51.82 -39.87 59.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.766 1.626 . . . . 0.0 109.322 177.156 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -62.63 -45.23 93.79 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.706 174.644 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.4 t -57.88 -47.86 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 169.222 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.49 -51.02 66.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.316 1.846 . . . . 0.0 113.547 177.444 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.43 90.98 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.24 1.816 . . . . 0.0 113.558 179.215 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.415 ' CB ' HD11 ' A' ' 45' ' ' LEU . 37.0 t80 -64.88 -31.82 73.24 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 121.909 0.862 . . . . 0.0 110.582 176.341 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.36 -20.62 25.09 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.295 178.998 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 28.2 55.32 Favored Glycine 0 CA--C 1.545 1.909 0 C-N-CA 126.339 1.923 . . . . 0.0 112.82 173.719 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -127.93 128.25 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -173.128 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 p -52.48 139.88 24.02 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 124.516 1.126 . . . . 0.0 111.407 -173.198 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.619 ' CE1' ' HB2' ' A' ' 6' ' ' LEU . 41.9 t80 -46.63 -43.56 17.58 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 119.871 3.286 . . . . 0.0 119.871 -165.559 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.484 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.403 0.0 OUTLIER -55.37 -25.07 33.13 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 121.748 3.981 . . . . 0.0 121.748 -179.362 . . . . . . . . 4 4 . 1 . 029 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.535 ' O ' HG23 ' A' ' 23' ' ' VAL . 55.8 p -60.74 -55.17 36.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 114.009 -1.451 . . . . 0.0 112.951 166.461 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 24' ' ' VAL . 97.1 t -60.08 -48.59 87.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.153 1.781 . . . . 0.0 109.469 -176.285 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.341 3.6 m -56.21 -36.8 68.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 115.551 1.685 . . . . 0.0 115.551 177.38 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.548 ' HG3' HH11 ' A' ' 22' ' ' ARG . 12.3 mtt85 -67.81 -45.95 73.27 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 111.727 -2.488 . . . . 0.0 115.98 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.57 HG21 HG21 ' A' ' 38' ' ' VAL . 66.0 t -60.4 -43.33 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 125.372 1.469 . . . . 0.0 109.673 -179.538 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.83 HG11 ' HG3' ' A' ' 51' ' ' ARG . 86.0 t -54.58 -50.74 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.382 0 CA-C-N 112.441 -2.163 . . . . 0.0 110.521 -173.434 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.21 18.12 14.34 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.655 -1.611 . . . . 0.0 113.952 177.761 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 28' ' ' SER 0.3 17.4 mt-30 68.19 11.09 8.22 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 119.768 3.247 . . . . 0.0 119.768 173.657 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.451 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . . . 40.41 -36.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 121.12 3.748 . . . . 0.0 121.12 176.89 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.492 ' H ' ' C ' ' A' ' 26' ' ' GLN . 51.0 p 125.38 -73.32 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.871 1 C-N-CA 133.571 4.748 . . . . 0.0 107.647 -166.425 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -141.08 128.2 20.8 Favored 'General case' 0 CA--C 1.556 1.183 0 CA-C-O 116.546 -1.693 . . . . 0.0 112.238 173.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.416 HG12 ' NE ' ' A' ' 35' ' ' ARG 0.258 0.3 OUTLIER -139.52 158.86 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 118.137 2.643 . . . . 0.0 118.137 167.72 . . . . . . . . 4 4 . 1 . 029 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -45.27 135.38 5.9 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -176.105 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.71 -63.35 1.2 Allowed 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -172.568 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' ' 33' ' ' LYS 0.265 13.4 tptp -49.08 -34.73 14.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.734 2.124 . . . . 0.0 116.734 179.018 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.499 ' O ' HG23 ' A' ' 38' ' ' VAL . 87.8 m -54.17 -56.26 19.91 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 174.215 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.416 ' NE ' HG12 ' A' ' 30' ' ' VAL . 19.2 mtt180 -58.64 -45.85 88.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.353 1.461 . . . . 0.0 113.72 -175.89 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -34.47 75.44 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 179.995 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.36 -45.77 37.26 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.889 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.57 HG21 HG21 ' A' ' 23' ' ' VAL . 39.8 t -58.48 -48.26 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.288 177.474 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 40.2 mt-10 -60.12 -44.79 94.61 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.561 2.344 . . . . 0.0 114.569 -178.641 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.88 65.43 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.617 176.366 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.25 -40.98 75.02 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 112.686 -2.052 . . . . 0.0 113.024 176.596 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.6 mtt -60.58 -51.47 69.26 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 125.818 1.647 . . . . 0.0 115.196 -176.943 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.85 98.54 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 113.189 -1.823 . . . . 0.0 111.835 179.585 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -65.03 -40.97 95.61 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 112.523 -2.126 . . . . 0.0 113.954 -176.83 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.415 HD11 ' CB ' ' A' ' 12' ' ' TYR . 43.5 mt -86.25 22.55 1.76 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.827 1.651 . . . . 0.0 115.251 -178.271 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.3 29.55 3.85 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 126.019 1.728 . . . . 0.0 113.376 177.528 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 61.4 t80 -87.27 -176.22 5.57 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.859 -1.518 . . . . 0.0 110.228 -170.978 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.44 HG22 ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -138.05 96.93 10.02 Favored Pre-proline 0 CA--C 1.546 0.804 0 CA-C-O 117.941 -1.028 . . . . 0.0 109.388 -173.207 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.552 ' O ' HG13 ' A' ' 24' ' ' VAL 0.357 0.0 OUTLIER -11.07 -72.07 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.028 1 C-N-CA 126.067 4.512 . . . . 0.0 117.129 -176.125 . . . . . . . . 5 4 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.304 0.2 OUTLIER -88.25 115.17 25.55 Favored 'General case' 0 CA--C 1.558 1.27 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 168.964 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.83 ' HG3' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -60.98 99.1 0.08 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.612 1.165 . . . . 0.0 111.741 167.343 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.9 m -85.02 52.7 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 CA-C-O 122.999 1.381 . . . . 0.0 107.316 -179.748 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -131.99 159.3 39.13 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 113.014 -1.903 . . . . 0.0 113.681 -159.899 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.4 mp0 -111.59 6.85 20.29 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 113.674 -1.603 . . . . 0.0 113.598 172.237 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.8 56.56 3.71 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 123.672 1.701 . . . . 0.0 112.061 178.655 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 pp . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 117.801 2.519 . . . . 0.0 117.801 -174.95 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.454 ' HB2' HH21 ' A' ' 51' ' ' ARG . 58.8 mtt . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.09 151.86 26.88 Favored Pre-proline 0 CA--C 1.554 1.126 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -171.661 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.705 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 32.7 Cg_exo -68.43 -38.8 10.73 Favored 'Trans proline' 0 N--CA 1.487 1.097 0 C-N-CA 122.868 2.378 . . . . 0.0 115.412 -158.702 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.469 0.7 OUTLIER -159.13 151.04 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 O-C-N 125.384 1.678 . . . . 0.0 107.898 -162.217 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.339 2.0 p -67.94 105.11 1.9 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.7 mt -43.56 -21.96 0.04 OUTLIER 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -177.453 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -57.28 -31.43 65.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 120.851 0.358 . . . . 0.0 111.931 169.908 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.486 ' OD2' HD22 ' A' ' 45' ' ' LEU . 13.0 t0 -58.82 -51.09 71.49 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.873 0.869 . . . . 0.0 110.895 170.84 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.8 t -59.14 -43.35 89.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 176.218 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.47 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -55.22 -55.45 31.16 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.944 1.697 . . . . 0.0 112.707 175.619 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -42.21 92.66 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.952 2.101 . . . . 0.0 114.229 -179.536 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.436 ' CB ' HD11 ' A' ' 45' ' ' LEU . 36.5 t80 -66.23 -34.27 77.63 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.119 0.887 . . . . 0.0 110.515 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.21 34.84 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 113.822 -1.536 . . . . 0.0 110.571 179.374 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.63 29.0 60.24 Favored Glycine 0 CA--C 1.546 1.99 0 C-N-CA 127.192 2.329 . . . . 0.0 112.71 172.782 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.32 138.71 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 123.636 0.774 . . . . 0.0 110.483 -167.843 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -46.2 130.26 10.32 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 127.101 2.161 . . . . 0.0 107.139 178.768 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -50.01 -31.63 13.29 Favored 'General case' 0 N--CA 1.503 2.208 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.995 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -50.81 -44.8 59.13 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 124.642 1.214 . . . . 0.0 112.377 177.231 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.621 ' O ' HG23 ' A' ' 23' ' ' VAL 0.756 0.6 OUTLIER -67.79 -40.45 83.92 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.868 . . . . . . . . 4 4 . 1 . 030 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.612 ' O ' HG23 ' A' ' 24' ' ' VAL . 71.6 t -60.98 -50.47 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.221 0.608 . . . . 0.0 110.861 -176.09 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 56.2 p -58.73 -43.44 90.18 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.422 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -59.48 -46.13 89.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 110.621 -2.99 . . . . 0.0 115.861 168.494 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.628 HG11 HG21 ' A' ' 38' ' ' VAL . 63.0 t -59.0 -43.47 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.658 1.183 . . . . 0.0 108.869 -178.175 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 20' ' ' VAL . 90.9 t -50.54 -48.07 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 112.901 -1.954 . . . . 0.0 112.977 -171.228 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.272 97.2 m-20 -99.9 25.82 6.94 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 172.149 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 65.91 5.12 3.28 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 127.51 2.324 . . . . 0.0 116.964 173.837 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 37.94 37.05 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.489 2.716 . . . . 0.0 115.719 -176.049 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.5 p 60.29 -49.54 0.09 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 126.486 1.915 . . . . 0.0 115.774 -163.252 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.266 74.3 m80 -147.83 101.01 3.27 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -175.635 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.43 158.07 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 O-C-N 119.877 -1.764 . . . . 0.0 114.222 170.005 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -57.7 133.31 55.24 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.345 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.22 -54.88 42.04 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -177.155 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.98 -38.74 8.06 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 118.553 2.797 . . . . 0.0 118.553 175.798 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 49.5 m -62.57 -49.02 76.93 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.45 -1.704 . . . . 0.0 107.282 177.987 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.5 OUTLIER -57.57 -46.2 84.26 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 178.076 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.94 -37.09 71.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -178.44 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -77.24 -47.28 20.6 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 112.435 -2.166 . . . . 0.0 111.373 -179.365 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.628 HG21 HG11 ' A' ' 23' ' ' VAL . 47.9 t -62.79 -47.47 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 124.682 1.193 . . . . 0.0 108.009 178.308 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 49.2 mt-10 -54.58 -42.06 70.59 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 128.796 2.838 . . . . 0.0 111.73 -179.974 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.53 66.68 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 112.005 -2.361 . . . . 0.0 110.815 176.666 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.61 -39.03 79.3 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 112.93 -1.941 . . . . 0.0 112.18 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 31.2 mtt -61.04 -49.07 78.89 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.638 -1.164 . . . . 0.0 114.031 -173.044 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.78 98.09 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 112.336 -2.211 . . . . 0.0 111.687 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.97 -37.78 88.46 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 112.292 -2.231 . . . . 0.0 112.785 -178.706 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.486 HD22 ' OD2' ' A' ' 8' ' ' ASP . 47.8 mt -102.03 22.84 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.605 1.962 . . . . 0.0 113.822 -174.29 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 55.16 28.46 11.07 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 174.393 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -99.44 167.49 10.59 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 113.594 -1.639 . . . . 0.0 110.159 -173.053 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.553 HG23 ' O ' ' A' ' 50' ' ' ASN . 0.0 OUTLIER -146.46 123.67 5.95 Favored Pre-proline 0 CA--C 1.555 1.146 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.421 -168.394 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -30.99 -46.34 0.16 Allowed 'Trans proline' 0 N--CA 1.485 0.994 1 C-N-CA 126.07 4.513 . . . . 0.0 116.33 179.855 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.553 ' O ' HG23 ' A' ' 48' ' ' ILE 0.356 5.8 t-20 -103.16 126.15 50.19 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 156.871 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.454 HH21 ' HB2' ' A' ' 1' ' ' MET . 0.0 OUTLIER -74.79 66.68 1.53 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -176.643 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.1 p -123.84 64.07 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.489 177.117 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.705 ' HB3' ' HG3' ' A' ' 3' ' ' PRO . . . -127.28 -155.25 0.68 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.677 179.084 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 63.12 -39.98 0.18 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 178.237 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.289 0.1 OUTLIER -106.84 66.17 0.68 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 124.552 2.12 . . . . 0.0 111.193 173.383 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.0 mt . . . . . 0 N--CA 1.487 1.395 0 CA-C-N 110.621 -2.991 . . . . 0.0 113.271 -165.998 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.6 mtt . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.565 ' HE2' ' HA ' ' A' ' 5' ' ' THR . 85.0 tttt 21.78 67.42 0.31 Allowed Pre-proline 0 N--CA 1.496 1.875 0 C-N-CA 128.854 2.861 . . . . 0.0 108.762 -169.828 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.422 ' HD2' HG22 ' A' ' 48' ' ' ILE 0.254 4.0 Cg_exo -53.57 -10.88 1.72 Allowed 'Trans proline' 0 C--N 1.358 1.069 1 N-CA-C 123.113 4.236 . . . . 0.0 123.113 -172.349 . . . . . . . . 4 3 . 1 . 031 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.386 0.4 OUTLIER -155.3 152.61 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 -178.926 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.565 ' HA ' ' HE2' ' A' ' 2' ' ' LYS . 11.9 p -90.31 120.77 31.73 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.776 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.493 HD22 HG12 ' A' ' 20' ' ' VAL . 18.8 mt -35.64 -22.19 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.978 0 C-N-CA 129.444 3.098 . . . . 0.0 118.666 -174.529 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.447 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 56.8 m-85 -56.27 -36.17 68.27 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.026 0.53 . . . . 0.0 110.793 170.353 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.477 ' OD2' HD22 ' A' ' 45' ' ' LEU . 18.7 t70 -60.75 -49.88 75.7 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 117.946 -1.026 . . . . 0.0 113.194 173.619 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.6 t -56.96 -41.9 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.079 0.952 . . . . 0.0 113.335 172.168 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.02 -53.67 54.28 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 112.836 -1.984 . . . . 0.0 112.349 -179.244 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.447 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.62 -38.64 84.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.718 2.007 . . . . 0.0 114.031 178.164 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.428 ' CB ' HD11 ' A' ' 45' ' ' LEU . 56.2 t80 -66.14 -35.56 80.8 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.192 0.997 . . . . 0.0 110.763 176.58 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.47 -10.62 51.35 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.262 178.292 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.73 25.94 74.98 Favored Glycine 0 N--CA 1.479 1.514 0 C-N-CA 126.795 2.14 . . . . 0.0 112.204 174.109 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.6 p -119.56 132.02 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 123.785 0.834 . . . . 0.0 109.909 -168.683 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.7 p -38.7 124.64 1.37 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 128.933 2.893 . . . . 0.0 107.204 177.626 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.255 36.5 t80 -46.08 -37.45 6.83 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 116.661 2.097 . . . . 0.0 116.661 -171.517 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -52.3 -40.0 61.25 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -178.142 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.488 ' O ' HG23 ' A' ' 23' ' ' VAL . 73.2 p -53.44 -50.15 65.85 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.436 1.094 . . . . 0.0 112.802 175.537 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.663 ' O ' HG23 ' A' ' 24' ' ' VAL . 86.5 t -64.17 -55.44 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.657 -170.588 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.323 13.6 m -62.73 -33.3 74.85 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -43.44 98.81 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 117.225 2.306 . . . . 0.0 117.225 167.697 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.622 HG21 HG21 ' A' ' 38' ' ' VAL . 17.9 t -58.01 -49.01 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 127.157 2.183 . . . . 0.0 108.836 177.656 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 20' ' ' VAL . 69.8 t -56.65 -44.61 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 CA-C-N 110.849 -2.887 . . . . 0.0 111.528 -169.678 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -96.62 11.4 35.42 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 113.444 -1.707 . . . . 0.0 114.178 176.857 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.279 21.8 tt0 60.11 20.74 9.97 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.272 2.629 . . . . 0.0 115.859 177.244 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.8 37.91 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 110.456 -3.065 . . . . 0.0 117.815 -176.639 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.4 t 65.78 -54.3 0.37 Allowed 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.667 1.587 . . . . 0.0 112.233 -163.751 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.256 69.6 m80 -144.82 89.95 2.02 Favored 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.442 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.647 HG13 ' HD2' ' A' ' 35' ' ' ARG . 7.9 p -100.67 146.82 8.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 119.985 -1.697 . . . . 0.0 114.028 174.296 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.05 138.51 58.19 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 174.929 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.98 -55.69 29.91 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -172.778 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.625 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -49.01 -36.01 16.7 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 117.694 2.479 . . . . 0.0 117.694 178.525 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.5 m -60.76 -48.69 80.66 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.417 176.811 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.647 ' HD2' HG13 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -61.49 -39.82 92.35 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 177.797 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -34.41 69.62 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -178.254 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -77.78 -47.68 18.4 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 111.783 -2.462 . . . . 0.0 110.824 -179.941 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.622 HG21 HG21 ' A' ' 23' ' ' VAL . 39.7 t -63.26 -35.87 73.81 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.03 179.958 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 47.8 mt-10 -61.5 -45.58 93.61 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 130.495 3.518 . . . . 0.0 113.394 -176.643 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.21 82.85 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.007 174.988 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 38' ' ' VAL . . . -55.45 -44.72 76.65 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 112.009 -2.36 . . . . 0.0 113.156 175.959 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 49' ' ' PRO . 27.9 mtt -59.36 -50.54 73.58 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.4 1.88 . . . . 0.0 114.892 -179.732 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.62 89.07 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 112.892 -1.958 . . . . 0.0 112.584 179.866 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -66.54 -36.81 83.59 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 113.021 -1.9 . . . . 0.0 113.058 -179.931 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.477 HD22 ' OD2' ' A' ' 8' ' ' ASP . 38.6 mt -92.15 7.09 44.09 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 114.257 177.265 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.337 2.4 p-10 62.42 -49.68 0.17 Allowed 'General case' 0 C--N 1.346 0.428 0 C-N-CA 130.656 3.582 . . . . 0.0 117.374 -173.822 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . 0.268 7.4 t80 29.93 -91.23 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 110.565 -3.016 . . . . 0.0 116.597 -179.271 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.422 HG22 ' HD2' ' A' ' 3' ' ' PRO 0.259 0.0 OUTLIER 123.8 94.08 0.0 OUTLIER Pre-proline 0 N--CA 1.509 2.517 0 C-N-CA 129.362 3.065 . . . . 0.0 111.779 -155.486 . . . . . . . . 4 4 . 1 . 031 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HA ' ' SD ' ' A' ' 42' ' ' MET 0.268 0.1 OUTLIER -22.19 -71.09 0.03 OUTLIER 'Trans proline' 0 CA--C 1.54 0.816 1 C-N-CA 127.357 5.371 . . . . 0.0 120.024 179.748 . . . . . . . . 5 4 . 1 . 031 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.268 4.3 p-10 -92.19 31.5 1.28 Allowed 'General case' 0 N--CA 1.477 0.906 1 N-CA-C 122.811 4.374 . . . . 0.0 122.811 -170.846 . . . . . . . . 3 2 . 1 . 031 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.446 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.5 OUTLIER 52.05 107.78 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 127.302 2.241 . . . . 0.0 112.898 174.707 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 1.7 m -112.53 100.52 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 -179.211 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -24.81 106.63 0.03 OUTLIER 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 -179.35 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -109.87 -70.08 0.83 Allowed 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 113.223 -1.808 . . . . 0.0 108.761 161.342 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.482 ' OE1' HG22 ' A' ' 5' ' ' THR . 0.0 OUTLIER -112.56 107.97 16.89 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.879 -1.509 . . . . 0.0 107.511 165.945 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 N--CA 1.481 1.104 0 CA-C-N 112.052 -2.34 . . . . 0.0 116.072 -163.897 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.6 ptm . . . . . 0 N--CA 1.487 1.395 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.482 ' HB2' ' NH2' ' A' ' 51' ' ' ARG 0.252 0.0 OUTLIER -134.46 162.84 55.28 Favored Pre-proline 0 CA--C 1.547 0.861 0 CA-C-O 116.651 -1.642 . . . . 0.0 115.116 168.733 . . . . . . . . 4 4 . 1 . 032 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -84.41 -52.5 0.03 OUTLIER 'Trans proline' 0 N--CA 1.48 0.716 0 CA-C-N 121.951 1.733 . . . . 0.0 111.887 172.99 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.512 1.2 t -164.51 144.54 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 103.875 -2.639 . . . . 0.0 103.875 -165.08 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 p -94.6 141.13 28.96 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-O 118.65 -0.69 . . . . 0.0 109.232 -173.685 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.454 HD21 ' CE2' ' A' ' 47' ' ' TYR . 10.8 mt -57.61 -13.48 3.96 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 120.499 3.518 . . . . 0.0 120.499 -158.023 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -57.85 -33.43 68.64 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 119.881 1.219 . . . . 0.0 111.622 175.561 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -65.9 -47.61 74.23 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.457 176.978 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.3 t -59.23 -43.84 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.577 0.751 . . . . 0.0 112.207 175.17 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.38 -50.55 73.25 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.07 1.348 . . . . 0.0 113.213 179.101 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -37.68 81.24 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 127.558 2.343 . . . . 0.0 114.196 177.424 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -63.94 -36.21 83.21 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.237 1.015 . . . . 0.0 109.767 175.751 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.12 -15.81 30.86 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.541 -179.142 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.23 19.05 78.85 Favored Glycine 0 N--CA 1.485 1.926 0 C-N-CA 127.451 2.453 . . . . 0.0 113.711 173.899 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -127.43 121.27 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 C-N-CA 124.08 0.952 . . . . 0.0 109.717 -166.536 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -17.06 138.22 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.846 0 C-N-CA 129.533 3.133 . . . . 0.0 112.02 -178.861 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -55.74 -27.8 52.56 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 118.527 -2.608 . . . . 0.0 115.177 170.423 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -54.29 -51.28 65.09 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 116.994 -1.479 . . . . 0.0 111.822 171.646 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.546 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.0 -50.45 73.36 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 179.275 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.613 ' O ' HG23 ' A' ' 24' ' ' VAL 0.293 71.8 t -63.19 -47.39 92.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.493 -173.58 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.6 p -59.2 -42.77 91.72 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -177.93 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 19' ' ' THR . 55.0 mtp85 -59.13 -50.77 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 110.007 -3.27 . . . . 0.0 115.004 168.647 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 19' ' ' THR . 88.6 t -59.28 -44.61 92.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 124.299 1.04 . . . . 0.0 109.281 -176.442 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 20' ' ' VAL . 47.2 t -54.13 -50.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.006 -165.271 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.399 58.2 m-20 -105.31 42.0 1.29 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 172.34 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.52 ' HA ' HH22 ' A' ' 35' ' ' ARG 0.424 17.7 tt0 73.01 -3.28 2.47 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 121.346 3.832 . . . . 0.0 121.346 165.702 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.31 30.72 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 112.077 -2.329 . . . . 0.0 115.372 -176.546 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.8 p 60.96 -53.41 0.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.36 1.864 . . . . 0.0 114.322 -158.648 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -150.99 141.8 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 117.631 -1.175 . . . . 0.0 108.73 -178.964 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.442 HG11 HG22 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -150.33 159.79 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 121.08 1.764 . . . . 0.0 113.713 164.346 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -51.32 139.29 19.46 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 175.569 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.86 -57.56 11.56 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.568 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -41.94 -41.19 2.4 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 177.684 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.6 m -58.5 -48.89 79.3 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 114.256 -1.338 . . . . 0.0 108.676 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.52 HH22 ' HA ' ' A' ' 26' ' ' GLN . 40.2 mtt-85 -60.47 -46.4 90.22 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 125.539 1.536 . . . . 0.0 113.964 -179.956 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -32.04 70.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -178.318 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ttpt -80.46 -41.62 24.08 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 111.338 -2.665 . . . . 0.0 112.516 -178.904 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.47 HG21 HG11 ' A' ' 23' ' ' VAL . 98.4 t -61.79 -51.32 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 126.326 1.85 . . . . 0.0 107.611 172.315 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.08 -41.06 91.63 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.54 1.936 . . . . 0.0 115.133 -175.955 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.3 -51.1 62.91 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 112.329 -2.214 . . . . 0.0 110.751 174.063 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.19 -41.53 84.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.297 -1.774 . . . . 0.0 113.559 176.554 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 mtt -62.58 -44.59 95.94 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -179.894 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.62 98.31 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.875 178.411 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -64.57 -37.86 89.03 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.006 -1.906 . . . . 0.0 112.925 179.855 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 40.8 mt -95.91 16.21 18.35 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.082 2.553 . . . . 0.0 115.135 178.612 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.328 0.1 OUTLIER 45.63 30.11 0.75 Allowed 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.588 2.811 . . . . 0.0 118.588 -178.199 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.454 ' CE2' HD21 ' A' ' 6' ' ' LEU . 84.1 t80 -93.7 88.26 5.76 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 112.25 -2.25 . . . . 0.0 111.422 -163.807 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.405 HG21 HG22 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -7.81 112.83 0.03 OUTLIER Pre-proline 0 N--CA 1.509 2.482 0 CA-C-N 111.378 -2.646 . . . . 0.0 113.278 153.614 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -62.07 67.78 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.74 2.294 . . . . 0.0 115.008 171.088 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 173.56 156.47 0.12 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.594 2.358 . . . . 0.0 110.995 169.414 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.482 ' NH2' ' HB2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -79.47 99.81 7.4 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 118.735 0.698 . . . . 0.0 109.211 166.006 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.446 HG23 ' HA ' ' A' ' 2' ' ' LYS . 6.7 m -83.87 140.11 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 165.21 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -108.34 116.57 32.21 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 -165.348 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.402 ' HB2' ' N ' ' A' ' 2' ' ' LYS . 26.1 tt0 -103.08 -39.07 7.04 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 112.968 -1.924 . . . . 0.0 108.251 161.572 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.409 ' H ' ' CD ' ' A' ' 55' ' ' GLN . 0.6 OUTLIER -43.5 84.27 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 113.852 -1.522 . . . . 0.0 111.147 152.622 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.6 mt . . . . . 0 N--CA 1.482 1.128 0 CA-C-N 111.735 -2.484 . . . . 0.0 112.971 -179.3 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.423 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 105.465 -2.05 . . . . 0.0 105.465 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 1.1 p -60.0 97.02 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 127.053 2.141 . . . . 0.0 107.415 174.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.3 mt -39.95 -19.96 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 119.085 2.994 . . . . 0.0 119.085 -177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -54.85 -35.22 63.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.228 0.611 . . . . 0.0 111.353 166.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -58.01 -48.87 78.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.071 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -58.25 -46.35 88.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 173.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.64 -50.73 69.42 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 112.629 -2.078 . . . . 0.0 111.917 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -43.39 75.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.83 2.452 . . . . 0.0 113.844 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -66.98 -33.7 76.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.266 1.026 . . . . 0.0 110.384 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.08 -9.26 57.03 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.081 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.54 24.45 76.2 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 126.821 2.153 . . . . 0.0 112.477 170.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.9 p -122.77 134.19 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 124.183 0.993 . . . . 0.0 110.665 -170.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.4 p -41.08 128.54 2.8 Favored 'General case' 0 N--CA 1.51 2.558 0 C-N-CA 127.648 2.379 . . . . 0.0 107.751 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -42.98 -31.31 0.5 Allowed 'General case' 0 N--CA 1.523 3.186 0 N-CA-C 116.658 2.096 . . . . 0.0 116.658 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -48.25 -45.16 34.06 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 125.175 1.547 . . . . 0.0 112.149 177.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 23' ' ' VAL . 6.7 p -59.88 -53.98 51.5 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 178.047 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' HG23 ' A' ' 24' ' ' VAL 0.329 79.3 t -59.86 -50.97 78.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.705 0.802 . . . . 0.0 111.25 -163.785 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.508 49.4 m -66.3 -29.01 69.14 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -44.4 92.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 112.429 -2.169 . . . . 0.0 115.736 164.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 38' ' ' VAL . 75.4 t -60.94 -43.9 96.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.564 1.545 . . . . 0.0 108.4 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 20' ' ' VAL . 84.1 t -53.8 -49.07 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.334 -172.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -90.94 14.81 12.78 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 171.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 63.3 14.7 8.05 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.196 2.599 . . . . 0.0 117.819 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 29.06 40.96 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 110.53 -3.032 . . . . 0.0 116.326 -172.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p 56.59 -52.96 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.62 1.968 . . . . 0.0 115.919 -165.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -137.27 117.03 13.08 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 170.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -133.73 154.39 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 120.18 1.355 . . . . 0.0 113.215 169.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 p -59.94 128.62 37.77 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.706 0.802 . . . . 0.0 112.757 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.79 -53.79 36.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -174.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.87 -36.95 8.08 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 42.1 m -60.63 -49.25 78.29 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.509 1.524 . . . . 0.0 108.142 175.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.3 mtp-105 -60.41 -43.49 96.67 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.214 1.806 . . . . 0.0 113.182 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -35.06 70.84 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -77.89 -46.23 21.92 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 112.071 -2.331 . . . . 0.0 111.604 -179.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.464 HG21 HG11 ' A' ' 23' ' ' VAL . 51.1 t -62.52 -47.29 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 C-N-CA 126.169 1.788 . . . . 0.0 108.039 177.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.24 -43.8 79.03 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 128.888 2.875 . . . . 0.0 111.57 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -52.63 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 112.235 -2.257 . . . . 0.0 110.673 176.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.58 -39.68 68.05 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 112.903 -1.953 . . . . 0.0 113.174 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.1 mtt -59.87 -52.81 63.85 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 117.428 2.381 . . . . 0.0 117.428 -173.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.04 96.52 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 112.412 -2.176 . . . . 0.0 112.866 178.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.92 -33.1 75.04 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 111.324 -2.671 . . . . 0.0 113.987 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 65.2 mt -98.78 21.11 11.9 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.996 1.718 . . . . 0.0 113.878 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.17 24.14 7.73 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -99.74 157.26 16.61 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -172.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.358 7.2 mm . . . . . 0 C--N 1.328 -0.326 0 N-CA-C 118.806 2.891 . . . . 0.0 118.806 -177.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.443 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.458 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 p -78.56 114.75 17.75 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 102.706 -3.072 . . . . 0.0 102.706 -174.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.525 HD21 ' CZ ' ' A' ' 47' ' ' TYR . 24.3 mt -48.69 -19.91 0.41 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 70.5 m-85 -54.74 -35.52 63.81 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.382 0.673 . . . . 0.0 111.318 167.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.45 ' OD2' HD22 ' A' ' 45' ' ' LEU . 36.6 t0 -60.76 -47.69 85.19 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.992 172.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HA ' HD13 ' A' ' 45' ' ' LEU . 93.7 t -59.26 -43.06 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.83 -52.84 61.59 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 111.582 -2.553 . . . . 0.0 111.877 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.481 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.4 OUTLIER -65.39 -39.47 92.26 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.387 1.875 . . . . 0.0 113.868 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.427 ' CB ' HD11 ' A' ' 45' ' ' LEU . 33.9 t80 -66.97 -34.32 77.5 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.156 0.91 . . . . 0.0 110.829 177.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.45 -13.46 34.77 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 125.018 1.327 . . . . 0.0 112.099 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.39 26.3 72.27 Favored Glycine 0 CA--C 1.546 2.002 0 C-N-CA 126.674 2.083 . . . . 0.0 112.985 173.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -125.96 136.14 61.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 121.448 0.642 . . . . 0.0 109.865 -171.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.8 p -36.65 128.65 0.82 Allowed 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 128.694 2.798 . . . . 0.0 108.131 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -49.23 -36.55 20.48 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.605 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.522 0.0 OUTLIER -59.48 -27.19 65.9 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 121.734 3.975 . . . . 0.0 121.734 172.695 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 44.3 p -62.58 -52.82 61.88 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.457 1.098 . . . . 0.0 111.796 163.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.648 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.4 t -59.28 -50.29 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.969 1.308 . . . . 0.0 108.532 -173.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.7 p -55.69 -42.47 75.25 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.683 1.193 . . . . 0.0 113.901 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.605 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 40.8 mtt85 -62.06 -47.41 84.8 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 111.817 -2.447 . . . . 0.0 116.328 170.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.498 HG11 HG21 ' A' ' 38' ' ' VAL . 49.1 t -58.28 -41.38 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 C-N-CA 127.048 2.139 . . . . 0.0 107.556 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 20' ' ' VAL . 57.5 t -56.8 -42.55 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.286 -170.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.284 15.1 m120 -101.31 22.99 11.61 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 168.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.389 9.3 pt20 58.47 -0.36 0.12 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 130.988 3.715 . . . . 0.0 119.404 -177.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.09 33.08 0.14 Allowed 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 112.14 -2.3 . . . . 0.0 114.716 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p 59.96 -54.04 0.07 Allowed 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 126.999 2.12 . . . . 0.0 114.432 -159.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -144.41 116.37 8.32 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-N 113.606 -1.634 . . . . 0.0 111.985 -172.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.2 t -146.43 156.49 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 120.254 1.388 . . . . 0.0 113.083 168.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -45.57 133.82 7.55 Favored 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.89 -53.44 52.61 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -49.11 -35.59 16.73 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 117.827 2.529 . . . . 0.0 117.827 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 56.7 m -60.05 -50.24 74.5 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -58.48 -42.5 87.69 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.81 -39.78 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -74.34 -43.79 55.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.531 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.498 HG21 HG11 ' A' ' 23' ' ' VAL . 45.7 t -63.08 -49.1 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 125.83 1.652 . . . . 0.0 108.052 177.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.87 -41.38 82.35 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.251 2.62 . . . . 0.0 114.886 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -49.31 75.1 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 111.311 -2.677 . . . . 0.0 110.325 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.61 -39.86 85.65 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 112.638 -2.074 . . . . 0.0 113.308 175.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.7 mtt -58.89 -51.59 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.68 97.68 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 112.248 -2.251 . . . . 0.0 111.88 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -62.85 -42.51 99.77 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 111.534 -2.575 . . . . 0.0 112.249 -178.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 9' ' ' VAL . 51.8 mt -93.09 23.21 4.44 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.355 1.862 . . . . 0.0 114.02 -177.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 50.4 34.15 8.73 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.955 2.206 . . . . 0.0 116.955 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.525 ' CZ ' HD21 ' A' ' 6' ' ' LEU . 32.0 t80 -96.17 160.69 14.31 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 113.986 -1.461 . . . . 0.0 112.754 -173.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.898 0 CA-C-N 112.556 -2.111 . . . . 0.0 109.048 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 103.448 -2.797 . . . . 0.0 103.448 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.257 80.3 m -61.86 110.46 1.55 Allowed 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 105.202 -2.148 . . . . 0.0 105.202 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -51.85 -17.46 0.97 Allowed 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 176.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.586 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.373 23.1 m-85 -57.78 -29.38 64.8 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 120.28 1.4 . . . . 0.0 112.687 165.652 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -63.43 -50.96 67.72 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.399 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -56.89 -43.04 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 CA-C-O 121.302 0.572 . . . . 0.0 112.418 175.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -61.12 -50.77 71.86 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 112.436 -2.165 . . . . 0.0 111.847 -176.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.586 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -68.78 -40.65 79.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.624 1.97 . . . . 0.0 115.182 175.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -62.79 -33.93 76.21 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.048 1.339 . . . . 0.0 110.079 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.68 -22.64 17.43 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 113.891 -1.504 . . . . 0.0 111.663 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.53 25.35 56.91 Favored Glycine 0 CA--C 1.554 2.524 0 C-N-CA 125.699 1.619 . . . . 0.0 113.18 173.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.538 HG22 HG21 ' A' ' 19' ' ' THR . 6.9 p -126.25 94.5 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.222 0 C-N-CA 122.992 0.517 . . . . 0.0 110.066 -167.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.6 p -7.62 127.11 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.734 0 C-N-CA 127.334 2.254 . . . . 0.0 113.672 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -50.17 -38.89 41.88 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 117.924 2.565 . . . . 0.0 117.924 -171.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -51.2 -40.11 57.98 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 118.906 0.775 . . . . 0.0 112.472 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.538 HG21 HG22 ' A' ' 15' ' ' VAL . 20.4 m -55.39 -53.26 58.48 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.835 2.054 . . . . 0.0 112.169 171.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.675 ' O ' HG23 ' A' ' 24' ' ' VAL . 73.6 t -63.73 -53.42 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-O 118.675 -0.679 . . . . 0.0 109.698 -173.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.413 3.2 m -60.22 -34.09 73.17 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 117.198 2.295 . . . . 0.0 117.198 -177.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 mtp85 -59.06 -49.54 77.51 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.249 -1.796 . . . . 0.0 115.36 166.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.827 HG11 HG21 ' A' ' 38' ' ' VAL . 29.5 t -57.82 -47.24 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 126.533 1.933 . . . . 0.0 108.749 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 20' ' ' VAL . 39.3 t -57.35 -42.07 79.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 O-C-N 126.594 2.434 . . . . 0.0 112.299 -166.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -94.54 15.01 19.04 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 125.209 1.568 . . . . 0.0 112.773 175.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 69.03 9.63 7.51 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.15 2.18 . . . . 0.0 116.571 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.66 38.63 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.789 -2.46 . . . . 0.0 117.197 -173.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.4 p 58.88 -50.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 126.343 1.857 . . . . 0.0 115.758 -164.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -146.86 93.8 2.33 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.44 HG11 ' HD3' ' A' ' 35' ' ' ARG . 11.1 p -116.63 155.34 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.58 124.87 21.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.82 -63.56 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.695 ' HE3' ' H ' ' A' ' 33' ' ' LYS 0.362 0.1 OUTLIER -42.6 -35.63 1.15 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 119.652 3.204 . . . . 0.0 119.652 173.078 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 m -65.46 -50.55 64.95 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 112.879 -1.964 . . . . 0.0 108.178 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.674 ' HD2' HG13 ' A' ' 23' ' ' VAL . 6.5 mmm180 -57.16 -45.79 83.32 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 178.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.59 -36.43 73.99 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.5 ttmt -76.06 -44.32 39.6 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 112.266 -2.243 . . . . 0.0 111.186 -177.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.827 HG21 HG11 ' A' ' 23' ' ' VAL . 55.1 t -63.91 -47.94 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 126.463 1.905 . . . . 0.0 108.18 177.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 46.2 mt-10 -54.55 -44.84 73.21 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.452 2.701 . . . . 0.0 111.405 -178.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.89 69.53 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.142 -2.299 . . . . 0.0 111.0 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.52 -41.37 89.83 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 113.206 -1.816 . . . . 0.0 114.019 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.5 mtt -62.07 -44.83 95.82 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 119.949 -1.719 . . . . 0.0 112.962 -174.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.52 93.49 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 126.271 2.232 . . . . 0.0 111.496 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -65.91 -34.18 77.53 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.914 -2.403 . . . . 0.0 113.351 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.5 mt -97.24 13.92 27.8 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.294 2.237 . . . . 0.0 114.486 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.37 33.75 21.48 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 117.573 2.435 . . . . 0.0 117.573 175.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -92.1 152.68 19.81 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.925 -171.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.294 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.74 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.694 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.53 1.1 t . . . . . 0 N--CA 1.497 1.925 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 40.0 p -95.32 145.33 25.18 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.262 0.937 . . . . 0.0 109.556 -175.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.534 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 4.6 mt -59.94 -14.9 17.94 Favored 'General case' 0 N--CA 1.506 2.343 0 N-CA-C 117.095 2.258 . . . . 0.0 117.095 -163.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.491 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 47.2 m-85 -55.87 -38.42 70.1 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.468 1.485 . . . . 0.0 111.448 174.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -64.73 -44.51 89.94 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.767 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.423 ' HA ' HD13 ' A' ' 45' ' ' LEU . 81.1 t -59.64 -43.61 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-N 118.747 0.703 . . . . 0.0 112.886 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.9 69.94 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 113.173 -1.83 . . . . 0.0 113.394 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.491 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.5 OUTLIER -66.75 -39.55 87.94 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.473 1.909 . . . . 0.0 114.274 174.585 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -63.43 -33.7 76.13 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.414 1.086 . . . . 0.0 110.31 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.28 -19.58 19.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.106 1.362 . . . . 0.0 112.216 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.83 25.1 56.92 Favored Glycine 0 CA--C 1.549 2.216 0 C-N-CA 126.613 2.054 . . . . 0.0 113.399 174.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.471 HG22 HG21 ' A' ' 19' ' ' THR 0.268 3.9 p -129.83 119.16 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.33 0 C-N-CA 124.914 1.285 . . . . 0.0 108.24 -166.482 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.7 p -27.47 143.55 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.344 0 C-N-CA 128.647 2.779 . . . . 0.0 111.849 -174.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' A' ' 6' ' ' LEU . 64.2 t80 -57.62 -34.33 69.19 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 119.238 -2.164 . . . . 0.0 114.665 175.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.266 14.8 tp60 -56.41 -45.95 80.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 117.434 -1.27 . . . . 0.0 112.596 173.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' HG23 ' A' ' 23' ' ' VAL . 86.4 m -53.31 -54.17 40.35 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.885 1.274 . . . . 0.0 111.388 175.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' HG23 ' A' ' 24' ' ' VAL . 70.6 t -64.18 -49.26 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.837 -176.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.281 69.6 p -57.42 -39.38 76.07 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 119.196 3.036 . . . . 0.0 119.196 -174.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 19' ' ' THR . 36.6 mtp85 -61.58 -51.18 69.6 Favored 'General case' 0 C--N 1.319 -0.72 1 CA-C-N 106.857 -4.701 . . . . 0.0 114.198 167.123 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 19' ' ' THR . 95.1 t -58.58 -43.01 86.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.861 1.265 . . . . 0.0 109.764 -176.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 20' ' ' VAL . 75.9 t -49.14 -53.22 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 112.705 -2.043 . . . . 0.0 111.816 -171.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.331 16.4 m120 -107.37 37.43 2.4 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 113.67 -1.605 . . . . 0.0 114.589 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.69 HE21 ' CZ ' ' A' ' 35' ' ' ARG 0.253 2.2 tp60 73.92 -5.46 2.03 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 129.289 3.036 . . . . 0.0 117.873 166.133 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 36.69 36.32 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 113.302 -1.772 . . . . 0.0 115.256 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.0 p 55.31 -48.37 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -151.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.262 71.7 m80 -157.57 130.91 7.77 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -170.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -145.5 150.68 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 116.967 2.21 . . . . 0.0 116.967 162.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.3 p -51.47 139.47 19.88 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -57.48 9.34 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -173.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.523 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -40.2 -43.22 1.63 Allowed 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 176.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.8 m -57.79 -48.79 78.69 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 126.528 1.931 . . . . 0.0 108.577 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.69 ' CZ ' HE21 ' A' ' 26' ' ' GLN . 43.7 mtt-85 -65.33 -44.8 86.63 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 117.475 2.398 . . . . 0.0 117.475 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.21 -29.94 64.15 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -80.31 -42.28 23.31 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 111.381 -2.645 . . . . 0.0 112.048 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.54 -49.7 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 125.686 1.595 . . . . 0.0 109.204 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -55.63 -46.84 77.34 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.605 3.162 . . . . 0.0 111.757 -176.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -51.17 64.02 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.339 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.97 -42.05 84.23 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 112.974 -1.921 . . . . 0.0 114.598 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -56.09 -45.2 79.49 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 178.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.09 -43.74 91.1 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.646 -2.07 . . . . 0.0 113.071 177.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -66.1 -38.46 88.27 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 112.759 -2.019 . . . . 0.0 113.014 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 9' ' ' VAL . 30.3 mt -85.3 13.66 6.25 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 127.089 2.156 . . . . 0.0 113.842 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.401 0.2 OUTLIER 44.99 31.5 0.71 Allowed 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 115.98 1.844 . . . . 0.0 115.98 -176.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -98.59 101.14 12.47 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.058 -160.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.173 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 167.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.434 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.483 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -77.56 107.0 9.71 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 101.388 -3.56 . . . . 0.0 101.388 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.412 HD11 ' OH ' ' A' ' 47' ' ' TYR . 76.8 mt -51.14 -10.24 0.07 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 120.161 3.393 . . . . 0.0 120.161 -175.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -53.75 -31.9 50.23 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.644 0.656 . . . . 0.0 112.221 162.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.76 -52.74 62.99 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 176.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.15 -43.23 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 172.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.05 -51.09 71.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 113.119 -1.855 . . . . 0.0 111.876 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -39.5 91.24 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.219 2.207 . . . . 0.0 114.146 174.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -65.79 -34.05 77.28 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.141 0.977 . . . . 0.0 110.909 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.39 -13.63 37.31 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.829 1.251 . . . . 0.0 111.332 177.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.9 23.12 64.67 Favored Glycine 0 N--CA 1.491 2.32 0 C-N-CA 127.199 2.333 . . . . 0.0 113.387 172.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.49 124.28 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.514 1.126 . . . . 0.0 111.331 -168.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -32.2 129.63 0.18 Allowed 'General case' 0 N--CA 1.526 3.336 0 C-N-CA 125.347 1.459 . . . . 0.0 109.631 175.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -45.26 -34.57 2.93 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 118.318 2.711 . . . . 0.0 118.318 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.675 ' H ' ' NE2' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -50.58 -30.2 12.66 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.436 ' O ' HG23 ' A' ' 23' ' ' VAL . 13.9 p -66.77 -56.67 9.43 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 168.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.661 ' O ' HG23 ' A' ' 24' ' ' VAL . 78.5 t -57.47 -53.48 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 C-N-CA 123.901 0.88 . . . . 0.0 110.237 -164.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 2.0 m -60.93 -35.04 75.68 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -64.51 -47.33 79.3 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 19' ' ' THR . 93.0 t -59.56 -40.9 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.207 1.403 . . . . 0.0 108.851 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 20' ' ' VAL . 91.9 t -51.14 -46.18 31.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 O-C-N 125.461 1.726 . . . . 0.0 111.492 -171.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.303 20.3 m120 -107.42 32.4 4.69 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 173.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 64.52 0.34 1.08 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 130.089 3.355 . . . . 0.0 118.95 175.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.59 35.25 0.18 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 113.064 -1.88 . . . . 0.0 114.698 -173.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.9 p 62.52 -44.95 0.18 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -158.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.298 69.1 m80 -165.51 116.75 1.09 Allowed 'General case' 0 CA--C 1.561 1.395 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 -168.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.561 HG12 ' NH1' ' A' ' 35' ' ' ARG . 1.0 OUTLIER -136.4 162.67 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 159.584 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 p -45.94 135.61 7.13 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.67 -61.1 2.3 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -171.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.3 pptp? -39.69 -37.47 0.52 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 117.82 2.526 . . . . 0.0 117.82 176.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -61.41 -50.03 74.5 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.447 1.499 . . . . 0.0 108.866 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.561 ' NH1' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.82 -43.84 97.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 178.486 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.99 -35.46 76.88 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -80.18 -46.04 17.04 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 112.657 -2.065 . . . . 0.0 112.243 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 HG21 ' A' ' 23' ' ' VAL . 79.7 t -59.91 -49.93 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.527 1.131 . . . . 0.0 108.953 173.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -56.35 -41.54 76.27 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.816 2.046 . . . . 0.0 114.91 -178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.93 -53.28 52.72 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 111.679 -2.51 . . . . 0.0 110.469 175.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.55 -40.45 78.9 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 113.298 -1.773 . . . . 0.0 113.476 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.0 mtt -59.44 -48.55 81.2 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -176.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.88 -41.05 95.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 112.175 -2.284 . . . . 0.0 112.996 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -65.6 -37.18 85.89 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.292 -1.776 . . . . 0.0 113.286 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.9 mt -90.81 14.33 13.89 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.538 2.335 . . . . 0.0 112.878 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.275 3.7 p-10 53.92 19.05 1.82 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 120.029 3.344 . . . . 0.0 120.029 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.412 ' OH ' HD11 ' A' ' 6' ' ' LEU . 42.4 t80 -87.45 91.82 8.87 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 112.243 -2.253 . . . . 0.0 110.887 -169.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.51 2.557 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.236 153.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.378 1.2 t . . . . . 0 N--CA 1.484 1.269 0 CA-C-O 122.134 0.969 . . . . 0.0 108.606 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.417 1.2 m -51.85 109.17 0.34 Allowed 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 131.014 3.725 . . . . 0.0 107.701 175.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -48.71 -24.46 1.39 Allowed 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 117.726 2.491 . . . . 0.0 117.726 171.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.262 54.0 m-85 -61.62 -31.57 71.66 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 168.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.66 -46.56 87.64 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 118.154 -0.927 . . . . 0.0 110.464 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.402 ' HA ' HD13 ' A' ' 45' ' ' LEU . 60.9 t -56.94 -42.74 79.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 174.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.59 -54.9 39.85 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.809 1.644 . . . . 0.0 112.709 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -36.61 84.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.157 1.783 . . . . 0.0 113.387 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -64.93 -37.38 87.45 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.873 0.844 . . . . 0.0 109.859 177.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.66 -10.86 50.09 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.604 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.54 24.19 73.39 Favored Glycine 0 N--CA 1.487 2.061 0 C-N-CA 127.528 2.49 . . . . 0.0 113.431 172.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -125.98 122.49 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.026 0.93 . . . . 0.0 111.879 -167.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.7 p -29.41 121.42 0.15 Allowed 'General case' 0 N--CA 1.524 3.249 0 C-N-CA 127.929 2.491 . . . . 0.0 107.95 171.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -49.85 -27.47 5.14 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.8 tp60 -46.1 -40.51 11.0 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.94 1.4 . . . . 0.0 112.133 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 23' ' ' VAL . 10.4 p -61.07 -55.24 34.92 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 173.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' HG23 ' A' ' 24' ' ' VAL 0.255 74.2 t -59.96 -46.65 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.617 1.167 . . . . 0.0 109.648 -169.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.9 p -59.77 -45.87 90.93 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.5 mtp85 -57.5 -46.47 83.73 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.595 -2.093 . . . . 0.0 114.843 170.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.591 HG21 HG21 ' A' ' 38' ' ' VAL . 79.0 t -60.18 -44.94 96.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.724 1.209 . . . . 0.0 109.089 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 20' ' ' VAL . 82.2 t -52.92 -46.17 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 O-C-N 126.213 2.196 . . . . 0.0 111.269 -169.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.251 16.6 m120 -106.57 27.68 8.58 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 65.7 9.08 5.66 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 118.518 2.785 . . . . 0.0 118.518 171.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 34.25 33.68 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 128.266 2.626 . . . . 0.0 116.423 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 58.84 -42.75 0.07 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 -160.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -149.0 92.78 2.01 Favored 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.7 p -110.18 151.92 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 N-CA-C 117.223 2.305 . . . . 0.0 117.223 171.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -65.07 136.41 56.71 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 176.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.64 -43.38 96.96 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -175.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.792 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -49.85 -45.14 50.12 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 173.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.9 m -64.34 -47.47 79.25 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 112.658 -2.064 . . . . 0.0 108.386 177.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -56.45 -42.46 78.2 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.126 1.37 . . . . 0.0 114.631 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -60.96 -39.83 91.01 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 113.394 -1.73 . . . . 0.0 113.733 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -72.99 -43.59 62.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.661 1.985 . . . . 0.0 111.031 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.591 HG21 HG21 ' A' ' 23' ' ' VAL . 60.8 t -66.08 -48.98 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.087 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.7 mt-10 -52.49 -45.07 66.03 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 130.913 3.685 . . . . 0.0 110.354 -178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.71 -51.14 66.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.172 176.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -46.15 87.16 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.339 -1.755 . . . . 0.0 113.306 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.41 -45.38 80.69 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.679 1.592 . . . . 0.0 112.972 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.57 -46.45 88.3 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 112.903 -1.953 . . . . 0.0 112.34 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -64.43 -38.49 91.2 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.034 -2.348 . . . . 0.0 112.837 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 9' ' ' VAL . 11.4 mt -87.32 11.92 13.2 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.939 2.496 . . . . 0.0 114.185 -178.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.41 0.2 OUTLIER 52.47 23.58 2.6 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.196 2.598 . . . . 0.0 113.388 -176.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -96.56 87.63 4.44 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.386 -1.446 . . . . 0.0 110.52 -159.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.519 2.987 0 CA-C-N 113.178 -1.828 . . . . 0.0 113.509 153.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.308 4.2 p -70.39 97.6 1.29 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -177.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.4 mt -41.49 -14.27 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 -175.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.463 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 49.3 m-85 -53.74 -33.3 55.28 Favored 'General case' 0 CA--C 1.561 1.368 0 O-C-N 123.514 0.508 . . . . 0.0 110.913 165.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -59.07 -52.4 65.89 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 118.474 -0.774 . . . . 0.0 113.024 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 66.5 t -57.99 -45.04 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.506 0.722 . . . . 0.0 112.855 174.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.93 -49.18 78.81 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 113.444 -1.707 . . . . 0.0 112.016 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.463 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.4 OUTLIER -67.82 -43.61 79.2 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.139 1.776 . . . . 0.0 115.198 176.864 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -32.38 74.03 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.792 0.837 . . . . 0.0 111.311 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.7 -17.39 26.84 Favored 'General case' 0 CA--C 1.562 1.408 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.062 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.03 23.42 69.03 Favored Glycine 0 N--CA 1.49 2.264 0 C-N-CA 125.721 1.629 . . . . 0.0 113.524 173.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.449 HG22 HG21 ' A' ' 19' ' ' THR 0.253 4.5 p -123.28 126.07 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.426 0 C-N-CA 124.627 1.171 . . . . 0.0 107.929 -170.119 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' HB ' ' A' ' 19' ' ' THR . 83.2 p -33.24 139.48 0.05 Allowed 'General case' 0 N--CA 1.528 3.432 0 C-N-CA 126.21 1.804 . . . . 0.0 111.269 -177.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.365 55.2 t80 -40.45 -65.87 0.37 Allowed 'General case' 0 N--CA 1.519 3.019 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.551 HE21 ' CZ ' ' A' ' 22' ' ' ARG 0.401 0.0 OUTLIER -58.0 -23.47 54.18 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 121.785 3.994 . . . . 0.0 121.785 -177.39 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.516 ' O ' HG23 ' A' ' 23' ' ' VAL . 83.4 m -53.64 -48.43 69.38 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.595 163.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.584 ' O ' HG23 ' A' ' 24' ' ' VAL . 98.9 t -65.57 -51.31 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.199 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.253 1.3 m -57.26 -36.03 70.47 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -178.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.551 ' CZ ' HE21 ' A' ' 18' ' ' GLN . 10.8 mtt85 -59.21 -49.24 78.6 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 166.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 38' ' ' VAL . 77.3 t -59.41 -41.0 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.454 -176.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 20' ' ' VAL . 92.1 t -54.68 -50.23 61.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.319 0 CA-C-N 112.974 -1.921 . . . . 0.0 112.409 -167.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.398 3.9 m120 -100.6 29.74 4.31 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 170.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.81 14.65 7.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 129.16 2.984 . . . . 0.0 118.445 169.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.04 47.46 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 111.036 -2.802 . . . . 0.0 115.413 -173.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.254 91.5 p 57.32 -59.86 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 126.288 1.835 . . . . 0.0 115.214 -161.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -141.16 94.6 2.72 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -177.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.28 150.68 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 p -60.89 142.06 56.63 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -38.58 -79.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.125 2.17 . . . . 0.0 115.682 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -34.37 55.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 38' ' ' VAL . 47.8 m -61.74 -49.28 77.04 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.618 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.415 ' HB3' ' OE1' ' A' ' 39' ' ' GLU . 12.2 mtm105 -58.39 -53.37 59.02 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.305 1.594 . . . . 0.0 115.305 173.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -50.85 -38.57 49.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -76.82 -47.88 20.13 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 111.242 -2.708 . . . . 0.0 113.127 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 23' ' ' VAL . 43.2 t -61.18 -48.54 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.377 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.415 ' OE1' ' HB3' ' A' ' 35' ' ' ARG . 47.0 mt-10 -57.46 -45.83 84.32 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 128.161 2.584 . . . . 0.0 114.973 -178.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.12 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 112.855 -1.975 . . . . 0.0 110.665 176.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.42 -36.94 74.38 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 112.763 -2.017 . . . . 0.0 115.081 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 20.5 mtt -60.65 -53.33 58.72 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -171.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.31 97.31 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 113.499 -1.682 . . . . 0.0 113.311 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.63 -39.29 93.44 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.264 -2.244 . . . . 0.0 113.693 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.2 mt -94.3 25.3 3.91 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.933 1.693 . . . . 0.0 112.682 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 59.54 21.57 10.12 Favored 'General case' 0 CA--C 1.57 1.741 0 C-N-CA 125.473 1.509 . . . . 0.0 114.32 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -93.19 166.57 12.26 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.956 0.902 . . . . 0.0 110.009 -175.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.702 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.457 1.1 t . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 103.374 -2.825 . . . . 0.0 103.374 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.8 p -101.99 145.44 29.28 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 117.57 -1.652 . . . . 0.0 108.944 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -57.24 -9.58 1.01 Allowed 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -165.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -58.82 -37.56 76.67 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.926 0.784 . . . . 0.0 111.514 170.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.434 ' OD2' HD22 ' A' ' 45' ' ' LEU . 54.1 t0 -62.31 -48.43 79.9 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 118.062 -0.971 . . . . 0.0 111.603 176.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.21 -40.89 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 N-CA-C 112.235 0.458 . . . . 0.0 112.235 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.47 -55.26 36.9 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 125.827 1.651 . . . . 0.0 114.716 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -41.68 94.36 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 127.153 2.181 . . . . 0.0 113.841 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CB ' HD11 ' A' ' 45' ' ' LEU . 35.7 t80 -65.91 -31.47 72.43 Favored 'General case' 0 CA--C 1.551 0.981 0 O-C-N 124.411 1.07 . . . . 0.0 110.592 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.84 -16.86 22.59 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.111 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.94 23.2 59.92 Favored Glycine 0 CA--C 1.547 2.04 0 C-N-CA 126.496 1.998 . . . . 0.0 113.459 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.272 9.9 p -128.54 129.0 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -167.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.8 p -35.44 146.86 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 128.283 2.633 . . . . 0.0 112.181 -172.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -59.37 -32.8 70.46 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 119.192 -2.192 . . . . 0.0 114.648 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.271 27.2 tp60 -55.28 -38.93 69.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 117.473 -1.251 . . . . 0.0 113.01 171.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.459 ' O ' HG23 ' A' ' 23' ' ' VAL . 20.3 m -59.9 -53.39 58.49 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.469 0.708 . . . . 0.0 110.917 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.591 ' O ' HG23 ' A' ' 24' ' ' VAL 0.377 62.7 t -65.52 -43.11 94.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.826 -171.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.9 p -58.31 -48.1 81.6 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.452 HH11 ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -55.07 -53.6 53.82 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 110.932 -2.849 . . . . 0.0 113.491 170.597 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.763 HG11 HG21 ' A' ' 38' ' ' VAL . 76.4 t -62.24 -44.81 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.991 -174.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 20' ' ' VAL . 41.9 t -64.28 -41.64 93.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 CA-C-N 113.771 -1.558 . . . . 0.0 111.23 -168.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -77.22 5.07 9.1 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 113.787 -1.551 . . . . 0.0 113.832 169.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.512 ' OE1' ' HD2' ' A' ' 35' ' ' ARG . 14.9 mm100 69.97 3.68 4.45 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.895 2.478 . . . . 0.0 114.653 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.61 42.35 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 128.745 2.818 . . . . 0.0 116.898 -173.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.259 84.8 p 65.41 -62.19 0.23 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.584 1.954 . . . . 0.0 112.266 -164.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.8 m170 -138.2 137.57 37.7 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 124.2 0.938 . . . . 0.0 109.357 172.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.42 ' CG1' ' HD3' ' A' ' 35' ' ' ARG 0.253 1.4 p -138.21 153.84 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 120.278 1.399 . . . . 0.0 113.671 175.381 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -55.66 126.41 25.31 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.01 -60.88 1.27 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.1 -31.82 69.26 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.7 m -60.5 -48.17 82.92 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.145 1.378 . . . . 0.0 107.506 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.512 ' HD2' ' OE1' ' A' ' 26' ' ' GLN . 2.8 mtp85 -61.14 -44.66 96.98 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 116.773 2.138 . . . . 0.0 116.773 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.61 -34.36 71.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.864 178.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -80.28 -43.52 21.17 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.534 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.763 HG21 HG11 ' A' ' 23' ' ' VAL . 64.1 t -60.82 -48.28 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.549 1.54 . . . . 0.0 107.778 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.57 -40.76 88.4 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.916 2.086 . . . . 0.0 112.623 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.29 -49.66 70.94 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 113.783 -1.553 . . . . 0.0 111.137 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.01 -40.85 77.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 112.055 -2.339 . . . . 0.0 113.432 169.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 28.6 ttm -61.78 -46.24 90.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.632 1.573 . . . . 0.0 112.189 -172.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.44 -48.55 79.17 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.097 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.98 -39.15 93.83 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 113.19 -1.823 . . . . 0.0 113.561 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.444 HD11 ' CB ' ' A' ' 12' ' ' TYR . 61.6 mt -92.03 22.79 4.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -176.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 p30 57.03 19.35 4.6 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 117.624 2.453 . . . . 0.0 117.624 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -85.12 100.11 11.5 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.136 -1.393 . . . . 0.0 112.325 -163.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 116.41 -1.757 . . . . 0.0 113.024 160.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.481 1.1 t . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 100.523 -3.88 . . . . 0.0 100.523 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.7 p -81.31 139.05 35.62 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.895 -1.128 . . . . 0.0 108.491 -162.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.471 HD21 ' CE2' ' A' ' 47' ' ' TYR . 53.8 mt -62.09 -6.2 2.8 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 120.909 3.67 . . . . 0.0 120.909 -155.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.257 70.4 m-85 -57.69 -37.91 74.26 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.319 1.418 . . . . 0.0 111.611 173.357 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.497 ' OD2' HD22 ' A' ' 45' ' ' LEU . 11.1 t70 -55.94 -53.29 58.58 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.1 t -59.95 -44.32 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.129 0.572 . . . . 0.0 111.818 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.07 77.7 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.058 1.343 . . . . 0.0 112.818 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.481 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.9 OUTLIER -69.42 -41.71 76.01 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.91 2.084 . . . . 0.0 114.185 178.095 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -63.96 -35.11 79.61 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.539 1.136 . . . . 0.0 110.003 177.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.81 -19.77 24.28 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.298 1.439 . . . . 0.0 111.528 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.72 28.21 61.53 Favored Glycine 0 N--CA 1.488 2.153 0 C-N-CA 125.721 1.629 . . . . 0.0 112.772 174.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.522 HG22 HG21 ' A' ' 19' ' ' THR 0.27 5.1 p -132.31 123.4 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.191 0 C-N-CA 124.82 1.248 . . . . 0.0 107.707 -170.531 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.7 p -32.46 145.09 0.02 OUTLIER 'General case' 0 N--CA 1.528 3.431 0 C-N-CA 128.005 2.522 . . . . 0.0 111.803 -171.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -57.89 -35.92 71.68 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 119.067 -2.27 . . . . 0.0 115.313 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -57.32 -40.23 77.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 118.772 -0.632 . . . . 0.0 112.187 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.558 ' O ' HG23 ' A' ' 23' ' ' VAL . 57.4 m -55.24 -50.2 70.06 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.685 0.794 . . . . 0.0 110.122 173.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.492 ' O ' HG23 ' A' ' 24' ' ' VAL 0.332 74.2 t -66.54 -42.39 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.174 0.59 . . . . 0.0 112.459 -174.611 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.6 p -63.28 -47.38 82.59 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.406 ' NH2' ' HB1' ' A' ' 27' ' ' ALA . 15.4 mtp85 -51.61 -47.19 63.72 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.395 -2.184 . . . . 0.0 112.996 168.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.577 HG21 HG21 ' A' ' 38' ' ' VAL . 78.6 t -60.18 -48.41 88.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-O 122.035 0.921 . . . . 0.0 110.076 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 20' ' ' VAL . 61.9 t -59.76 -47.98 89.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 112.859 -1.973 . . . . 0.0 111.222 -172.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -84.99 23.13 1.26 Allowed 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.914 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.271 0.0 OUTLIER 59.22 7.79 0.96 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.382 2.673 . . . . 0.0 116.249 174.047 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.406 ' HB1' ' NH2' ' A' ' 22' ' ' ARG . . . 29.47 36.25 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 128.548 2.739 . . . . 0.0 116.075 -167.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p 59.33 -46.88 0.07 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 126.639 1.975 . . . . 0.0 115.759 -162.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -144.1 95.57 2.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.4 p -111.93 150.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -65.77 142.22 58.05 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.25 -69.47 0.11 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -49.62 -36.65 25.1 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 117.779 2.511 . . . . 0.0 117.779 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.2 m -58.82 -52.27 66.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.603 -1.635 . . . . 0.0 108.333 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.0 mtm105 -56.6 -47.52 79.42 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 175.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.09 -34.38 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -178.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.73 -42.95 57.34 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 112.542 -2.117 . . . . 0.0 112.02 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.577 HG21 HG21 ' A' ' 23' ' ' VAL . 60.4 t -64.62 -48.9 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 112.897 -1.956 . . . . 0.0 109.56 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -57.32 -47.15 82.28 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.655 2.782 . . . . 0.0 112.368 -178.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.34 -48.3 80.43 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 112.749 -2.023 . . . . 0.0 110.892 177.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.26 -43.63 88.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.527 -2.124 . . . . 0.0 114.703 175.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.9 mtt -59.28 -46.31 88.87 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.21 -44.35 95.55 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.881 -1.509 . . . . 0.0 112.437 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -61.54 -34.52 75.68 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.107 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.497 HD22 ' OD2' ' A' ' 8' ' ' ASP . 54.5 mt -99.79 13.08 34.94 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.625 2.37 . . . . 0.0 115.269 -177.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.378 0.2 OUTLIER 54.74 18.41 2.1 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 126.778 2.031 . . . . 0.0 115.763 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.471 ' CE2' HD21 ' A' ' 6' ' ' LEU . 61.4 t80 -83.83 102.29 12.24 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.428 -1.42 . . . . 0.0 108.467 -171.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.459 168.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.47 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.205 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.4 p -87.38 142.25 28.02 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.919 -168.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mt -58.94 -12.04 4.07 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 121.511 3.893 . . . . 0.0 121.511 -158.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -60.64 -34.14 73.83 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.557 0.617 . . . . 0.0 110.544 173.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.423 ' OD1' HD22 ' A' ' 45' ' ' LEU . 4.9 t70 -59.4 -50.55 73.51 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 170.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.49 -42.59 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 174.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.93 51.69 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 112.934 -1.939 . . . . 0.0 112.992 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -39.53 93.24 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.57 1.948 . . . . 0.0 114.309 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.483 ' CB ' HD11 ' A' ' 45' ' ' LEU . 41.5 t80 -64.44 -36.12 83.13 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.184 0.994 . . . . 0.0 110.39 176.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.98 -13.94 37.73 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.645 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.75 25.42 69.74 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 127.753 2.597 . . . . 0.0 113.31 172.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.25 128.62 71.73 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 CA-C-O 121.08 0.467 . . . . 0.0 111.894 -167.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.8 p -28.74 124.25 0.12 Allowed 'General case' 0 N--CA 1.52 3.053 0 C-N-CA 128.639 2.775 . . . . 0.0 109.323 174.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -45.31 -39.38 6.57 Favored 'General case' 0 N--CA 1.529 3.476 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.344 0.0 OUTLIER -54.05 -34.7 60.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 118.734 2.864 . . . . 0.0 118.734 -178.912 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' HG23 ' A' ' 23' ' ' VAL . 69.4 p -59.06 -47.11 86.42 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.755 1.222 . . . . 0.0 112.044 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.611 ' O ' HG23 ' A' ' 24' ' ' VAL . 92.6 t -66.02 -54.31 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.546 1.139 . . . . 0.0 109.675 -177.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.511 20.1 m -64.11 -26.89 68.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 19' ' ' THR . 26.2 mtp85 -61.27 -48.43 81.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 110.542 -3.026 . . . . 0.0 115.273 163.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.604 HG21 HG21 ' A' ' 38' ' ' VAL . 54.2 t -57.65 -46.5 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.417 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 20' ' ' VAL . 85.9 t -55.4 -48.04 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.852 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -104.93 19.7 20.11 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.26 2.9 mp0 64.92 14.8 9.53 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 174.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.426 ' HB1' ' CZ ' ' A' ' 22' ' ' ARG . . . 44.36 6.28 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 110.524 -3.035 . . . . 0.0 119.066 175.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.2 t 65.04 -51.76 0.34 Allowed 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 124.224 1.01 . . . . 0.0 110.867 -155.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -130.1 101.94 6.03 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.159 175.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -108.7 134.61 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 176.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.0 p -72.43 133.95 45.14 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.9 -63.38 1.11 Allowed 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.375 0.0 OUTLIER -45.38 -33.38 2.52 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 117.492 2.404 . . . . 0.0 117.492 178.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 38' ' ' VAL . 28.8 m -62.56 -49.73 74.1 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 -176.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -56.64 -45.16 81.76 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.202 1.801 . . . . 0.0 112.884 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.44 -38.21 83.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 113.759 -1.564 . . . . 0.0 113.844 -175.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 ttpt -78.19 -44.96 24.35 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 126.93 2.092 . . . . 0.0 110.415 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.604 HG21 HG21 ' A' ' 23' ' ' VAL . 49.0 t -62.05 -45.71 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.647 1.579 . . . . 0.0 108.233 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.01 -43.12 69.82 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.228 3.011 . . . . 0.0 113.058 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.43 -50.02 71.43 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 111.548 -2.569 . . . . 0.0 110.96 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.92 -45.7 86.14 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.758 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.563 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -58.69 -47.53 84.22 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.069 2.148 . . . . 0.0 113.885 -177.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.33 85.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 113.145 -1.843 . . . . 0.0 111.527 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -66.54 -37.4 84.91 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.317 -178.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.483 HD11 ' CB ' ' A' ' 12' ' ' TYR . 57.5 mt -88.83 14.28 10.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 178.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 53.48 28.54 7.76 Favored 'General case' 0 CA--C 1.57 1.725 0 C-N-CA 126.602 1.961 . . . . 0.0 113.62 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.563 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 27.7 t80 -89.51 169.27 11.5 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.543 -168.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.384 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -178.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 104.886 -2.265 . . . . 0.0 104.886 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.274 1.1 p -66.96 97.08 0.46 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.4 mt -36.35 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.623 0 N-CA-C 118.882 2.919 . . . . 0.0 118.882 -176.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.419 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 51.7 m-85 -54.94 -33.46 62.27 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.574 1.079 . . . . 0.0 110.863 167.206 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -56.44 -52.79 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.939 172.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.53 -44.89 90.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.652 0.66 . . . . 0.0 112.003 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.11 -50.03 74.9 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.37 -178.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.419 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.7 OUTLIER -67.76 -43.23 80.34 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.339 1.856 . . . . 0.0 115.497 174.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -65.47 -34.63 78.73 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.468 1.107 . . . . 0.0 111.131 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -17.95 25.36 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.801 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.46 26.02 68.9 Favored Glycine 0 N--CA 1.485 1.935 0 C-N-CA 125.822 1.677 . . . . 0.0 113.038 174.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.577 HG22 HG21 ' A' ' 19' ' ' THR . 5.4 p -129.64 108.38 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -169.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.8 p -17.27 145.93 0.0 OUTLIER 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 127.051 2.14 . . . . 0.0 114.516 -174.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -52.32 -46.67 66.1 Favored 'General case' 0 N--CA 1.52 3.042 0 O-C-N 119.758 -1.839 . . . . 0.0 114.129 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.54 -41.94 61.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.435 1.084 . . . . 0.0 112.516 177.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.577 HG21 HG22 ' A' ' 15' ' ' VAL . 52.2 m -57.33 -50.7 72.1 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.296 1.039 . . . . 0.0 111.998 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 24' ' ' VAL . 88.5 t -65.16 -51.0 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.044 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m -58.02 -32.79 68.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.385 1.074 . . . . 0.0 112.645 -177.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.9 mtp85 -65.28 -49.44 69.54 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 168.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.541 HG21 HG21 ' A' ' 38' ' ' VAL . 58.3 t -62.08 -38.11 80.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.707 -178.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 20' ' ' VAL . 51.3 t -48.65 -54.33 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.578 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -87.37 16.15 5.67 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.175 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.678 ' HA ' HH12 ' A' ' 35' ' ' ARG 0.375 0.2 OUTLIER 69.19 -1.42 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 130.212 3.405 . . . . 0.0 118.494 177.758 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 5.83 51.32 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 109.738 -3.392 . . . . 0.0 118.086 -164.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t 63.58 -57.29 0.19 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 110.95 -2.841 . . . . 0.0 115.427 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -130.59 21.64 5.1 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -163.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.321 93.6 t -74.06 111.68 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 N-CA-C 119.509 3.152 . . . . 0.0 119.509 -160.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 m -13.16 132.34 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.27 -2.241 . . . . 0.0 116.074 -174.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.64 -55.43 11.29 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -172.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.16 -49.48 42.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 117.936 2.569 . . . . 0.0 117.936 173.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 38' ' ' VAL . 61.6 m -55.96 -49.53 73.3 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.254 1.021 . . . . 0.0 108.609 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.678 HH12 ' HA ' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -58.42 -47.68 83.15 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 176.663 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.05 79.83 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -79.65 -42.21 25.29 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 112.662 -2.063 . . . . 0.0 112.534 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.541 HG21 HG21 ' A' ' 23' ' ' VAL . 59.9 t -60.84 -50.81 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 174.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -55.9 -44.24 78.01 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.631 2.773 . . . . 0.0 112.738 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.8 -51.27 65.54 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.673 -2.058 . . . . 0.0 110.83 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.46 84.37 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 112.935 -1.939 . . . . 0.0 113.356 175.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.406 ' HG3' HG12 ' A' ' 38' ' ' VAL . 4.9 mtt -59.17 -49.32 78.3 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -174.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.87 98.12 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 111.865 -2.425 . . . . 0.0 113.131 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.12 -38.15 87.48 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 112.525 -2.125 . . . . 0.0 114.022 -176.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.2 mt -94.91 21.82 7.17 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 126.717 2.007 . . . . 0.0 113.314 -174.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.59 25.98 13.86 Favored 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -98.48 166.45 11.35 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.075 -1.42 . . . . 0.0 108.311 -171.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.952 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.995 -174.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.387 0.5 OUTLIER . . . . . 0 CA--C 1.554 1.123 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 5.0 p -80.93 102.97 10.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 102.636 -3.098 . . . . 0.0 102.636 177.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -46.36 -13.79 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.829 0 N-CA-C 118.681 2.845 . . . . 0.0 118.681 -174.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 47.9 m-85 -53.99 -32.75 55.04 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 118.44 0.564 . . . . 0.0 111.2 165.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.433 ' OD2' HD22 ' A' ' 45' ' ' LEU . 10.4 t70 -57.9 -50.27 73.92 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.2 t -59.27 -43.32 89.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 118.492 0.587 . . . . 0.0 111.771 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.19 -49.94 75.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.638 -175.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.414 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -68.79 -41.77 78.3 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.894 2.078 . . . . 0.0 114.718 175.378 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -63.9 -33.66 76.21 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.975 0.91 . . . . 0.0 110.88 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.89 -18.73 22.44 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-N 113.497 -1.683 . . . . 0.0 111.037 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.24 26.78 56.96 Favored Glycine 0 N--CA 1.487 2.088 0 C-N-CA 126.383 1.945 . . . . 0.0 113.703 173.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.61 HG21 HG23 ' A' ' 34' ' ' THR . 9.1 p -125.6 114.84 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 124.326 1.051 . . . . 0.0 110.932 -170.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -21.73 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 128.636 2.774 . . . . 0.0 110.989 175.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -42.23 -40.55 2.44 Favored 'General case' 0 N--CA 1.52 3.052 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -50.35 -38.91 44.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.582 1.176 . . . . 0.0 113.611 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.645 ' O ' HG23 ' A' ' 23' ' ' VAL 0.256 24.3 p -62.7 -51.23 68.03 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 173.283 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.411 76.5 t -59.54 -41.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.867 0.867 . . . . 0.0 112.53 -167.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.72 -38.12 89.91 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 19' ' ' THR . 22.2 mtp85 -62.97 -38.54 91.51 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 172.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.809 HG21 HG21 ' A' ' 38' ' ' VAL . 97.2 t -56.97 -47.82 82.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 126.717 2.007 . . . . 0.0 108.824 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.3 t -59.37 -55.96 20.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 109.285 -3.598 . . . . 0.0 114.303 -169.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -82.92 0.5 44.09 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 125.464 1.728 . . . . 0.0 114.336 175.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 55.0 36.93 28.05 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 124.744 2.212 . . . . 0.0 110.184 -170.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.381 . . -68.79 84.14 0.3 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 118.821 2.897 . . . . 0.0 118.821 -165.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 57.8 p 80.43 -88.76 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.728 169.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -112.36 44.05 1.51 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.862 HG23 ' HE ' ' A' ' 35' ' ' ARG . 4.3 p -34.07 135.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 111.931 -2.395 . . . . 0.0 113.246 151.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.73 ' H ' ' CZ ' ' A' ' 35' ' ' ARG . 45.4 t -111.23 126.43 54.86 Favored 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -170.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.03 -59.66 1.67 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -47.37 83.41 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.61 HG23 HG21 ' A' ' 15' ' ' VAL . 28.6 m -58.4 -48.26 81.22 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 112.605 -2.088 . . . . 0.0 105.599 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.862 ' HE ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -57.4 -39.42 76.07 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 113.798 -1.546 . . . . 0.0 115.06 -174.791 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -62.58 -40.82 98.12 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.453 -1.703 . . . . 0.0 114.269 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -75.56 -40.97 56.02 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.47 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.809 HG21 HG21 ' A' ' 23' ' ' VAL . 20.6 t -62.2 -48.92 86.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 127.486 2.314 . . . . 0.0 106.638 176.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -55.6 -43.31 75.93 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 128.409 2.683 . . . . 0.0 113.786 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.19 -51.65 62.71 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 110.73 -2.941 . . . . 0.0 110.4 172.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.87 -54.77 40.63 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.828 ' HB2' ' HB3' ' A' ' 47' ' ' TYR 0.36 0.0 OUTLIER -64.29 -25.55 68.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 -174.66 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.17 -47.62 73.39 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.82 172.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.95 -34.2 75.68 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.588 1.555 . . . . 0.0 112.558 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.433 HD22 ' OD2' ' A' ' 8' ' ' ASP . 36.6 mt -95.68 7.24 46.84 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.304 2.642 . . . . 0.0 115.344 -176.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.416 0.2 OUTLIER 60.4 14.57 4.83 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 178.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.828 ' HB3' ' HB2' ' A' ' 42' ' ' MET . 83.6 t80 -73.44 105.37 4.78 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 C-N-CA 118.484 -1.286 . . . . 0.0 112.741 163.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.416 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -90.83 135.68 33.57 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 103.324 -2.843 . . . . 0.0 103.324 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.672 ' HB2' ' HE1' ' A' ' 17' ' ' TYR . 20.1 mt -54.91 -18.55 5.1 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 128.945 2.898 . . . . 0.0 116.053 -162.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -55.03 -33.57 62.78 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 119.566 1.076 . . . . 0.0 111.142 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -65.55 -47.83 74.52 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.169 176.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.5 t -55.79 -45.9 79.66 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 124.516 1.126 . . . . 0.0 112.625 173.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.05 -54.98 36.18 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 126.172 1.789 . . . . 0.0 112.671 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -38.07 89.75 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.123 1.769 . . . . 0.0 113.728 177.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.23 -34.8 78.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.022 1.329 . . . . 0.0 110.7 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.62 -4.57 55.11 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.13 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 70.15 23.45 77.21 Favored Glycine 0 N--CA 1.492 2.374 0 C-N-CA 127.274 2.368 . . . . 0.0 113.089 172.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.252 8.8 p -123.73 137.02 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -166.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 p -55.03 138.12 44.73 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.842 1.257 . . . . 0.0 109.013 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.672 ' HE1' ' HB2' ' A' ' 6' ' ' LEU . 72.9 t80 -49.95 -28.56 6.95 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -172.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 -46.96 -47.38 21.8 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 124.853 1.345 . . . . 0.0 112.292 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 23' ' ' VAL . 65.3 p -58.78 -51.81 68.4 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.638 ' O ' HG23 ' A' ' 24' ' ' VAL . 89.1 t -62.96 -51.82 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.817 1.647 . . . . 0.0 109.549 -173.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.8 t -59.13 -41.23 87.73 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 19' ' ' THR . 19.6 mtp85 -60.25 -45.2 94.08 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 113.804 -1.543 . . . . 0.0 114.854 173.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.626 HG21 HG21 ' A' ' 38' ' ' VAL . 42.6 t -57.56 -44.04 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.631 1.972 . . . . 0.0 109.277 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 20' ' ' VAL . 75.0 t -58.07 -42.05 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 CA-C-N 111.315 -2.675 . . . . 0.0 112.491 -171.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -91.38 4.22 52.97 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 113.529 -1.668 . . . . 0.0 113.354 173.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.433 ' OE1' HG12 ' A' ' 30' ' ' VAL . 1.1 tm0? 58.1 17.18 4.31 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 128.852 2.861 . . . . 0.0 114.63 -173.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.59 38.55 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 110.615 -2.993 . . . . 0.0 116.307 -174.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 97.6 p 55.36 -28.86 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 119.246 3.054 . . . . 0.0 119.246 -160.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -161.85 80.04 0.56 Allowed 'General case' 0 CA--C 1.564 1.501 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 -161.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.433 HG12 ' OE1' ' A' ' 26' ' ' GLN . 8.8 p -117.27 147.26 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 120.452 -1.405 . . . . 0.0 114.674 -179.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.4 p -63.06 135.11 57.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.042 0.937 . . . . 0.0 113.458 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.15 -66.23 0.43 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.309 1.6 pptp? -48.02 -33.22 7.64 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 120.299 3.444 . . . . 0.0 120.299 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -61.77 -49.67 75.45 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.608 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 14.2 mtm105 -57.83 -46.89 84.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.39 -36.09 70.84 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -75.54 -44.1 45.27 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.493 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.626 HG21 HG21 ' A' ' 23' ' ' VAL . 48.7 t -63.93 -45.24 97.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.415 176.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 45.5 mt-10 -55.39 -43.78 75.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 129.532 3.133 . . . . 0.0 111.784 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.11 -50.93 66.36 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.469 -1.696 . . . . 0.0 111.583 175.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.36 89.02 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 113.547 -1.66 . . . . 0.0 114.137 176.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.409 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 0.7 OUTLIER -57.61 -45.21 85.64 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.926 1.69 . . . . 0.0 114.356 179.833 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.98 -46.31 85.18 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 113.553 -1.658 . . . . 0.0 111.035 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -64.81 -37.27 87.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 113.122 -1.854 . . . . 0.0 113.726 -178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.9 mt -96.37 17.82 15.2 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.94 2.496 . . . . 0.0 114.391 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.383 0.2 OUTLIER 51.41 21.74 1.28 Allowed 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 127.402 2.281 . . . . 0.0 115.772 177.436 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.409 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 27.8 t80 -74.72 154.72 38.29 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.436 -0.79 . . . . 0.0 110.54 -168.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.718 0 CA-C-N 112.181 -2.282 . . . . 0.0 111.813 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.487 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 102.121 -3.289 . . . . 0.0 102.121 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -93.85 134.16 36.51 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.079 -1.013 . . . . 0.0 108.39 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.486 HD21 ' CZ ' ' A' ' 47' ' ' TYR . 14.6 mt -48.45 -17.69 0.18 Allowed 'General case' 0 N--CA 1.511 2.603 0 N-CA-C 118.454 2.761 . . . . 0.0 118.454 -163.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 45.5 m-85 -58.1 -35.38 71.35 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.78 0.718 . . . . 0.0 111.316 172.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -64.18 -45.77 86.92 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 117.525 -1.226 . . . . 0.0 111.339 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.63 ' HA ' HD13 ' A' ' 45' ' ' LEU . 71.2 t -57.61 -42.22 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 CA-C-N 119.052 0.842 . . . . 0.0 112.987 174.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.484 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -62.18 -52.98 61.62 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 111.646 -2.525 . . . . 0.0 111.748 -176.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.405 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.67 -38.07 83.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.202 2.201 . . . . 0.0 113.204 177.491 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.427 ' CB ' HD11 ' A' ' 45' ' ' LEU . 30.1 t80 -64.35 -35.39 80.73 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.417 1.487 . . . . 0.0 109.521 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.15 -18.32 24.67 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.876 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.44 29.54 57.95 Favored Glycine 0 N--CA 1.49 2.24 0 C-N-CA 126.391 1.948 . . . . 0.0 113.003 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.1 p -125.36 137.9 56.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 123.908 0.883 . . . . 0.0 109.028 -170.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.0 p -43.41 122.07 2.48 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 127.038 2.135 . . . . 0.0 107.852 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -33.05 -48.76 0.22 Allowed 'General case' 0 N--CA 1.524 3.241 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.554 0.0 OUTLIER -57.84 -20.98 40.11 Favored 'General case' 0 C--N 1.314 -0.963 1 N-CA-C 124.232 4.901 . . . . 0.0 124.232 -179.956 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' HG23 ' A' ' 23' ' ' VAL 0.696 0.7 OUTLIER -76.56 -43.56 38.43 Favored 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 160.753 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' HG23 ' A' ' 24' ' ' VAL . 77.4 t -59.72 -49.39 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.635 -176.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.3 p -58.01 -44.43 87.26 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -173.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -60.36 -47.39 86.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 108.695 -3.866 . . . . 0.0 114.852 168.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 19' ' ' THR . 91.4 t -59.19 -40.66 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -176.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 20' ' ' VAL . 68.5 t -53.62 -50.0 52.89 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 CA-C-N 113.914 -1.493 . . . . 0.0 112.966 -172.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.308 3.7 m120 -99.34 27.78 4.98 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 123.103 1.43 . . . . 0.0 114.706 170.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 71.31 -16.58 0.36 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 131.589 3.956 . . . . 0.0 116.583 173.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 45.18 37.93 2.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.113 2.165 . . . . 0.0 111.781 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.2 p 57.55 -46.34 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.751 -2.022 . . . . 0.0 115.821 -150.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -154.73 109.82 3.07 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.192 -165.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.638 ' H ' ' NH2' ' A' ' 35' ' ' ARG . 25.3 t -132.97 132.55 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 120.628 1.558 . . . . 0.0 114.763 157.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -16.16 135.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 175.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 35' ' ' ARG . . . -59.93 -49.08 79.08 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.559 1.144 . . . . 0.0 113.416 -173.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -44.2 43.65 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 175.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.0 m -62.03 -51.27 68.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 113.068 -1.878 . . . . 0.0 108.273 175.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.638 ' NH2' ' H ' ' A' ' 30' ' ' VAL . 38.3 mtt-85 -53.87 -46.81 71.42 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.386 1.074 . . . . 0.0 113.856 178.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.88 -37.42 76.52 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.792 -1.095 . . . . 0.0 113.539 -176.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -76.44 -45.3 32.02 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.741 -2.027 . . . . 0.0 111.908 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.4 t -61.29 -47.91 91.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-N 113.884 -1.507 . . . . 0.0 108.513 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -58.53 -46.12 87.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.009 3.324 . . . . 0.0 111.503 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.54 -48.98 73.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 113.434 -1.712 . . . . 0.0 110.873 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.8 -43.94 86.01 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 112.95 -1.932 . . . . 0.0 112.661 173.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.499 ' HG2' ' HD2' ' A' ' 47' ' ' TYR . 9.9 mtt -55.04 -46.65 75.33 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 125.436 1.495 . . . . 0.0 112.169 -178.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -47.45 83.26 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 112.951 -1.931 . . . . 0.0 111.731 -175.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -61.03 -40.31 93.09 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 112.413 -2.176 . . . . 0.0 112.916 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 9' ' ' VAL . 19.4 mt -87.13 6.23 33.81 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 128.393 2.677 . . . . 0.0 116.645 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.43 0.2 OUTLIER 52.6 23.1 2.45 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 128.09 2.556 . . . . 0.0 113.792 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.499 ' HD2' ' HG2' ' A' ' 42' ' ' MET . 51.8 t80 -82.05 97.96 8.4 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 118.614 -2.554 . . . . 0.0 110.824 -172.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.633 155.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.327 0.5 OUTLIER . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 p -67.81 147.15 52.96 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -152.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.542 ' HB2' ' HE2' ' A' ' 17' ' ' TYR . 11.8 mt -48.89 -17.54 0.2 Allowed 'General case' 0 N--CA 1.517 2.889 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 -162.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.425 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 30.3 m-85 -60.83 -40.58 93.32 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 118.596 0.635 . . . . 0.0 111.241 179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.427 ' OD2' HD22 ' A' ' 45' ' ' LEU . 6.4 t70 -51.81 -55.86 17.37 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.299 1.04 . . . . 0.0 112.057 166.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.6 t -58.94 -39.72 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 7' ' ' TYR . . . -58.07 -55.57 33.18 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 126.384 1.873 . . . . 0.0 112.701 172.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -38.37 89.3 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.52 1.928 . . . . 0.0 114.237 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.422 ' CG ' HD11 ' A' ' 45' ' ' LEU . 43.2 t80 -64.57 -37.28 87.02 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.466 1.107 . . . . 0.0 109.808 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.17 -12.33 44.23 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.829 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 26.61 67.57 Favored Glycine 0 CA--C 1.549 2.169 0 C-N-CA 127.533 2.492 . . . . 0.0 113.337 172.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.0 p -124.06 132.08 71.9 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 123.909 0.883 . . . . 0.0 110.663 -171.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -36.79 127.76 0.86 Allowed 'General case' 0 N--CA 1.522 3.137 0 C-N-CA 126.638 1.975 . . . . 0.0 108.952 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.542 ' HE2' ' HB2' ' A' ' 6' ' ' LEU . 58.7 t80 -48.05 -33.0 7.41 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 115.848 1.795 . . . . 0.0 115.848 176.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -52.38 -46.19 66.11 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-O 117.115 -1.421 . . . . 0.0 111.315 175.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.574 ' O ' HG23 ' A' ' 23' ' ' VAL 0.905 0.6 OUTLIER -67.86 -40.01 83.68 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.963 2.209 . . . . 0.0 116.963 176.544 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.65 ' O ' HG23 ' A' ' 24' ' ' VAL 0.278 78.2 t -59.61 -46.79 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 117.294 -1.336 . . . . 0.0 110.279 -177.614 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.347 3.5 m -68.08 -29.7 68.71 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 120.358 3.466 . . . . 0.0 120.358 -174.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 19' ' ' THR . 33.7 mtp85 -63.91 -52.18 61.08 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 110.808 -2.905 . . . . 0.0 113.184 162.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.736 HG22 HG21 ' A' ' 30' ' ' VAL . 62.8 t -62.39 -42.27 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 C-N-CA 124.488 1.115 . . . . 0.0 110.255 -172.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 20' ' ' VAL . 52.3 t -51.65 -54.87 10.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 O-C-N 125.418 1.699 . . . . 0.0 111.112 -162.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.289 17.7 m120 -105.89 42.01 1.32 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 113.948 -1.478 . . . . 0.0 112.858 176.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.384 10.6 pt20 80.97 -9.97 1.27 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.546 3.539 . . . . 0.0 118.417 163.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.36 30.55 0.08 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.717 2.007 . . . . 0.0 115.075 -168.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.9 p 61.02 -44.82 0.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 115.98 1.845 . . . . 0.0 115.98 -155.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.276 78.4 m80 -152.53 126.4 9.0 Favored 'General case' 0 CA--C 1.558 1.275 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -170.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.736 HG21 HG22 ' A' ' 23' ' ' VAL . 3.7 p -141.53 162.75 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.568 0 CA-C-N 120.157 1.344 . . . . 0.0 112.656 170.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -59.45 130.03 44.88 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 170.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.93 -59.53 4.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -175.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.6 tptp -41.41 -41.3 1.98 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.7 m -58.51 -47.0 85.59 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 113.639 -1.619 . . . . 0.0 109.173 -178.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.6 mmt85 -55.34 -45.19 76.43 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -35.13 76.05 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -78.55 -42.3 29.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 112.477 -2.147 . . . . 0.0 112.217 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.401 HG21 HG11 ' A' ' 23' ' ' VAL . 84.3 t -60.83 -50.8 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.007 1.723 . . . . 0.0 108.059 173.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -54.95 -44.9 74.77 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 125.327 1.451 . . . . 0.0 112.922 -178.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.89 -49.26 71.18 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 112.479 -2.146 . . . . 0.0 111.213 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.17 -45.59 83.52 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 113.581 -1.645 . . . . 0.0 113.249 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.489 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.1 mmt -60.11 -47.39 86.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.667 -1.151 . . . . 0.0 114.019 -177.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 113.27 -1.786 . . . . 0.0 111.449 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -64.78 -40.62 95.56 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.027 -2.351 . . . . 0.0 112.358 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.427 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.3 mt -85.78 6.67 26.93 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 127.81 2.444 . . . . 0.0 112.517 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.474 0.2 OUTLIER 44.16 34.05 0.92 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -171.257 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 60.7 t80 -98.34 88.46 4.16 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 111.324 -2.671 . . . . 0.0 108.778 -166.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.853 0 CA-C-N 111.65 -2.523 . . . . 0.0 114.219 155.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.5 OUTLIER . . . . . 0 CA--C 1.558 1.268 0 N-CA-C 102.578 -3.119 . . . . 0.0 102.578 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.337 0.8 OUTLIER -71.09 106.09 3.6 Favored 'General case' 0 CA--C 1.563 1.475 0 N-CA-C 101.75 -3.426 . . . . 0.0 101.75 -179.392 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.7 mt -45.48 -16.3 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.894 0 N-CA-C 118.341 2.719 . . . . 0.0 118.341 -179.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.61 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.314 56.4 m-85 -54.54 -32.5 58.37 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.621 1.555 . . . . 0.0 111.447 166.395 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.516 ' OD2' HD22 ' A' ' 45' ' ' LEU . 23.3 t0 -60.19 -49.67 76.71 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.327 175.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.98 -46.25 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 174.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.75 -49.51 77.44 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 111.67 -2.513 . . . . 0.0 111.66 -176.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.61 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.7 OUTLIER -67.89 -43.09 80.14 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.629 2.372 . . . . 0.0 114.678 177.243 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -63.24 -32.89 74.41 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.864 0.728 . . . . 0.0 110.601 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.75 -16.44 25.43 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 113.94 -1.482 . . . . 0.0 111.723 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.77 25.78 66.5 Favored Glycine 0 CA--C 1.55 2.24 0 C-N-CA 126.56 2.028 . . . . 0.0 113.618 173.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.428 HG22 HG21 ' A' ' 19' ' ' THR 0.276 4.3 p -129.94 125.12 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.511 0 C-N-CA 124.115 0.966 . . . . 0.0 108.394 -167.012 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -32.96 139.26 0.05 Allowed 'General case' 0 N--CA 1.526 3.37 0 C-N-CA 127.507 2.323 . . . . 0.0 111.274 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -52.52 -41.73 63.71 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-N 121.117 1.78 . . . . 0.0 115.047 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.667 HE21 ' CZ ' ' A' ' 22' ' ' ARG 0.529 0.0 OUTLIER -61.77 -30.51 70.84 Favored 'General case' 0 C--N 1.318 -0.77 1 N-CA-C 122.718 4.34 . . . . 0.0 122.718 175.331 . . . . . . . . 5 4 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 23' ' ' VAL . 87.4 m -55.19 -49.34 72.16 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 112.801 -2.0 . . . . 0.0 109.581 162.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.681 ' O ' HG23 ' A' ' 24' ' ' VAL 0.284 73.9 t -64.67 -48.06 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.772 -178.15 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.338 3.3 m -63.37 -33.24 75.12 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.667 ' CZ ' HE21 ' A' ' 18' ' ' GLN . 20.7 mtt85 -60.9 -48.84 79.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.085 -1.87 . . . . 0.0 114.354 167.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.568 HG21 HG21 ' A' ' 38' ' ' VAL . 89.7 t -61.07 -39.98 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.695 1.198 . . . . 0.0 108.954 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 20' ' ' VAL . 42.1 t -55.28 -42.53 66.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-N 113.53 -1.668 . . . . 0.0 112.996 -170.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.12 19.4 19.62 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 171.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.28 0.7 OUTLIER 65.47 11.65 7.56 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 129.459 3.104 . . . . 0.0 118.731 176.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.73 42.08 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 110.57 -3.014 . . . . 0.0 116.096 -173.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.275 69.7 m 58.14 -44.45 0.05 Allowed 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 117.906 2.558 . . . . 0.0 117.906 -165.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -152.68 101.32 2.62 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.276 4.2 p -132.04 147.82 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -57.21 143.09 40.53 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -172.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.35 -67.16 0.31 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -40.63 66.77 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -177.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.556 ' O ' HG23 ' A' ' 38' ' ' VAL . 36.8 m -56.95 -52.47 65.09 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 113.058 -1.883 . . . . 0.0 106.938 177.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm105 -61.39 -48.55 80.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.792 1.237 . . . . 0.0 114.265 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.11 86.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.294 1.837 . . . . 0.0 114.826 -176.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -75.43 -42.84 52.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 112.059 -2.337 . . . . 0.0 110.761 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.568 HG21 HG21 ' A' ' 23' ' ' VAL . 38.9 t -63.78 -49.83 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 CA-C-N 114.187 -1.37 . . . . 0.0 107.76 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.39 -46.42 73.08 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 126.661 1.985 . . . . 0.0 112.599 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.61 80.75 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 112.361 -2.2 . . . . 0.0 111.134 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.23 -39.97 80.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.584 -2.098 . . . . 0.0 113.293 173.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 30.5 mtt -61.01 -52.11 66.39 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -172.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.28 -41.33 85.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.254 -1.793 . . . . 0.0 113.673 174.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -59.46 -37.83 79.2 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 113.402 -1.726 . . . . 0.0 113.45 -178.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.516 HD22 ' OD2' ' A' ' 8' ' ' ASP . 52.9 mt -91.99 26.06 2.6 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 52.38 33.6 13.28 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.82 1.772 . . . . 0.0 114.139 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 66.3 t80 -101.45 -177.49 3.45 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.423 1.489 . . . . 0.0 109.751 -174.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 47' ' ' TYR 0.258 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 117.374 -1.298 . . . . 0.0 108.683 -177.24 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.2 p -61.45 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 174.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.536 HD11 ' OH ' ' A' ' 47' ' ' TYR . 17.7 mt -35.17 -16.89 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.347 0 N-CA-C 119.596 3.184 . . . . 0.0 119.596 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.488 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 52.0 m-85 -53.34 -33.89 55.35 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.407 0.683 . . . . 0.0 110.899 164.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.455 ' OD2' HD22 ' A' ' 45' ' ' LEU . 14.1 t70 -57.23 -50.6 72.37 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 172.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.419 ' HA ' HD13 ' A' ' 45' ' ' LEU . 84.6 t -59.95 -43.12 91.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 123.252 0.621 . . . . 0.0 112.592 173.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.78 -55.11 39.4 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 112.065 -2.334 . . . . 0.0 112.175 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.488 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.9 OUTLIER -66.24 -40.59 90.33 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.717 2.007 . . . . 0.0 115.049 177.508 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -65.22 -35.76 82.05 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.964 0.887 . . . . 0.0 110.73 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.11 -19.33 27.17 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 113.632 -1.622 . . . . 0.0 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 26.19 57.93 Favored Glycine 0 CA--C 1.545 1.951 0 C-N-CA 126.793 2.139 . . . . 0.0 113.001 172.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.6 p -119.56 126.4 75.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 125.325 1.45 . . . . 0.0 110.605 -171.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.2 p -28.3 121.4 0.12 Allowed 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 129.154 2.982 . . . . 0.0 110.476 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -44.46 -45.1 8.97 Favored 'General case' 0 N--CA 1.521 3.091 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.426 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.665 0.6 OUTLIER -56.56 -18.63 12.4 Favored 'General case' 0 C--N 1.321 -0.643 1 N-CA-C 125.265 5.283 . . . . 0.0 125.265 176.22 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.485 ' O ' HG23 ' A' ' 23' ' ' VAL . 71.0 p -64.66 -53.01 54.13 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 113.714 -1.584 . . . . 0.0 113.65 159.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.615 ' O ' HG23 ' A' ' 24' ' ' VAL 0.25 80.1 t -60.99 -50.86 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 O-C-N 121.106 -0.996 . . . . 0.0 110.87 -164.298 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.29 13.8 m -59.76 -35.18 74.08 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -179.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 19' ' ' THR . 11.2 mtt85 -67.23 -42.73 83.54 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 112.055 -2.339 . . . . 0.0 117.103 170.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.737 HG11 HG21 ' A' ' 38' ' ' VAL . 75.7 t -60.63 -43.13 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 125.813 1.645 . . . . 0.0 108.161 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.2 t -49.04 -49.45 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.289 0 O-C-N 125.708 1.88 . . . . 0.0 111.416 -171.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.377 14.3 m120 -106.46 29.85 6.51 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 18.3 tt0 61.05 17.76 8.3 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 129.493 3.117 . . . . 0.0 115.604 170.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.58 39.88 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 111.735 -2.484 . . . . 0.0 116.998 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.257 86.1 p 61.01 -56.72 0.09 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 126.313 1.845 . . . . 0.0 113.663 -163.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.288 98.8 m-70 -138.26 115.49 11.04 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.969 167.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 p -127.17 156.11 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 172.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.9 p -54.63 134.71 47.01 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 174.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.99 -53.28 57.83 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -175.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -48.4 -41.71 29.79 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.442 ' O ' HG23 ' A' ' 38' ' ' VAL . 27.9 m -56.46 -48.72 76.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 114.271 -1.331 . . . . 0.0 107.881 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 2.4 mmm180 -59.22 -42.64 91.46 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 117.72 2.489 . . . . 0.0 117.72 177.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -36.07 76.13 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 113.479 -1.691 . . . . 0.0 115.445 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -77.99 -44.56 26.3 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 111.949 -2.387 . . . . 0.0 111.283 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.737 HG21 HG11 ' A' ' 23' ' ' VAL . 41.6 t -64.25 -45.36 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 113.803 -1.544 . . . . 0.0 108.636 177.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 51.9 mt-10 -58.44 -42.09 86.53 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.565 3.146 . . . . 0.0 112.985 -177.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -52.03 65.06 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 112.585 -2.098 . . . . 0.0 109.843 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.66 -38.15 74.6 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 113.285 -1.78 . . . . 0.0 114.999 175.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 36.3 mtt -59.81 -53.21 60.61 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -173.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.04 94.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 113.07 -1.877 . . . . 0.0 112.386 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.42 -37.29 86.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 112.619 -2.082 . . . . 0.0 113.732 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.455 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.5 mt -98.75 20.76 12.46 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 126.455 1.902 . . . . 0.0 113.539 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 56.72 25.24 9.91 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 116.52 2.045 . . . . 0.0 116.52 175.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.536 ' OH ' HD11 ' A' ' 6' ' ' LEU . 54.4 t80 -86.82 170.83 11.35 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.294 -172.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.861 -170.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.476 ' O ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.494 1.728 1 N-CA-C 122.388 4.218 . . . . 0.0 122.388 . . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 4' ' ' VAL 0.31 7.0 t 71.82 149.59 0.09 Allowed 'General case' 0 N--CA 1.491 1.602 1 C-N-CA 133.92 4.888 . . . . 0.0 117.587 -177.862 . . . . . . . . 4 3 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.449 ' HB2' ' CE2' ' A' ' 17' ' ' TYR . 33.9 mt -62.55 -27.85 69.45 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -175.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -58.1 -37.54 74.71 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.876 0.871 . . . . 0.0 109.695 172.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.538 ' OD2' HD22 ' A' ' 45' ' ' LEU . 22.6 t70 -64.94 -49.51 70.08 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.885 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -43.34 90.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.404 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -57.1 -46.53 82.5 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.415 1.886 . . . . 0.0 113.214 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.54 -43.96 71.9 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 126.315 1.846 . . . . 0.0 115.673 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.43 ' CB ' HD11 ' A' ' 45' ' ' LEU . 37.5 t80 -64.55 -33.22 75.4 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.559 0.695 . . . . 0.0 110.546 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.38 -20.64 23.73 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.555 -1.657 . . . . 0.0 111.568 -179.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.18 27.9 61.18 Favored Glycine 0 N--CA 1.489 2.229 0 C-N-CA 125.524 1.535 . . . . 0.0 112.773 171.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.424 HG22 HG21 ' A' ' 19' ' ' THR 0.255 8.6 p -132.28 120.94 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.476 0.71 . . . . 0.0 109.727 -167.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.6 p -26.35 139.67 0.01 OUTLIER 'General case' 0 N--CA 1.524 3.27 0 C-N-CA 128.233 2.613 . . . . 0.0 110.623 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 6' ' ' LEU . 66.1 t80 -54.51 -34.8 62.31 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 119.483 -2.011 . . . . 0.0 114.728 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -53.51 -44.69 69.29 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.909 0.756 . . . . 0.0 111.62 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' HG23 ' A' ' 23' ' ' VAL . 36.6 m -55.13 -52.53 62.98 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.958 1.303 . . . . 0.0 111.127 176.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.65 ' O ' HG23 ' A' ' 24' ' ' VAL . 76.9 t -65.33 -50.83 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.393 -0.813 . . . . 0.0 110.911 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.384 7.6 m -63.15 -31.15 72.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 118.453 2.76 . . . . 0.0 118.453 -178.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.6 mtp85 -60.01 -48.85 80.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.356 -2.657 . . . . 0.0 115.121 164.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 38' ' ' VAL . 69.8 t -59.72 -45.11 94.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 124.949 1.3 . . . . 0.0 108.797 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 20' ' ' VAL . 94.8 t -53.14 -44.69 52.64 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 112.753 -2.021 . . . . 0.0 112.108 -171.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.285 11.1 m120 -104.22 25.82 9.6 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 173.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.438 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER 58.87 19.99 7.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.668 2.787 . . . . 0.0 115.997 172.265 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.79 45.64 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 111.371 -2.65 . . . . 0.0 116.699 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 88.5 p 59.44 -52.93 0.06 Allowed 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 126.129 1.772 . . . . 0.0 114.802 -162.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.8 m170 -138.44 117.15 12.25 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.438 HG12 ' OE1' ' A' ' 26' ' ' GLN . 3.3 p -118.18 147.56 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 p -61.92 139.43 58.39 Favored 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.43 -66.53 0.39 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB2' ' HZ2' ' A' ' 33' ' ' LYS 0.271 0.0 OUTLIER -52.94 -34.07 53.74 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -179.317 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -62.48 -50.89 69.65 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -57.69 -46.91 83.7 Favored 'General case' 0 N--CA 1.434 -1.254 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 175.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.03 -36.35 65.42 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -175.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -74.56 -44.61 50.18 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.748 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 23' ' ' VAL . 61.1 t -66.6 -50.01 70.03 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 113.677 -1.602 . . . . 0.0 109.606 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -49.77 -45.59 49.82 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.648 3.179 . . . . 0.0 111.394 178.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.15 77.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 111.404 -2.634 . . . . 0.0 110.887 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.61 -46.67 88.82 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 113.356 -1.747 . . . . 0.0 114.965 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.55 -45.41 81.26 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.342 1.857 . . . . 0.0 113.662 -177.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.42 78.58 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.177 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.42 -43.28 94.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 112.612 -2.085 . . . . 0.0 113.104 -177.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.538 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.0 mt -81.15 14.09 2.5 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.333 1.2 p-10 50.28 41.85 24.88 Favored 'General case' 0 CA--C 1.574 1.893 0 CA-C-O 122.777 1.275 . . . . 0.0 113.338 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -105.11 179.41 4.28 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 114.83 -1.077 . . . . 0.0 108.916 -173.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.272 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.082 0 O-C-N 121.36 -0.838 . . . . 0.0 112.1 -174.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.307 2.7 p -71.07 94.14 1.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 105.616 -1.994 . . . . 0.0 105.616 -175.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.9 mt -27.87 -16.66 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 1 N-CA-C 123.028 4.455 . . . . 0.0 123.028 177.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -56.5 -36.45 69.17 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 118.97 0.805 . . . . 0.0 111.158 165.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.02 -52.25 59.06 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 172.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.22 -45.93 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.166 0.987 . . . . 0.0 112.387 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.45 79.4 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.238 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -44.48 76.67 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 115.296 175.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.449 ' CB ' HD11 ' A' ' 45' ' ' LEU . 52.4 t80 -63.59 -33.53 75.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.993 1.317 . . . . 0.0 111.248 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.63 -15.35 25.44 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.92 -1.491 . . . . 0.0 111.21 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.95 26.69 68.32 Favored Glycine 0 N--CA 1.494 2.504 0 C-N-CA 125.949 1.738 . . . . 0.0 112.6 171.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.447 HG22 HG21 ' A' ' 19' ' ' THR . 8.5 p -131.78 117.68 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.478 1.111 . . . . 0.0 108.441 -168.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.7 p -22.24 142.87 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.984 0 C-N-CA 127.066 2.146 . . . . 0.0 112.73 -174.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.25 83.3 t80 -50.73 -42.89 57.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 119.919 -1.738 . . . . 0.0 114.295 171.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -52.52 -41.9 63.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 123.872 0.733 . . . . 0.0 112.754 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 23' ' ' VAL . 46.4 m -56.55 -51.86 66.97 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.75 175.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 24' ' ' VAL 0.328 86.9 t -64.91 -45.39 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 118.085 -0.959 . . . . 0.0 112.4 -173.599 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 3.7 m -63.57 -36.0 82.36 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -178.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -60.17 -47.45 85.89 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 167.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.78 HG11 HG21 ' A' ' 38' ' ' VAL . 73.3 t -59.98 -39.59 80.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.668 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.9 t -53.06 -50.94 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 CA-C-N 113.898 -1.501 . . . . 0.0 112.293 -171.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -84.45 7.46 19.68 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 171.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.557 ' HG2' ' HD3' ' A' ' 35' ' ' ARG . 0.9 OUTLIER 62.66 14.24 7.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 128.091 2.557 . . . . 0.0 113.781 -177.006 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.05 42.53 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 111.937 -2.392 . . . . 0.0 115.967 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.4 m 56.25 -36.1 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -165.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.281 79.1 m80 -157.29 103.25 1.97 Allowed 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 -178.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.98 156.88 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 120.093 -1.629 . . . . 0.0 114.53 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -60.57 136.26 58.0 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.435 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . . . -55.21 -53.84 50.96 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -175.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HE2' ' HB3' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -54.32 -38.97 66.59 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 177.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.7 m -62.07 -52.02 65.63 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.557 ' HD3' ' HG2' ' A' ' 26' ' ' GLN . 3.6 mtm105 -56.82 -45.07 82.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -61.38 -35.71 78.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.141 -1.845 . . . . 0.0 114.039 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -75.63 -42.12 52.44 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 111.712 -2.494 . . . . 0.0 111.046 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.78 HG21 HG11 ' A' ' 23' ' ' VAL . 46.3 t -61.77 -48.37 88.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 125.347 1.459 . . . . 0.0 107.399 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -55.02 -41.33 71.18 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 128.105 2.562 . . . . 0.0 113.78 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.42 -51.04 61.08 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 111.698 -2.501 . . . . 0.0 111.447 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.29 -43.41 88.02 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 113.689 -1.596 . . . . 0.0 113.936 178.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.551 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -58.02 -47.55 82.74 Favored 'General case' 0 CA--C 1.598 2.805 0 C-N-CA 128.805 2.842 . . . . 0.0 111.297 -176.926 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.01 82.9 Favored 'General case' 0 C--N 1.318 -0.767 0 O-C-N 126.439 2.337 . . . . 0.0 111.771 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -65.99 -41.41 91.15 Favored 'General case' 0 CA--C 1.586 2.346 0 C-N-CA 126.447 1.899 . . . . 0.0 111.94 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.449 HD11 ' CB ' ' A' ' 12' ' ' TYR . 56.4 mt -88.54 13.21 12.54 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.689 1.996 . . . . 0.0 114.649 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.267 2.2 p-10 56.76 32.33 21.05 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-N 114.202 -1.363 . . . . 0.0 114.535 176.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.551 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 6.7 t80 -94.79 174.28 7.18 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -175.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.932 0 CA-C-O 118.367 -0.825 . . . . 0.0 109.138 -178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.466 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.738 0 N-CA-C 106.517 -1.661 . . . . 0.0 106.517 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.258 1.6 p -68.94 90.71 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.9 mt -34.99 -14.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 -175.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -56.24 -29.94 61.72 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.183 0.901 . . . . 0.0 112.826 164.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -54.86 -50.56 68.36 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 168.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.41 -44.21 95.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 123.09 0.556 . . . . 0.0 111.889 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.1 -48.7 80.63 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.17 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -42.41 88.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.519 1.928 . . . . 0.0 114.902 176.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.47 ' CB ' HD11 ' A' ' 45' ' ' LEU . 41.6 t80 -66.52 -32.68 74.19 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.913 1.285 . . . . 0.0 111.434 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.63 -8.24 47.77 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.686 1.194 . . . . 0.0 111.674 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.59 20.53 79.83 Favored Glycine 0 N--CA 1.496 2.7 0 C-N-CA 126.92 2.2 . . . . 0.0 113.04 171.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.23 127.19 65.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.239 0.616 . . . . 0.0 112.253 -164.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -27.95 128.72 0.06 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 127.717 2.407 . . . . 0.0 110.53 176.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -42.81 -36.0 1.34 Allowed 'General case' 0 N--CA 1.521 3.111 0 C-N-CA 124.998 1.319 . . . . 0.0 114.111 177.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -51.18 -43.67 61.37 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.247 177.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . 46.9 p -59.19 -54.31 48.34 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 176.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.506 ' O ' HG23 ' A' ' 24' ' ' VAL . 87.5 t -61.33 -49.64 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 125.248 1.419 . . . . 0.0 109.951 -172.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.0 p -53.54 -47.06 70.33 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.381 1.473 . . . . 0.0 113.674 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -60.37 -45.66 92.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 110.754 -2.93 . . . . 0.0 116.985 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.645 HG21 HG21 ' A' ' 38' ' ' VAL . 94.4 t -62.55 -39.88 86.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.242 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 20' ' ' VAL . 78.2 t -51.55 -55.09 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 113.312 -1.767 . . . . 0.0 112.486 -175.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.291 34.3 m120 -92.29 22.87 4.19 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 175.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 20.4 tt0 67.09 1.2 2.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 128.349 2.66 . . . . 0.0 117.433 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.21 35.81 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 111.675 -2.511 . . . . 0.0 116.827 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 59.24 -43.95 0.07 Allowed 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 117.97 2.582 . . . . 0.0 117.97 -167.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.274 69.3 m80 -152.49 103.59 2.83 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -174.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -123.29 151.7 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 171.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 p -67.48 145.93 54.48 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 -175.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.411 ' HB1' ' OE2' ' A' ' 36' ' ' GLU . . . -46.1 -73.87 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.569 ' H ' ' HE2' ' A' ' 33' ' ' LYS 0.292 0.0 OUTLIER -51.21 -28.9 12.56 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 119.832 3.271 . . . . 0.0 119.832 179.564 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 23.7 m -65.05 -56.97 9.96 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 175.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtm105 -55.35 -51.35 67.07 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.411 ' OE2' ' HB1' ' A' ' 32' ' ' ALA . 0.4 OUTLIER -54.65 -34.64 62.48 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -175.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.19 -51.06 11.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.806 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.645 HG21 HG21 ' A' ' 23' ' ' VAL . 48.5 t -58.8 -46.39 90.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 125.86 1.664 . . . . 0.0 108.177 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.0 -44.11 91.61 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.147 2.179 . . . . 0.0 116.208 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.9 -50.01 70.41 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.626 -2.079 . . . . 0.0 110.511 174.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.15 -37.88 75.53 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 112.283 -2.235 . . . . 0.0 114.866 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 35.0 mtt -59.56 -51.29 70.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.21 -40.38 95.91 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 112.43 -2.168 . . . . 0.0 111.818 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.13 -41.07 95.15 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.783 -2.008 . . . . 0.0 113.495 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.47 HD11 ' CB ' ' A' ' 12' ' ' TYR . 63.1 mt -98.94 25.14 6.93 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 127.031 2.132 . . . . 0.0 112.24 -175.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.41 21.12 10.75 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 117.698 2.481 . . . . 0.0 117.698 173.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -87.93 159.64 18.26 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.518 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.944 0 CA-C-N 112.347 -2.206 . . . . 0.0 108.504 -171.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.766 0 CA-C-O 122.282 1.039 . . . . 0.0 112.765 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -77.31 145.26 37.5 Favored 'General case' 0 CA--C 1.556 1.204 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 -169.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.483 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 14.2 mt -61.92 0.92 0.32 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 121.429 3.863 . . . . 0.0 121.429 -155.236 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -58.37 -38.18 76.76 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 119.539 1.063 . . . . 0.0 110.997 174.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.435 ' OD1' HD22 ' A' ' 45' ' ' LEU . 4.6 t70 -61.69 -46.96 87.48 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 114.935 -1.03 . . . . 0.0 113.14 173.566 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.23 -45.36 96.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.463 1.105 . . . . 0.0 112.827 174.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.458 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -55.12 -54.0 48.74 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.026 2.13 . . . . 0.0 112.35 176.247 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.28 -37.96 86.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.126 1.371 . . . . 0.0 114.266 177.855 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -67.98 -34.41 76.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 123.505 0.503 . . . . 0.0 110.317 179.34 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.57 -19.55 27.67 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.277 178.583 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.56 29.17 53.49 Favored Glycine 0 N--CA 1.486 2.016 0 C-N-CA 127.007 2.241 . . . . 0.0 113.704 174.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.296 8.5 p -130.21 130.58 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.623 0 C-N-CA 123.563 0.745 . . . . 0.0 109.12 -175.706 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.6 p -44.29 142.17 1.61 Allowed 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 128.658 2.783 . . . . 0.0 110.381 -173.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.483 ' CE1' ' HB2' ' A' ' 6' ' ' LEU . 74.3 t80 -48.84 -47.94 42.15 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 117.489 2.403 . . . . 0.0 117.489 -170.105 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.424 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.558 0.0 OUTLIER -56.57 -25.34 52.1 Favored 'General case' 0 C--N 1.322 -0.607 1 N-CA-C 124.359 4.948 . . . . 0.0 124.359 179.835 . . . . . . . . 5 4 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.55 ' O ' HG23 ' A' ' 23' ' ' VAL . 5.1 m -58.13 -53.13 61.74 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 111.608 -2.542 . . . . 0.0 111.512 165.501 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.558 ' O ' HG23 ' A' ' 24' ' ' VAL . 95.0 t -63.77 -49.57 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.46 -169.462 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.446 1.0 OUTLIER -58.32 -37.95 76.14 Favored 'General case' 0 CA--C 1.466 -2.278 0 N-CA-C 119.106 3.002 . . . . 0.0 119.106 176.247 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.55 ' HG3' HH11 ' A' ' 22' ' ' ARG . 2.5 mtt85 -63.54 -44.38 94.35 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 110.412 -3.086 . . . . 0.0 114.78 169.012 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.678 HG11 HG21 ' A' ' 38' ' ' VAL . 99.4 t -61.19 -42.87 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.091 -1.413 . . . . 0.0 110.342 -176.6 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 20' ' ' VAL . 96.5 t -54.88 -50.01 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 112.899 -1.955 . . . . 0.0 112.395 -168.292 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -91.72 17.48 8.89 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 171.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.454 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.4 OUTLIER 67.49 11.74 8.53 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.99 2.916 . . . . 0.0 114.85 172.326 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.9 40.03 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 127.723 2.409 . . . . 0.0 116.441 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.6 p 57.91 -34.67 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -160.227 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -157.6 99.32 1.72 Allowed 'General case' 0 CA--C 1.564 1.487 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -168.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.454 HG12 ' OE1' ' A' ' 26' ' ' GLN 0.258 4.6 p -137.96 152.88 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 175.551 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.5 p -61.29 145.32 51.8 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -173.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.36 -63.83 1.0 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.574 1.949 . . . . 0.0 113.359 -177.323 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 33' ' ' LYS 0.254 11.6 tptp -56.96 -42.01 79.35 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.885 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.6 m -57.82 -50.49 73.09 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 113.344 -1.753 . . . . 0.0 108.054 178.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.56 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 15.8 mtm105 -57.05 -48.88 77.47 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 174.567 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.47 -34.47 74.07 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 113.708 -1.587 . . . . 0.0 114.896 -176.199 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -78.47 -43.19 27.72 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.212 2.205 . . . . 0.0 111.001 -179.434 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.678 HG21 HG11 ' A' ' 23' ' ' VAL . 81.3 t -63.24 -46.79 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.095 174.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 31.9 mt-10 -52.76 -45.51 67.12 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 126.452 1.901 . . . . 0.0 111.966 179.083 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.56 -52.5 60.8 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 110.582 -3.008 . . . . 0.0 111.037 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.33 -52.16 65.82 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 112.85 -1.977 . . . . 0.0 115.674 178.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.543 ' HB2' ' HB3' ' A' ' 47' ' ' TYR 0.264 0.0 OUTLIER -59.98 -33.32 71.8 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -178.111 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.91 -50.62 63.82 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.542 179.471 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -62.76 -33.77 75.85 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.521 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.435 HD22 ' OD1' ' A' ' 8' ' ' ASP . 62.0 mt -99.14 14.64 28.66 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.425 2.29 . . . . 0.0 116.951 -177.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.353 0.2 OUTLIER 54.48 19.33 2.31 Favored 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 127.127 2.171 . . . . 0.0 116.776 176.309 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.543 ' HB3' ' HB2' ' A' ' 42' ' ' MET . 62.3 t80 -82.99 95.4 8.0 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 172.509 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.331 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 117.505 -1.236 . . . . 0.0 108.795 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.5 p -75.85 120.63 21.47 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-N 120.878 1.672 . . . . 0.0 109.246 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.412 HD22 HG12 ' A' ' 20' ' ' VAL . 15.8 mt -31.35 -28.82 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.88 0 N-CA-C 121.27 3.804 . . . . 0.0 121.27 -178.215 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -54.2 -37.06 64.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.414 0.686 . . . . 0.0 109.152 173.353 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.463 ' OD2' HD22 ' A' ' 45' ' ' LEU . 21.7 t70 -60.58 -41.32 94.41 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 118.555 -0.736 . . . . 0.0 111.791 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.0 t -62.45 -50.82 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 170.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -48.75 -48.89 40.46 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.986 1.315 . . . . 0.0 112.19 175.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.54 -44.42 70.98 Favored 'General case' 0 C--N 1.316 -0.861 1 C-N-CA 132.539 4.335 . . . . 0.0 113.49 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.428 ' CB ' HD11 ' A' ' 45' ' ' LEU . 54.3 t80 -63.97 -34.59 78.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.022 0.929 . . . . 0.0 110.538 174.031 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.02 -12.5 38.39 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.522 -177.282 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.58 28.87 66.63 Favored Glycine 0 N--CA 1.495 2.599 0 C-N-CA 125.981 1.753 . . . . 0.0 113.82 177.115 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.405 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 9.3 p -124.85 142.22 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 122.49 1.138 . . . . 0.0 110.167 -170.409 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -55.82 128.69 36.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 129.328 3.051 . . . . 0.0 107.442 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -53.2 -31.67 44.19 Favored 'General case' 0 N--CA 1.509 2.487 0 N-CA-C 118.125 2.639 . . . . 0.0 118.125 -167.035 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -49.2 -44.56 43.25 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.354 -1.307 . . . . 0.0 113.827 175.626 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.637 ' O ' HG23 ' A' ' 23' ' ' VAL . 44.7 p -52.59 -48.82 66.01 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 124.018 0.824 . . . . 0.0 112.548 178.376 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.67 ' O ' HG23 ' A' ' 24' ' ' VAL . 85.4 t -68.46 -52.1 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 113.802 -1.545 . . . . 0.0 110.187 -174.925 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.8 m -59.05 -32.01 69.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.9 mtp85 -65.53 -46.98 77.47 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 111.26 -2.7 . . . . 0.0 113.937 170.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.773 HG21 HG21 ' A' ' 38' ' ' VAL . 92.7 t -58.59 -43.88 88.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.595 1.558 . . . . 0.0 108.018 -178.574 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 20' ' ' VAL . 58.1 t -55.45 -47.76 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 CA-C-N 111.951 -2.386 . . . . 0.0 111.54 -173.336 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -95.67 13.88 24.89 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 176.159 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 62.23 16.9 8.8 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 116.605 2.076 . . . . 0.0 116.605 179.027 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.462 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . . . 36.48 22.77 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 110.582 -3.008 . . . . 0.0 118.22 178.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 t 63.69 -51.76 0.24 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 125.121 1.369 . . . . 0.0 112.346 -160.66 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -138.16 109.67 7.0 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 178.323 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.869 HG11 HH11 ' A' ' 35' ' ' ARG . 4.6 p -124.06 144.03 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.34 0 O-C-N 120.309 -1.494 . . . . 0.0 113.243 179.53 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.4 p -71.02 137.74 49.29 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 177.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -50.79 72.36 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.187 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.468 ' O ' ' HG2' ' A' ' 36' ' ' GLU 0.302 0.0 OUTLIER -59.57 -28.62 67.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 118.164 2.654 . . . . 0.0 118.164 177.545 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.7 m -67.24 -50.28 61.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 112.585 -2.098 . . . . 0.0 107.567 174.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.869 HH11 HG11 ' A' ' 30' ' ' VAL . 13.6 mtp85 -59.06 -42.68 90.9 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.58 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 3.2 pt-20 -58.98 -35.23 72.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 113.659 -1.609 . . . . 0.0 113.956 -177.968 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -76.95 -44.23 32.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 110.991 -2.822 . . . . 0.0 112.529 -176.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.773 HG21 HG21 ' A' ' 23' ' ' VAL . 42.7 t -64.66 -46.34 92.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 112.305 -2.225 . . . . 0.0 108.967 177.292 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -56.54 -42.18 78.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.824 2.85 . . . . 0.0 111.272 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.0 69.29 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.513 -1.676 . . . . 0.0 111.47 174.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.47 91.88 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 113.432 -1.713 . . . . 0.0 115.203 176.958 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.82 -44.53 93.99 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -178.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.3 -46.4 88.92 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.495 1.122 . . . . 0.0 112.446 178.661 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -61.99 -39.55 92.6 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.592 -2.094 . . . . 0.0 113.803 177.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.463 HD22 ' OD2' ' A' ' 8' ' ' ASP . 26.2 mt -90.21 15.83 9.65 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.601 1.56 . . . . 0.0 114.201 178.225 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 49.62 31.56 4.34 Favored 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 127.189 2.196 . . . . 0.0 112.6 176.895 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -97.52 139.91 32.74 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 122.863 1.316 . . . . 0.0 108.773 -165.657 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.327 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.971 0 CA-C-N 110.807 -2.906 . . . . 0.0 114.5 176.277 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.442 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.294 1.3 p -68.62 100.48 1.13 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 -179.261 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.413 HD21 ' CE2' ' A' ' 47' ' ' TYR . 21.2 mt -43.86 -14.26 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.73 0 N-CA-C 117.602 2.445 . . . . 0.0 117.602 -176.449 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.418 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 2.3 m-30 -55.93 -35.45 66.65 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.019 0.527 . . . . 0.0 110.334 165.909 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.475 ' OD2' HD22 ' A' ' 45' ' ' LEU . 32.6 t70 -59.0 -47.64 84.46 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.8 0.84 . . . . 0.0 113.08 174.395 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.8 t -59.31 -45.86 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 172.104 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -48.07 81.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.348 -2.205 . . . . 0.0 112.123 -177.358 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.418 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.5 OUTLIER -67.53 -42.2 83.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.221 2.208 . . . . 0.0 115.453 177.038 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.4 ' CB ' HD11 ' A' ' 45' ' ' LEU . 46.5 t80 -64.79 -33.05 75.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 124.017 0.823 . . . . 0.0 110.712 177.379 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.12 -16.43 24.93 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.397 -179.768 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.36 25.35 68.48 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 126.747 2.118 . . . . 0.0 113.479 173.558 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.437 HG22 HG21 ' A' ' 19' ' ' THR . 5.4 p -126.0 111.32 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.445 0.698 . . . . 0.0 110.197 -167.264 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 91.7 p -16.83 135.65 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.19 0 C-N-CA 127.889 2.476 . . . . 0.0 111.724 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.309 31.6 t80 -47.83 -53.29 16.0 Favored 'General case' 0 N--CA 1.521 3.086 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 -175.763 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.579 HE21 ' CZ ' ' A' ' 22' ' ' ARG 0.366 0.0 OUTLIER -58.44 -24.77 61.1 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 179.593 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 94.6 m -56.1 -50.21 71.67 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.233 165.255 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 24' ' ' VAL 0.297 79.9 t -65.5 -43.65 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-O 118.542 -0.742 . . . . 0.0 110.733 -177.126 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.89 81.58 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.034 0.834 . . . . 0.0 112.446 -177.54 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.579 ' CZ ' HE21 ' A' ' 18' ' ' GLN . 18.9 mtt85 -61.37 -45.97 92.13 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.013 1.857 . . . . 0.0 116.013 169.168 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.608 HG21 HG21 ' A' ' 38' ' ' VAL . 70.1 t -59.86 -41.25 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 125.019 1.328 . . . . 0.0 108.458 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 20' ' ' VAL . 82.3 t -53.27 -49.87 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 113.687 -1.597 . . . . 0.0 112.665 -171.115 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -92.09 14.34 16.26 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 171.61 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.526 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.3 OUTLIER 60.02 21.08 10.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.971 2.508 . . . . 0.0 113.823 178.072 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.17 45.16 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 111.674 -2.512 . . . . 0.0 116.574 -175.192 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.2 t 64.09 -57.36 0.22 Allowed 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 125.959 1.704 . . . . 0.0 111.929 -163.589 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -146.08 104.86 3.86 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 125.858 1.663 . . . . 0.0 107.646 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.526 HG12 ' OE1' ' A' ' 26' ' ' GLN . 9.8 p -113.51 157.61 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 120.891 1.678 . . . . 0.0 114.453 177.311 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -60.81 121.01 11.24 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.647 0.737 . . . . 0.0 112.913 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -41.24 -62.62 0.81 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -43.3 -43.13 4.78 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 179.529 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -59.85 -52.42 65.53 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 179.05 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.2 mtm105 -54.43 -47.67 72.56 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.575 1.695 . . . . 0.0 115.575 177.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.46 -36.5 69.12 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -176.635 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -76.72 -42.12 42.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 111.354 -2.657 . . . . 0.0 111.364 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.608 HG21 HG21 ' A' ' 23' ' ' VAL . 60.5 t -64.98 -49.53 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 C-N-CA 125.892 1.677 . . . . 0.0 108.029 176.379 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -52.54 -40.4 62.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 128.54 2.736 . . . . 0.0 112.875 179.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.51 -52.98 55.04 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.3 -2.227 . . . . 0.0 111.663 173.544 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.98 86.04 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 113.404 -1.725 . . . . 0.0 114.254 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.97 -45.48 86.66 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.501 1.92 . . . . 0.0 115.947 -177.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.83 -46.39 82.15 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 112.721 -2.036 . . . . 0.0 112.563 177.135 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.84 -35.44 80.67 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 111.964 -2.38 . . . . 0.0 113.926 -174.893 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.475 HD22 ' OD2' ' A' ' 8' ' ' ASP . 46.4 mt -91.56 18.39 7.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.528 1.931 . . . . 0.0 113.96 179.936 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.42 0.2 OUTLIER 52.03 36.96 20.03 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.789 1.235 . . . . 0.0 113.876 178.537 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.413 ' CE2' HD21 ' A' ' 6' ' ' LEU . 11.1 t80 -100.41 175.64 5.63 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -172.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -176.578 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.36 0.5 OUTLIER . . . . . 0 N--CA 1.497 1.898 0 CA-C-O 121.377 0.608 . . . . 0.0 109.866 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.301 2.8 p -73.07 99.22 2.72 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.6 mt -41.0 -14.4 0.01 OUTLIER 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 118.546 2.795 . . . . 0.0 118.546 -176.956 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.502 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 56.2 m-85 -54.62 -33.17 60.06 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 119.096 0.862 . . . . 0.0 111.071 165.338 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.441 ' OD2' HD22 ' A' ' 45' ' ' LEU . 15.0 t70 -59.13 -48.82 80.2 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 118.408 -0.806 . . . . 0.0 113.09 173.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -58.05 -44.26 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 173.358 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.22 70.62 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 112.029 -2.351 . . . . 0.0 111.531 -177.261 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.502 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.1 -39.57 86.77 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.515 1.926 . . . . 0.0 114.282 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -66.34 -36.35 82.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-O 122.236 1.017 . . . . 0.0 110.881 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.61 -15.15 40.67 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.198 -1.819 . . . . 0.0 110.856 178.694 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 26.65 60.89 Favored Glycine 0 CA--C 1.544 1.888 0 C-N-CA 126.936 2.208 . . . . 0.0 113.128 170.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -124.36 128.75 73.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.25 0.62 . . . . 0.0 110.655 -167.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.72 ' HB2' HE22 ' A' ' 18' ' ' GLN . 74.7 p -33.08 122.14 0.38 Allowed 'General case' 0 N--CA 1.514 2.725 0 C-N-CA 127.445 2.298 . . . . 0.0 109.13 175.288 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.317 41.8 t80 -40.92 -47.8 3.04 Favored 'General case' 0 N--CA 1.522 3.147 0 N-CA-C 117.628 2.455 . . . . 0.0 117.628 -175.873 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.72 HE22 ' HB2' ' A' ' 16' ' ' SER 0.403 0.0 OUTLIER -57.53 -16.99 11.52 Favored 'General case' 0 C--N 1.32 -0.681 1 N-CA-C 122.073 4.101 . . . . 0.0 122.073 179.108 . . . . . . . . 5 4 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 23' ' ' VAL . 69.0 p -64.96 -52.61 55.34 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 114.203 -1.362 . . . . 0.0 112.866 162.014 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.677 ' O ' HG23 ' A' ' 24' ' ' VAL 0.27 73.7 t -60.99 -47.6 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.204 -171.39 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 p -57.12 -42.58 81.13 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 122.775 1.274 . . . . 0.0 112.411 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.425 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 17.1 mtt85 -67.7 -38.97 84.37 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 119.773 3.249 . . . . 0.0 119.773 173.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.813 HG11 HG21 ' A' ' 38' ' ' VAL . 24.7 t -55.11 -46.62 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 127.237 2.215 . . . . 0.0 107.979 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.677 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.2 t -55.7 -46.81 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 110.974 -2.83 . . . . 0.0 111.239 -168.006 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.282 13.8 m120 -99.07 26.81 5.52 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.87 -1.513 . . . . 0.0 114.437 176.65 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.454 ' C ' ' H ' ' A' ' 28' ' ' SER . 17.5 pt20 49.29 44.54 23.52 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-O 123.809 1.766 . . . . 0.0 112.905 171.543 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.296 . . -72.87 36.15 0.08 Allowed 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 110.211 -3.177 . . . . 0.0 118.858 -176.501 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.454 ' H ' ' C ' ' A' ' 26' ' ' GLN . 4.7 m 4.83 93.99 0.01 OUTLIER 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 108.854 -3.794 . . . . 0.0 117.902 176.617 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.7 m80 171.89 -68.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 102.67 -3.085 . . . . 0.0 102.67 -167.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -25.16 101.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 129.1 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 86.1 p -100.6 156.29 17.39 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 112.234 -2.257 . . . . 0.0 114.811 -177.048 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -15.21 -63.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.403 1.881 . . . . 0.0 115.28 167.646 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.82 -51.85 12.19 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 176.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 38' ' ' VAL . 76.3 m -59.56 -51.45 69.77 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.481 1.512 . . . . 0.0 107.012 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.495 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -54.87 -43.3 73.02 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.762 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.86 -39.4 85.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.309 -1.769 . . . . 0.0 114.744 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -79.11 -40.84 30.06 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 113.079 -1.873 . . . . 0.0 112.072 -177.487 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.813 HG21 HG11 ' A' ' 23' ' ' VAL . 44.7 t -61.17 -47.56 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.74 1.616 . . . . 0.0 106.771 172.706 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 53.2 mt-10 -55.73 -44.68 77.76 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.344 2.258 . . . . 0.0 111.499 -178.585 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -51.7 65.83 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.658 -2.065 . . . . 0.0 110.925 177.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.68 -40.7 80.01 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 113.205 -1.816 . . . . 0.0 113.603 176.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 mtt -58.25 -48.97 78.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -176.0 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.4 94.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.101 -2.318 . . . . 0.0 112.875 177.599 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -64.13 -34.47 78.12 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-N 112.332 -2.213 . . . . 0.0 113.684 -177.533 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.441 HD22 ' OD2' ' A' ' 8' ' ' ASP . 47.0 mt -94.48 18.0 12.08 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.867 1.667 . . . . 0.0 113.042 -178.486 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.69 21.41 5.85 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.693 2.397 . . . . 0.0 113.043 178.341 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -89.79 157.43 17.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -170.294 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.429 24.5 mm . . . . . 0 CA--C 1.535 0.396 1 N-CA-C 121.921 4.045 . . . . 0.0 121.921 178.112 . . . . . . . . 2 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.415 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 118.962 -0.542 . . . . 0.0 109.669 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.3 p -91.54 145.66 24.43 Favored 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.3 -165.521 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.473 HD22 HG12 ' A' ' 20' ' ' VAL . 8.2 mt -45.71 -27.88 0.9 Allowed 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -170.384 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -59.58 -39.61 84.7 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.816 0.735 . . . . 0.0 111.744 176.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.5 -48.31 74.81 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 171.121 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.0 t -60.0 -40.62 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 174.317 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.406 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -60.15 -50.54 73.29 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.643 -1.617 . . . . 0.0 113.201 177.563 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.69 -39.35 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.993 1.717 . . . . 0.0 113.72 177.212 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.403 ' CB ' HD11 ' A' ' 45' ' ' LEU . 36.5 t80 -67.27 -34.97 78.53 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.572 0.749 . . . . 0.0 111.212 177.479 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.42 -14.91 44.76 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.104 177.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.91 29.46 54.38 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 126.124 1.821 . . . . 0.0 112.655 170.831 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -132.4 134.37 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.981 0 CA-C-O 122.202 1.001 . . . . 0.0 109.651 -168.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.5 p -41.21 130.88 2.79 Favored 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 128.135 2.574 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.414 ' HE1' ' HB2' ' A' ' 6' ' ' LEU . 85.9 t80 -51.95 -29.54 20.88 Favored 'General case' 0 N--CA 1.51 2.528 0 N-CA-C 119.586 3.18 . . . . 0.0 119.586 -174.524 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -49.31 -41.52 38.59 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 116.479 -1.724 . . . . 0.0 113.374 172.889 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 43.5 p -63.22 -53.85 46.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 176.378 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.726 ' O ' HG23 ' A' ' 24' ' ' VAL . 82.4 t -62.38 -48.18 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.831 0.852 . . . . 0.0 110.207 -173.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.0 p -57.81 -42.45 84.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 116.609 2.078 . . . . 0.0 116.609 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 19' ' ' THR . 30.2 mtp85 -62.01 -45.59 92.91 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 109.995 -3.275 . . . . 0.0 115.157 171.212 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 38' ' ' VAL . 14.3 t -54.92 -48.31 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 127.405 2.282 . . . . 0.0 109.657 179.253 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.726 HG23 ' O ' ' A' ' 20' ' ' VAL . 48.3 t -57.26 -48.68 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 CA-C-N 109.945 -3.298 . . . . 0.0 112.937 -166.826 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.301 21.2 m120 -108.54 33.44 4.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.756 -1.565 . . . . 0.0 114.9 176.364 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 73.51 -5.49 1.97 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.902 2.881 . . . . 0.0 118.619 167.053 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.15 30.02 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.814 2.446 . . . . 0.0 115.266 -175.785 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.6 p 55.21 -44.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 -148.448 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.272 77.9 m80 -153.8 131.96 11.85 Favored 'General case' 0 CA--C 1.556 1.189 0 CA-C-O 117.64 -1.171 . . . . 0.0 109.875 -175.986 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.9 t -150.98 143.19 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.847 1.658 . . . . 0.0 113.887 159.244 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 p -23.34 131.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 119.387 3.106 . . . . 0.0 119.387 166.123 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 35' ' ' ARG . . . -66.45 -47.43 73.17 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.945 0.898 . . . . 0.0 112.791 -176.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.93 15.76 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 176.226 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -61.78 -49.61 75.65 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.931 1.692 . . . . 0.0 107.653 175.995 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.565 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 12.5 mmt85 -58.18 -46.77 85.17 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.688 1.995 . . . . 0.0 113.054 -178.941 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.26 -37.92 75.92 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 179.506 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -73.3 -43.26 61.26 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 112.27 -2.241 . . . . 0.0 111.87 178.695 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.562 HG21 HG11 ' A' ' 23' ' ' VAL . 85.8 t -63.6 -48.84 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 114.396 -1.275 . . . . 0.0 108.699 177.393 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.565 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 42.0 mt-10 -49.17 -46.81 45.95 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 128.981 2.912 . . . . 0.0 108.995 178.464 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.45 -54.23 31.41 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 112.706 -2.043 . . . . 0.0 111.359 -178.475 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.13 -42.41 69.48 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.275 -1.784 . . . . 0.0 114.23 174.332 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.603 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 3.0 mmt -59.62 -50.37 74.14 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 125.88 1.672 . . . . 0.0 111.587 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.98 -42.77 94.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.292 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.52 -32.93 74.59 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.501 179.566 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.403 HD11 ' CB ' ' A' ' 12' ' ' TYR . 29.6 mt -92.76 11.53 26.59 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 125.683 1.593 . . . . 0.0 113.727 177.576 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.408 0.2 OUTLIER 46.47 29.76 0.96 Allowed 'General case' 0 CA--C 1.564 1.487 0 C-N-CA 127.298 2.239 . . . . 0.0 113.715 -175.791 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.603 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 24.9 t80 -93.8 103.48 15.61 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.03 -1.044 . . . . 0.0 108.59 -168.037 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.764 0 CA-C-N 113.534 -1.666 . . . . 0.0 113.799 169.395 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.465 1.1 t . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 103.474 -2.787 . . . . 0.0 103.474 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 19.1 p -101.05 141.46 33.91 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.616 -0.677 . . . . 0.0 110.371 -176.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.572 HD22 HG12 ' A' ' 20' ' ' VAL . 21.6 mt -47.02 -23.84 0.53 Allowed 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 119.563 3.171 . . . . 0.0 119.563 -164.863 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -62.28 -35.59 79.47 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.14 0.882 . . . . 0.0 111.727 175.2 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.498 ' OD2' HD22 ' A' ' 45' ' ' LEU . 21.1 t70 -59.55 -46.92 87.49 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 118.383 -0.818 . . . . 0.0 112.885 171.283 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.9 t -58.61 -45.46 90.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 172.765 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.01 71.34 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.288 1.435 . . . . 0.0 112.598 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.58 -38.81 84.58 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.184 1.794 . . . . 0.0 115.766 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.407 ' CB ' HD11 ' A' ' 45' ' ' LEU . 48.6 t80 -64.82 -35.64 81.76 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.97 0.908 . . . . 0.0 110.346 176.58 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.38 -14.9 44.91 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.149 -1.387 . . . . 0.0 110.241 179.311 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.31 24.96 69.55 Favored Glycine 0 N--CA 1.48 1.582 0 C-N-CA 127.23 2.347 . . . . 0.0 113.275 172.443 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -121.02 124.72 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 124.188 0.995 . . . . 0.0 109.749 -167.812 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.4 p -31.12 123.27 0.22 Allowed 'General case' 0 N--CA 1.513 2.715 0 C-N-CA 127.207 2.203 . . . . 0.0 108.534 175.214 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -39.47 -33.18 0.15 Allowed 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 115.863 1.801 . . . . 0.0 115.863 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -48.11 -42.4 29.02 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 117.745 -1.121 . . . . 0.0 112.733 176.986 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.456 ' O ' HG23 ' A' ' 23' ' ' VAL . 2.3 p -60.83 -55.77 29.08 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 175.764 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.617 ' O ' HG23 ' A' ' 24' ' ' VAL 0.326 94.7 t -60.45 -44.61 96.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 C-N-CA 124.666 1.186 . . . . 0.0 110.092 -165.05 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.5 p -59.61 -49.35 78.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.198 0.999 . . . . 0.0 113.056 178.885 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 19' ' ' THR . 26.2 mtp85 -56.75 -44.53 81.83 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 111.998 -2.364 . . . . 0.0 113.857 173.278 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.486 HG21 HG21 ' A' ' 38' ' ' VAL . 43.7 t -59.57 -47.83 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.522 1.529 . . . . 0.0 109.069 -178.813 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 20' ' ' VAL . 50.5 t -60.02 -41.38 86.05 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 112.982 -1.917 . . . . 0.0 112.042 -167.776 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.26 14.0 m120 -100.05 23.48 9.85 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 113.697 -1.592 . . . . 0.0 114.867 173.518 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.34 5.91 4.54 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 170.647 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.96 43.36 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 111.566 -2.561 . . . . 0.0 115.147 -167.904 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.0 p 57.34 -59.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 113.155 -1.839 . . . . 0.0 114.485 -160.261 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -140.16 108.41 5.8 Favored 'General case' 0 CA--C 1.559 1.297 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.145 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.3 p -121.51 157.66 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 171.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 p -68.96 131.44 45.09 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 116.462 2.023 . . . . 0.0 116.462 -175.13 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -24.65 -67.06 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 128.004 2.522 . . . . 0.0 117.026 176.053 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -53.36 -40.54 65.02 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -172.346 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -50.45 70.09 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 113.056 -1.884 . . . . 0.0 107.31 -178.108 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -63.45 -40.13 96.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -179.645 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.76 -36.56 83.45 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.744 -176.743 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.74 -41.45 53.29 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 112.883 -1.962 . . . . 0.0 110.965 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.486 HG21 HG21 ' A' ' 23' ' ' VAL . 47.7 t -64.83 -47.4 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.294 1.438 . . . . 0.0 109.099 176.075 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.2 mt-10 -52.48 -43.97 65.33 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 130.066 3.347 . . . . 0.0 109.693 179.095 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.76 -51.35 67.48 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.005 -1.907 . . . . 0.0 111.28 177.738 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.85 93.22 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 113.837 -1.529 . . . . 0.0 113.55 176.261 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 mtt -56.59 -45.78 81.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 127.573 2.349 . . . . 0.0 113.537 -178.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.52 -47.96 76.93 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 113.077 -1.874 . . . . 0.0 112.628 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -63.04 -39.34 94.46 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 112.348 -2.205 . . . . 0.0 113.142 -177.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.498 HD22 ' OD2' ' A' ' 8' ' ' ASP . 52.9 mt -84.76 7.81 19.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.32 2.248 . . . . 0.0 113.902 -177.5 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.403 0.5 OUTLIER 49.22 45.21 23.43 Favored 'General case' 0 CA--C 1.573 1.849 0 C-N-CA 125.304 1.442 . . . . 0.0 112.852 179.679 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -95.39 -167.29 1.59 Allowed 'General case' 0 CA--C 1.558 1.254 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.26 -167.519 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 117.708 -1.139 . . . . 0.0 109.571 179.977 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.445 1.1 t . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 102.906 -2.998 . . . . 0.0 102.906 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.9 p -93.94 134.94 35.8 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.197 -174.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.552 HD21 ' OH ' ' A' ' 47' ' ' TYR . 22.4 mt -51.36 -22.37 2.87 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 120.188 3.403 . . . . 0.0 120.188 -163.591 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -58.37 -32.36 68.49 Favored 'General case' 0 CA--C 1.551 1.0 0 O-C-N 123.406 0.441 . . . . 0.0 109.951 175.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -61.59 -52.33 64.83 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 118.01 -0.995 . . . . 0.0 113.26 171.406 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.6 t -56.59 -44.71 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 174.205 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.42 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -58.11 -51.9 67.79 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.353 2.661 . . . . 0.0 112.998 -178.118 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.77 -39.85 84.09 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.86 1.664 . . . . 0.0 113.909 177.456 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -67.17 -34.01 76.63 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.414 1.086 . . . . 0.0 111.155 177.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.86 -11.25 42.51 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.73 1.212 . . . . 0.0 111.291 178.357 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.49 17.57 77.91 Favored Glycine 0 N--CA 1.48 1.602 0 C-N-CA 126.511 2.005 . . . . 0.0 114.15 169.187 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -117.98 136.64 54.5 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 124.828 1.251 . . . . 0.0 110.07 -170.427 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -36.29 123.59 0.77 Allowed 'General case' 0 N--CA 1.52 3.029 0 C-N-CA 127.414 2.286 . . . . 0.0 108.872 -179.485 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -34.21 -46.75 0.26 Allowed 'General case' 0 N--CA 1.53 3.543 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 175.044 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.567 HE21 ' CZ ' ' A' ' 22' ' ' ARG 0.572 0.0 OUTLIER -59.6 -29.97 68.36 Favored 'General case' 0 C--N 1.322 -0.613 1 N-CA-C 124.455 4.983 . . . . 0.0 124.455 176.642 . . . . . . . . 5 4 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' HG23 ' A' ' 23' ' ' VAL . 70.1 p -59.18 -46.14 89.19 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.416 -1.266 . . . . 0.0 112.763 165.047 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.524 ' O ' HG23 ' A' ' 24' ' ' VAL . 92.5 t -66.06 -47.5 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.686 0.794 . . . . 0.0 110.275 -175.757 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.292 2.7 m -61.55 -34.67 75.96 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -177.836 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.567 ' CZ ' HE21 ' A' ' 18' ' ' GLN . 17.3 mtt85 -60.81 -49.02 79.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 111.385 -2.643 . . . . 0.0 114.603 166.423 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 19' ' ' THR . 92.8 t -61.52 -45.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.113 -175.778 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 20' ' ' VAL . 30.1 t -57.97 -45.09 87.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 O-C-N 124.938 1.399 . . . . 0.0 111.477 -168.243 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -90.81 24.24 2.81 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 113.846 -1.525 . . . . 0.0 113.958 175.176 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.292 0.0 OUTLIER 62.98 1.85 0.92 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 129.953 3.301 . . . . 0.0 117.741 173.668 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.76 40.02 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 111.811 -2.45 . . . . 0.0 116.141 -170.921 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.25 98.4 p 61.23 -49.61 0.12 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -164.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -153.33 104.59 2.78 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -174.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 p -125.74 150.99 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 N-CA-C 116.495 2.035 . . . . 0.0 116.495 -179.595 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -59.65 137.48 58.02 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 116.977 2.214 . . . . 0.0 116.977 -176.009 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.24 -61.52 1.95 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.521 1.929 . . . . 0.0 114.868 177.102 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.72 -35.83 56.52 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 38' ' ' VAL . 24.7 m -69.27 -58.14 4.42 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.549 1.54 . . . . 0.0 107.346 174.661 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.458 ' HB3' ' OE2' ' A' ' 39' ' ' GLU . 7.9 mtm105 -53.5 -48.09 69.28 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -179.157 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -56.3 -36.84 69.1 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.735 2.014 . . . . 0.0 113.695 -174.108 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -77.62 -44.64 27.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 109.698 -3.41 . . . . 0.0 110.518 -176.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.539 HG21 HG21 ' A' ' 23' ' ' VAL . 42.0 t -65.34 -48.46 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.125 1.77 . . . . 0.0 108.234 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.458 ' OE2' ' HB3' ' A' ' 35' ' ' ARG . 41.4 mt-10 -59.15 -40.04 84.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 128.64 2.776 . . . . 0.0 115.645 179.123 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.9 58.12 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 111.98 -2.373 . . . . 0.0 110.029 172.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.54 -37.57 73.29 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 112.988 -1.914 . . . . 0.0 113.29 176.986 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.5 ' HG2' ' CD2' ' A' ' 47' ' ' TYR . 34.3 mtt -58.09 -55.98 27.96 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 -174.699 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -42.32 99.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.613 179.024 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.86 -37.07 85.41 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.307 -2.224 . . . . 0.0 112.501 -176.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -94.0 16.84 13.49 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.966 1.306 . . . . 0.0 114.269 -178.165 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.343 1.5 p-10 54.73 48.9 19.17 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-O 123.948 1.832 . . . . 0.0 113.745 178.871 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.552 ' OH ' HD21 ' A' ' 6' ' ' LEU . 73.5 t80 -105.86 157.87 17.16 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.368 -1.287 . . . . 0.0 112.462 -173.166 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.496 0 CA-C-N 114.008 -1.451 . . . . 0.0 111.601 -173.827 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.4 OUTLIER . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 103.354 -2.832 . . . . 0.0 103.354 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 p -85.41 150.56 24.64 Favored 'General case' 0 CA--C 1.552 1.033 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 175.891 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.0 mt -46.41 -25.11 0.6 Allowed 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 119.996 3.332 . . . . 0.0 119.996 -166.811 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -60.54 -40.17 90.6 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 119.665 1.12 . . . . 0.0 112.155 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.57 -31.04 71.86 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.72 179.328 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.69 -50.31 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 168.238 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.68 -53.78 35.3 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.544 1.938 . . . . 0.0 112.249 176.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.39 -39.03 88.8 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.559 1.543 . . . . 0.0 112.298 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.482 ' CB ' HD11 ' A' ' 45' ' ' LEU . 32.4 t80 -65.1 -34.4 78.32 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 121.755 0.788 . . . . 0.0 109.906 177.189 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.53 -11.91 44.35 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.094 178.616 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 31.29 66.83 Favored Glycine 0 N--CA 1.483 1.818 0 C-N-CA 126.891 2.186 . . . . 0.0 112.24 171.544 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.12 128.49 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-O 121.78 0.8 . . . . 0.0 111.354 -168.579 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.4 p -34.57 122.22 0.52 Allowed 'General case' 0 N--CA 1.516 2.826 0 C-N-CA 128.095 2.558 . . . . 0.0 107.462 174.294 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -42.18 -43.3 3.3 Favored 'General case' 0 N--CA 1.538 3.931 0 N-CA-C 117.849 2.537 . . . . 0.0 117.849 -166.509 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.413 0.0 OUTLIER -57.43 -24.83 57.91 Favored 'General case' 0 C--N 1.318 -0.795 1 N-CA-C 123.437 4.606 . . . . 0.0 123.437 -178.214 . . . . . . . . 4 3 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.524 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.7 p -55.77 -54.71 41.09 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.801 0.688 . . . . 0.0 111.707 164.548 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.627 ' O ' HG23 ' A' ' 24' ' ' VAL . 82.1 t -59.74 -49.79 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.31 1.844 . . . . 0.0 108.623 -172.195 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 m -59.81 -37.53 79.4 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.239 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.525 ' HG3' HH11 ' A' ' 22' ' ' ARG . 11.0 mtt85 -67.29 -41.16 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 118.953 2.946 . . . . 0.0 118.953 170.27 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 38' ' ' VAL . 74.4 t -59.35 -41.44 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 126.379 1.872 . . . . 0.0 107.368 179.544 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 20' ' ' VAL . 58.4 t -59.28 -45.0 93.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 113.182 -1.826 . . . . 0.0 112.579 -169.852 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -83.84 4.4 29.44 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 170.3 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.412 HE22 ' HD3' ' A' ' 35' ' ' ARG . 20.9 mm100 66.31 14.18 9.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.016 2.127 . . . . 0.0 115.832 -177.047 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 24.02 40.46 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.834 2.454 . . . . 0.0 117.557 -171.41 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.258 96.0 p 58.46 -53.7 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -162.576 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -140.34 79.56 1.71 Allowed 'General case' 0 CA--C 1.571 1.776 0 C-N-CA 124.101 0.961 . . . . 0.0 109.909 -175.124 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -102.24 140.2 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 119.836 -1.79 . . . . 0.0 114.699 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.1 t -58.2 150.55 21.29 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -176.604 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.69 0.24 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.747 2.019 . . . . 0.0 113.491 -175.834 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -56.32 -30.93 63.21 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 120.401 3.482 . . . . 0.0 120.401 -178.807 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 36.6 m -62.73 -52.0 64.94 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 174.579 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.412 ' HD3' HE22 ' A' ' 26' ' ' GLN . 25.4 mtm105 -57.01 -44.3 82.68 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 176.608 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -36.63 72.56 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.769 1.627 . . . . 0.0 115.157 -176.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.6 ttpt -76.07 -42.31 47.82 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 110.934 -2.848 . . . . 0.0 110.987 -178.453 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 23' ' ' VAL . 74.9 t -65.67 -51.25 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.861 179.595 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -53.57 -46.73 70.4 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 129.825 3.25 . . . . 0.0 110.999 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.85 -49.65 71.92 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.439 -2.164 . . . . 0.0 111.879 176.532 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.18 -49.64 77.07 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.578 -1.647 . . . . 0.0 113.178 176.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.6 mtt -54.2 -45.54 72.22 Favored 'General case' 0 N--CA 1.497 1.903 0 C-N-CA 127.0 2.12 . . . . 0.0 111.061 -179.437 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.61 -47.77 82.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 125.843 1.964 . . . . 0.0 111.507 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -64.41 -40.55 95.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 113.044 -1.889 . . . . 0.0 113.584 177.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.482 HD11 ' CB ' ' A' ' 12' ' ' TYR . 61.6 mt -84.89 9.24 14.88 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 127.632 2.373 . . . . 0.0 115.103 179.978 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.274 0.6 OUTLIER 49.1 34.66 6.04 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 126.29 1.836 . . . . 0.0 114.048 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -80.34 161.29 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.461 -0.774 . . . . 0.0 111.077 -171.338 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.31 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.123 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.863 177.985 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.405 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.5 p -71.96 144.44 48.89 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 -169.559 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.619 ' HB2' ' CE1' ' A' ' 17' ' ' TYR . 41.7 mt -55.5 -23.7 27.55 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -162.747 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -51.82 -39.87 59.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.766 1.626 . . . . 0.0 109.322 177.156 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -62.63 -45.23 93.79 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.706 174.644 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.4 t -57.88 -47.86 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 169.222 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.49 -51.02 66.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.316 1.846 . . . . 0.0 113.547 177.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.43 90.98 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.24 1.816 . . . . 0.0 113.558 179.215 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.415 ' CB ' HD11 ' A' ' 45' ' ' LEU . 37.0 t80 -64.88 -31.82 73.24 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 121.909 0.862 . . . . 0.0 110.582 176.341 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.36 -20.62 25.09 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.295 178.998 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 28.2 55.32 Favored Glycine 0 CA--C 1.545 1.909 0 C-N-CA 126.339 1.923 . . . . 0.0 112.82 173.719 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -127.93 128.25 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -173.128 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 p -52.48 139.88 24.02 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 124.516 1.126 . . . . 0.0 111.407 -173.198 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.619 ' CE1' ' HB2' ' A' ' 6' ' ' LEU . 41.9 t80 -46.63 -43.56 17.58 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 119.871 3.286 . . . . 0.0 119.871 -165.559 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.484 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.403 0.0 OUTLIER -55.37 -25.07 33.13 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 121.748 3.981 . . . . 0.0 121.748 -179.362 . . . . . . . . 4 4 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.535 ' O ' HG23 ' A' ' 23' ' ' VAL . 55.8 p -60.74 -55.17 36.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 114.009 -1.451 . . . . 0.0 112.951 166.461 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 24' ' ' VAL . 97.1 t -60.08 -48.59 87.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.153 1.781 . . . . 0.0 109.469 -176.285 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.341 3.6 m -56.21 -36.8 68.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 115.551 1.685 . . . . 0.0 115.551 177.38 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.548 ' HG3' HH11 ' A' ' 22' ' ' ARG . 12.3 mtt85 -67.81 -45.95 73.27 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 111.727 -2.488 . . . . 0.0 115.98 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.57 HG21 HG21 ' A' ' 38' ' ' VAL . 66.0 t -60.4 -43.33 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 125.372 1.469 . . . . 0.0 109.673 -179.538 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 20' ' ' VAL . 86.0 t -54.58 -50.74 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.382 0 CA-C-N 112.441 -2.163 . . . . 0.0 110.521 -173.434 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.21 18.12 14.34 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.655 -1.611 . . . . 0.0 113.952 177.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 28' ' ' SER 0.3 17.4 mt-30 68.19 11.09 8.22 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 119.768 3.247 . . . . 0.0 119.768 173.657 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.451 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . . . 40.41 -36.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 121.12 3.748 . . . . 0.0 121.12 176.89 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.492 ' H ' ' C ' ' A' ' 26' ' ' GLN . 51.0 p 125.38 -73.32 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.871 1 C-N-CA 133.571 4.748 . . . . 0.0 107.647 -166.425 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -141.08 128.2 20.8 Favored 'General case' 0 CA--C 1.556 1.183 0 CA-C-O 116.546 -1.693 . . . . 0.0 112.238 173.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.416 HG12 ' NE ' ' A' ' 35' ' ' ARG 0.258 0.3 OUTLIER -139.52 158.86 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 118.137 2.643 . . . . 0.0 118.137 167.72 . . . . . . . . 4 4 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -45.27 135.38 5.9 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -176.105 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.71 -63.35 1.2 Allowed 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -172.568 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' ' 33' ' ' LYS 0.265 13.4 tptp -49.08 -34.73 14.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.734 2.124 . . . . 0.0 116.734 179.018 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.499 ' O ' HG23 ' A' ' 38' ' ' VAL . 87.8 m -54.17 -56.26 19.91 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 174.215 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.416 ' NE ' HG12 ' A' ' 30' ' ' VAL . 19.2 mtt180 -58.64 -45.85 88.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.353 1.461 . . . . 0.0 113.72 -175.89 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -34.47 75.44 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 179.995 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.36 -45.77 37.26 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.889 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.57 HG21 HG21 ' A' ' 23' ' ' VAL . 39.8 t -58.48 -48.26 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.288 177.474 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 40.2 mt-10 -60.12 -44.79 94.61 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.561 2.344 . . . . 0.0 114.569 -178.641 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.88 65.43 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.617 176.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.25 -40.98 75.02 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 112.686 -2.052 . . . . 0.0 113.024 176.596 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.6 mtt -60.58 -51.47 69.26 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 125.818 1.647 . . . . 0.0 115.196 -176.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.85 98.54 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 113.189 -1.823 . . . . 0.0 111.835 179.585 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -65.03 -40.97 95.61 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 112.523 -2.126 . . . . 0.0 113.954 -176.83 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.415 HD11 ' CB ' ' A' ' 12' ' ' TYR . 43.5 mt -86.25 22.55 1.76 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.827 1.651 . . . . 0.0 115.251 -178.271 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.3 29.55 3.85 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 126.019 1.728 . . . . 0.0 113.376 177.528 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 61.4 t80 -87.27 -176.22 5.57 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.859 -1.518 . . . . 0.0 110.228 -170.978 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.422 ' N ' ' CG ' ' A' ' 47' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.804 0 CA-C-O 117.941 -1.028 . . . . 0.0 109.388 -173.207 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.469 0.7 OUTLIER . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.339 2.0 p -67.94 105.11 1.9 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.7 mt -43.56 -21.96 0.04 OUTLIER 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -177.453 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -57.28 -31.43 65.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 120.851 0.358 . . . . 0.0 111.931 169.908 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.486 ' OD2' HD22 ' A' ' 45' ' ' LEU . 13.0 t0 -58.82 -51.09 71.49 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.873 0.869 . . . . 0.0 110.895 170.84 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.8 t -59.14 -43.35 89.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 176.218 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.47 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -55.22 -55.45 31.16 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.944 1.697 . . . . 0.0 112.707 175.619 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -42.21 92.66 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.952 2.101 . . . . 0.0 114.229 -179.536 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.436 ' CB ' HD11 ' A' ' 45' ' ' LEU . 36.5 t80 -66.23 -34.27 77.63 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.119 0.887 . . . . 0.0 110.515 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.21 34.84 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 113.822 -1.536 . . . . 0.0 110.571 179.374 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.63 29.0 60.24 Favored Glycine 0 CA--C 1.546 1.99 0 C-N-CA 127.192 2.329 . . . . 0.0 112.71 172.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.32 138.71 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 123.636 0.774 . . . . 0.0 110.483 -167.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -46.2 130.26 10.32 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 127.101 2.161 . . . . 0.0 107.139 178.768 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -50.01 -31.63 13.29 Favored 'General case' 0 N--CA 1.503 2.208 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -50.81 -44.8 59.13 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 124.642 1.214 . . . . 0.0 112.377 177.231 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.621 ' O ' HG23 ' A' ' 23' ' ' VAL 0.756 0.6 OUTLIER -67.79 -40.45 83.92 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.868 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.612 ' O ' HG23 ' A' ' 24' ' ' VAL . 71.6 t -60.98 -50.47 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.221 0.608 . . . . 0.0 110.861 -176.09 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 56.2 p -58.73 -43.44 90.18 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.422 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -59.48 -46.13 89.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 110.621 -2.99 . . . . 0.0 115.861 168.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.628 HG11 HG21 ' A' ' 38' ' ' VAL . 63.0 t -59.0 -43.47 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.658 1.183 . . . . 0.0 108.869 -178.175 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 20' ' ' VAL . 90.9 t -50.54 -48.07 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 112.901 -1.954 . . . . 0.0 112.977 -171.228 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.272 10.7 m120 -99.9 25.82 6.94 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 172.149 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 65.91 5.12 3.28 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 127.51 2.324 . . . . 0.0 116.964 173.837 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 37.94 37.05 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.489 2.716 . . . . 0.0 115.719 -176.049 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.5 p 60.29 -49.54 0.09 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 126.486 1.915 . . . . 0.0 115.774 -163.252 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.266 74.3 m80 -147.83 101.01 3.27 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -175.635 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.43 158.07 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 O-C-N 119.877 -1.764 . . . . 0.0 114.222 170.005 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -57.7 133.31 55.24 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.22 -54.88 42.04 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -177.155 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.98 -38.74 8.06 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 118.553 2.797 . . . . 0.0 118.553 175.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 49.5 m -62.57 -49.02 76.93 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.45 -1.704 . . . . 0.0 107.282 177.987 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.5 OUTLIER -57.57 -46.2 84.26 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 178.076 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.94 -37.09 71.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -178.44 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -77.24 -47.28 20.6 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 112.435 -2.166 . . . . 0.0 111.373 -179.365 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.628 HG21 HG11 ' A' ' 23' ' ' VAL . 47.9 t -62.79 -47.47 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 124.682 1.193 . . . . 0.0 108.009 178.308 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 49.2 mt-10 -54.58 -42.06 70.59 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 128.796 2.838 . . . . 0.0 111.73 -179.974 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.53 66.68 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 112.005 -2.361 . . . . 0.0 110.815 176.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.61 -39.03 79.3 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 112.93 -1.941 . . . . 0.0 112.18 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 31.2 mtt -61.04 -49.07 78.89 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.638 -1.164 . . . . 0.0 114.031 -173.044 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.78 98.09 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 112.336 -2.211 . . . . 0.0 111.687 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.97 -37.78 88.46 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 112.292 -2.231 . . . . 0.0 112.785 -178.706 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.486 HD22 ' OD2' ' A' ' 8' ' ' ASP . 47.8 mt -102.03 22.84 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.605 1.962 . . . . 0.0 113.822 -174.29 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 55.16 28.46 11.07 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 174.393 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -99.44 167.49 10.59 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 113.594 -1.639 . . . . 0.0 110.159 -173.053 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.555 1.146 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.421 -168.394 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.386 0.4 OUTLIER . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 . . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.9 p -90.31 120.77 31.73 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.776 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.493 HD22 HG12 ' A' ' 20' ' ' VAL . 18.8 mt -35.64 -22.19 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.978 0 C-N-CA 129.444 3.098 . . . . 0.0 118.666 -174.529 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.447 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 56.8 m-85 -56.27 -36.17 68.27 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.026 0.53 . . . . 0.0 110.793 170.353 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.477 ' OD2' HD22 ' A' ' 45' ' ' LEU . 18.7 t70 -60.75 -49.88 75.7 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 117.946 -1.026 . . . . 0.0 113.194 173.619 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.6 t -56.96 -41.9 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.079 0.952 . . . . 0.0 113.335 172.168 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.02 -53.67 54.28 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 112.836 -1.984 . . . . 0.0 112.349 -179.244 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.447 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.62 -38.64 84.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.718 2.007 . . . . 0.0 114.031 178.164 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.428 ' CB ' HD11 ' A' ' 45' ' ' LEU . 56.2 t80 -66.14 -35.56 80.8 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.192 0.997 . . . . 0.0 110.763 176.58 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.47 -10.62 51.35 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.262 178.292 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.73 25.94 74.98 Favored Glycine 0 N--CA 1.479 1.514 0 C-N-CA 126.795 2.14 . . . . 0.0 112.204 174.109 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.6 p -119.56 132.02 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 123.785 0.834 . . . . 0.0 109.909 -168.683 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.7 p -38.7 124.64 1.37 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 128.933 2.893 . . . . 0.0 107.204 177.626 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.255 36.5 t80 -46.08 -37.45 6.83 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 116.661 2.097 . . . . 0.0 116.661 -171.517 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -52.3 -40.0 61.25 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -178.142 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.488 ' O ' HG23 ' A' ' 23' ' ' VAL . 73.2 p -53.44 -50.15 65.85 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.436 1.094 . . . . 0.0 112.802 175.537 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.663 ' O ' HG23 ' A' ' 24' ' ' VAL . 86.5 t -64.17 -55.44 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.657 -170.588 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.323 13.6 m -62.73 -33.3 74.85 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -43.44 98.81 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 117.225 2.306 . . . . 0.0 117.225 167.697 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.622 HG21 HG21 ' A' ' 38' ' ' VAL . 17.9 t -58.01 -49.01 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 127.157 2.183 . . . . 0.0 108.836 177.656 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 20' ' ' VAL . 69.8 t -56.65 -44.61 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 CA-C-N 110.849 -2.887 . . . . 0.0 111.528 -169.678 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -96.62 11.4 35.42 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 113.444 -1.707 . . . . 0.0 114.178 176.857 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.533 HE21 ' NH2' ' A' ' 35' ' ' ARG 0.279 24.5 tt0 60.11 20.74 9.97 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.272 2.629 . . . . 0.0 115.859 177.244 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.8 37.91 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 110.456 -3.065 . . . . 0.0 117.815 -176.639 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.4 t 65.78 -54.3 0.37 Allowed 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.667 1.587 . . . . 0.0 112.233 -163.751 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.256 69.6 m80 -144.82 89.95 2.02 Favored 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.442 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.647 HG13 ' HD2' ' A' ' 35' ' ' ARG . 7.9 p -100.67 146.82 8.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 119.985 -1.697 . . . . 0.0 114.028 174.296 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.05 138.51 58.19 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 174.929 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.98 -55.69 29.91 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -172.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.625 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -49.01 -36.01 16.7 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 117.694 2.479 . . . . 0.0 117.694 178.525 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.5 m -60.76 -48.69 80.66 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.417 176.811 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.647 ' HD2' HG13 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -61.49 -39.82 92.35 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 177.797 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -34.41 69.62 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -178.254 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -77.78 -47.68 18.4 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 111.783 -2.462 . . . . 0.0 110.824 -179.941 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.622 HG21 HG21 ' A' ' 23' ' ' VAL . 39.7 t -63.26 -35.87 73.81 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.03 179.958 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 47.8 mt-10 -61.5 -45.58 93.61 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 130.495 3.518 . . . . 0.0 113.394 -176.643 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.21 82.85 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.007 174.988 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 38' ' ' VAL . . . -55.45 -44.72 76.65 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 112.009 -2.36 . . . . 0.0 113.156 175.959 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.9 mtt -59.36 -50.54 73.58 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.4 1.88 . . . . 0.0 114.892 -179.732 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.62 89.07 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 112.892 -1.958 . . . . 0.0 112.584 179.866 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -66.54 -36.81 83.59 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 113.021 -1.9 . . . . 0.0 113.058 -179.931 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.477 HD22 ' OD2' ' A' ' 8' ' ' ASP . 38.6 mt -92.15 7.09 44.09 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 114.257 177.265 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.337 2.4 p-10 62.42 -49.68 0.17 Allowed 'General case' 0 C--N 1.346 0.428 0 C-N-CA 130.656 3.582 . . . . 0.0 117.374 -173.822 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . 0.268 7.4 t80 29.93 -91.23 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 110.565 -3.016 . . . . 0.0 116.597 -179.271 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.259 0.0 OUTLIER . . . . . 0 N--CA 1.509 2.517 0 C-N-CA 129.362 3.065 . . . . 0.0 111.779 -155.486 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.512 1.2 t . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 103.875 -2.639 . . . . 0.0 103.875 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 p -94.6 141.13 28.96 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-O 118.65 -0.69 . . . . 0.0 109.232 -173.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.454 HD21 ' CE2' ' A' ' 47' ' ' TYR . 10.8 mt -57.61 -13.48 3.96 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 120.499 3.518 . . . . 0.0 120.499 -158.023 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -57.85 -33.43 68.64 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 119.881 1.219 . . . . 0.0 111.622 175.561 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -65.9 -47.61 74.23 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.457 176.978 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.3 t -59.23 -43.84 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.577 0.751 . . . . 0.0 112.207 175.17 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.38 -50.55 73.25 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.07 1.348 . . . . 0.0 113.213 179.101 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -37.68 81.24 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 127.558 2.343 . . . . 0.0 114.196 177.424 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -63.94 -36.21 83.21 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.237 1.015 . . . . 0.0 109.767 175.751 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.12 -15.81 30.86 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.541 -179.142 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.23 19.05 78.85 Favored Glycine 0 N--CA 1.485 1.926 0 C-N-CA 127.451 2.453 . . . . 0.0 113.711 173.899 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -127.43 121.27 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 C-N-CA 124.08 0.952 . . . . 0.0 109.717 -166.536 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -17.06 138.22 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.846 0 C-N-CA 129.533 3.133 . . . . 0.0 112.02 -178.861 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -55.74 -27.8 52.56 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 118.527 -2.608 . . . . 0.0 115.177 170.423 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -54.29 -51.28 65.09 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 116.994 -1.479 . . . . 0.0 111.822 171.646 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.546 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.0 -50.45 73.36 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 179.275 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.613 ' O ' HG23 ' A' ' 24' ' ' VAL 0.293 71.8 t -63.19 -47.39 92.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.493 -173.58 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.6 p -59.2 -42.77 91.72 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -177.93 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 19' ' ' THR . 55.0 mtp85 -59.13 -50.77 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 110.007 -3.27 . . . . 0.0 115.004 168.647 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 19' ' ' THR . 88.6 t -59.28 -44.61 92.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 124.299 1.04 . . . . 0.0 109.281 -176.442 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 20' ' ' VAL . 47.2 t -54.13 -50.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.006 -165.271 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.485 HD22 ' HA ' ' A' ' 25' ' ' ASN 0.399 3.0 m120 -105.31 42.0 1.29 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 172.34 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.52 ' HA ' HH22 ' A' ' 35' ' ' ARG 0.424 17.7 tt0 73.01 -3.28 2.47 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 121.346 3.832 . . . . 0.0 121.346 165.702 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.31 30.72 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 112.077 -2.329 . . . . 0.0 115.372 -176.546 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.8 p 60.96 -53.41 0.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.36 1.864 . . . . 0.0 114.322 -158.648 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -150.99 141.8 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 117.631 -1.175 . . . . 0.0 108.73 -178.964 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.442 HG11 HG22 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -150.33 159.79 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 121.08 1.764 . . . . 0.0 113.713 164.346 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -51.32 139.29 19.46 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 175.569 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.86 -57.56 11.56 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.568 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -41.94 -41.19 2.4 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 177.684 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.6 m -58.5 -48.89 79.3 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 114.256 -1.338 . . . . 0.0 108.676 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.52 HH22 ' HA ' ' A' ' 26' ' ' GLN . 40.2 mtt-85 -60.47 -46.4 90.22 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 125.539 1.536 . . . . 0.0 113.964 -179.956 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -32.04 70.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -178.318 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ttpt -80.46 -41.62 24.08 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 111.338 -2.665 . . . . 0.0 112.516 -178.904 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.47 HG21 HG11 ' A' ' 23' ' ' VAL . 98.4 t -61.79 -51.32 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 126.326 1.85 . . . . 0.0 107.611 172.315 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.08 -41.06 91.63 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.54 1.936 . . . . 0.0 115.133 -175.955 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.3 -51.1 62.91 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 112.329 -2.214 . . . . 0.0 110.751 174.063 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.19 -41.53 84.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.297 -1.774 . . . . 0.0 113.559 176.554 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 mtt -62.58 -44.59 95.94 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -179.894 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.62 98.31 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.875 178.411 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -64.57 -37.86 89.03 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.006 -1.906 . . . . 0.0 112.925 179.855 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 40.8 mt -95.91 16.21 18.35 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.082 2.553 . . . . 0.0 115.135 178.612 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.328 0.1 OUTLIER 45.63 30.11 0.75 Allowed 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.588 2.811 . . . . 0.0 118.588 -178.199 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.454 ' CE2' HD21 ' A' ' 6' ' ' LEU . 84.1 t80 -93.7 88.26 5.76 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 112.25 -2.25 . . . . 0.0 111.422 -163.807 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.509 2.482 0 CA-C-N 111.378 -2.646 . . . . 0.0 113.278 153.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.3 tpt . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HE3' HD12 ' A' ' 6' ' ' LEU . 0.2 OUTLIER 159.49 162.71 0.03 OUTLIER Pre-proline 0 CA--C 1.566 1.575 0 C-N-CA 128.024 2.53 . . . . 0.0 113.21 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . 0.266 24.7 Cg_exo -53.98 -28.4 49.54 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 N-CA-C 120.25 3.135 . . . . 0.0 120.25 -176.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.423 0.8 OUTLIER -161.43 141.08 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 105.465 -2.05 . . . . 0.0 105.465 -179.371 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 1.1 p -60.0 97.02 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 127.053 2.141 . . . . 0.0 107.415 174.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.415 HD12 ' HE3' ' A' ' 2' ' ' LYS . 24.3 mt -39.95 -19.96 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.661 0 N-CA-C 119.085 2.994 . . . . 0.0 119.085 -177.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.9 m-85 -54.85 -35.22 63.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.228 0.611 . . . . 0.0 111.353 166.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -58.01 -48.87 78.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.071 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -58.25 -46.35 88.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 173.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.64 -50.73 69.42 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 112.629 -2.078 . . . . 0.0 111.917 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -43.39 75.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.83 2.452 . . . . 0.0 113.844 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -66.98 -33.7 76.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.266 1.026 . . . . 0.0 110.384 177.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.08 -9.26 57.03 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.081 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.54 24.45 76.2 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 126.821 2.153 . . . . 0.0 112.477 170.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.9 p -122.77 134.19 66.66 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 124.183 0.993 . . . . 0.0 110.665 -170.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 81.4 p -41.08 128.54 2.8 Favored 'General case' 0 N--CA 1.51 2.558 0 C-N-CA 127.648 2.379 . . . . 0.0 107.751 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -42.98 -31.31 0.5 Allowed 'General case' 0 N--CA 1.523 3.186 0 N-CA-C 116.658 2.096 . . . . 0.0 116.658 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -48.25 -45.16 34.06 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 125.175 1.547 . . . . 0.0 112.149 177.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 23' ' ' VAL . 6.7 p -59.88 -53.98 51.5 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 178.047 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' HG23 ' A' ' 24' ' ' VAL 0.329 79.3 t -59.86 -50.97 78.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.705 0.802 . . . . 0.0 111.25 -163.785 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.508 49.4 m -66.3 -29.01 69.14 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 119.77 3.248 . . . . 0.0 119.77 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -44.4 92.09 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 112.429 -2.169 . . . . 0.0 115.736 164.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 38' ' ' VAL . 75.4 t -60.94 -43.9 96.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.564 1.545 . . . . 0.0 108.4 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 20' ' ' VAL . 84.1 t -53.8 -49.07 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 112.995 -1.911 . . . . 0.0 112.334 -172.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.751 ' ND2' HD21 ' A' ' 50' ' ' ASN . 20.3 m120 -90.94 14.81 12.78 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 171.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 63.3 14.7 8.05 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.196 2.599 . . . . 0.0 117.819 176.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 29.06 40.96 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 110.53 -3.032 . . . . 0.0 116.326 -172.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p 56.59 -52.96 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.62 1.968 . . . . 0.0 115.919 -165.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -137.27 117.03 13.08 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.135 -1.432 . . . . 0.0 107.135 170.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -133.73 154.39 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 CA-C-N 120.18 1.355 . . . . 0.0 113.215 169.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 p -59.94 128.62 37.77 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.706 0.802 . . . . 0.0 112.757 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.79 -53.79 36.0 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.819 1.415 . . . . 0.0 114.819 -174.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.87 -36.95 8.08 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 42.1 m -60.63 -49.25 78.29 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.509 1.524 . . . . 0.0 108.142 175.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.3 mtp-105 -60.41 -43.49 96.67 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 126.214 1.806 . . . . 0.0 113.182 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.07 -35.06 70.84 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -77.89 -46.23 21.92 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-N 112.071 -2.331 . . . . 0.0 111.604 -179.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.464 HG21 HG11 ' A' ' 23' ' ' VAL . 51.1 t -62.52 -47.29 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 C-N-CA 126.169 1.788 . . . . 0.0 108.039 177.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.24 -43.8 79.03 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 128.888 2.875 . . . . 0.0 111.57 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -52.63 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 112.235 -2.257 . . . . 0.0 110.673 176.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.58 -39.68 68.05 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 112.903 -1.953 . . . . 0.0 113.174 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.407 ' SD ' ' HA ' ' A' ' 49' ' ' PRO . 10.1 mtt -59.87 -52.81 63.85 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 117.428 2.381 . . . . 0.0 117.428 -173.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.04 96.52 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 112.412 -2.176 . . . . 0.0 112.866 178.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -65.92 -33.1 75.04 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 111.324 -2.671 . . . . 0.0 113.987 -177.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 65.2 mt -98.78 21.11 11.9 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.996 1.718 . . . . 0.0 113.878 -177.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.17 24.14 7.73 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.409 ' CZ ' ' HB2' ' A' ' 51' ' ' ARG . 40.7 t80 -99.74 157.26 16.61 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -172.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.556 HG22 HH11 ' A' ' 51' ' ' ARG 0.358 7.2 mm -127.34 119.64 21.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 N-CA-C 118.806 2.891 . . . . 0.0 118.806 -177.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.544 ' HD3' ' HA ' ' A' ' 48' ' ' ILE 0.367 0.1 OUTLIER -14.54 -62.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.881 2 C-N-CA 126.819 5.013 . . . . 0.0 123.011 -162.334 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.751 HD21 ' ND2' ' A' ' 25' ' ' ASN . 0.1 OUTLIER -112.84 45.13 1.38 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 117.887 2.551 . . . . 0.0 117.887 -172.303 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.556 HH11 HG22 ' A' ' 48' ' ' ILE . 3.4 mmp_? -88.78 79.01 7.53 Favored 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.925 -172.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 1.9 m -74.65 166.57 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 114.196 -1.365 . . . . 0.0 111.571 167.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.52 73.28 1.93 Allowed 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 123.159 1.457 . . . . 0.0 113.126 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -144.58 92.94 2.35 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 112.58 -2.1 . . . . 0.0 111.199 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.75 -50.42 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 109.566 -3.47 . . . . 0.0 109.994 174.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 62.6 mt . . . . . 0 N--CA 1.492 1.661 0 CA-C-N 114.275 -1.329 . . . . 0.0 113.827 175.881 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.654 ' HG3' ' HA ' ' A' ' 5' ' ' THR . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.839 0 N-CA-C 117.206 2.298 . . . . 0.0 117.206 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.629 ' HD2' HE21 ' A' ' 55' ' ' GLN 0.331 22.7 tptm -111.52 -60.24 0.04 OUTLIER Pre-proline 0 N--CA 1.486 1.33 0 CA-C-O 115.984 -1.96 . . . . 0.0 113.838 -177.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -74.76 -29.95 8.13 Favored 'Trans proline' 0 N--CA 1.488 1.162 0 CA-C-N 121.986 1.745 . . . . 0.0 115.736 -177.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.443 0.5 OUTLIER -159.33 153.23 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 O-C-N 124.758 1.286 . . . . 0.0 107.699 -170.139 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.654 ' HA ' ' HG3' ' A' ' 1' ' ' MET . 2.6 p -78.56 114.75 17.75 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 102.706 -3.072 . . . . 0.0 102.706 -174.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.525 HD21 ' CZ ' ' A' ' 47' ' ' TYR . 24.3 mt -48.69 -19.91 0.41 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -175.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 70.5 m-85 -54.74 -35.52 63.81 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.382 0.673 . . . . 0.0 111.318 167.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.45 ' OD2' HD22 ' A' ' 45' ' ' LEU . 36.6 t0 -60.76 -47.69 85.19 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 118.156 -0.926 . . . . 0.0 112.992 172.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.543 ' HA ' HD13 ' A' ' 45' ' ' LEU . 93.7 t -59.26 -43.06 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.83 -52.84 61.59 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 111.582 -2.553 . . . . 0.0 111.877 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.481 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.4 OUTLIER -65.39 -39.47 92.26 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.387 1.875 . . . . 0.0 113.868 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.427 ' CB ' HD11 ' A' ' 45' ' ' LEU . 33.9 t80 -66.97 -34.32 77.5 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.156 0.91 . . . . 0.0 110.829 177.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.45 -13.46 34.77 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 125.018 1.327 . . . . 0.0 112.099 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.39 26.3 72.27 Favored Glycine 0 CA--C 1.546 2.002 0 C-N-CA 126.674 2.083 . . . . 0.0 112.985 173.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -125.96 136.14 61.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 121.448 0.642 . . . . 0.0 109.865 -171.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.8 p -36.65 128.65 0.82 Allowed 'General case' 0 N--CA 1.509 2.492 0 C-N-CA 128.694 2.798 . . . . 0.0 108.131 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -49.23 -36.55 20.48 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 117.149 2.277 . . . . 0.0 117.149 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.605 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.522 0.0 OUTLIER -59.48 -27.19 65.9 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 121.734 3.975 . . . . 0.0 121.734 172.695 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 44.3 p -62.58 -52.82 61.88 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 124.457 1.098 . . . . 0.0 111.796 163.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.648 ' O ' HG23 ' A' ' 24' ' ' VAL . 79.4 t -59.28 -50.29 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.969 1.308 . . . . 0.0 108.532 -173.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.7 p -55.69 -42.47 75.25 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.683 1.193 . . . . 0.0 113.901 -177.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.605 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 40.8 mtt85 -62.06 -47.41 84.8 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 111.817 -2.447 . . . . 0.0 116.328 170.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.498 HG11 HG21 ' A' ' 38' ' ' VAL . 49.1 t -58.28 -41.38 80.99 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 C-N-CA 127.048 2.139 . . . . 0.0 107.556 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 20' ' ' VAL . 57.5 t -56.8 -42.55 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.286 -170.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.284 15.1 m120 -101.31 22.99 11.61 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 168.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.389 9.3 pt20 58.47 -0.36 0.12 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 130.988 3.715 . . . . 0.0 119.404 -177.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.09 33.08 0.14 Allowed 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 112.14 -2.3 . . . . 0.0 114.716 -171.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p 59.96 -54.04 0.07 Allowed 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 126.999 2.12 . . . . 0.0 114.432 -159.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -144.41 116.37 8.32 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-N 113.606 -1.634 . . . . 0.0 111.985 -172.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.2 t -146.43 156.49 11.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-N 120.254 1.388 . . . . 0.0 113.083 168.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -45.57 133.82 7.55 Favored 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.89 -53.44 52.61 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -49.11 -35.59 16.73 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 117.827 2.529 . . . . 0.0 117.827 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 56.7 m -60.05 -50.24 74.5 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -58.48 -42.5 87.69 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.81 -39.78 92.95 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -74.34 -43.79 55.16 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 112.133 -2.303 . . . . 0.0 110.531 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.498 HG21 HG11 ' A' ' 23' ' ' VAL . 45.7 t -63.08 -49.1 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 125.83 1.652 . . . . 0.0 108.052 177.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -57.87 -41.38 82.35 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.251 2.62 . . . . 0.0 114.886 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.04 -49.31 75.1 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 111.311 -2.677 . . . . 0.0 110.325 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.61 -39.86 85.65 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 112.638 -2.074 . . . . 0.0 113.308 175.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.421 ' SD ' ' HG3' ' A' ' 49' ' ' PRO . 25.7 mtt -58.89 -51.59 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -174.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.68 97.68 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 112.248 -2.251 . . . . 0.0 111.88 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -62.85 -42.51 99.77 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 111.534 -2.575 . . . . 0.0 112.249 -178.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 9' ' ' VAL . 51.8 mt -93.09 23.21 4.44 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.355 1.862 . . . . 0.0 114.02 -177.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 50.4 34.15 8.73 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.955 2.206 . . . . 0.0 116.955 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.525 ' CZ ' HD21 ' A' ' 6' ' ' LEU . 32.0 t80 -96.17 160.69 14.31 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 113.986 -1.461 . . . . 0.0 112.754 -173.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -136.38 115.43 10.77 Favored Pre-proline 0 CA--C 1.548 0.898 0 CA-C-N 112.556 -2.111 . . . . 0.0 109.048 -176.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.421 ' HG3' ' SD ' ' A' ' 42' ' ' MET . 22.9 Cg_exo -44.77 87.64 0.02 OUTLIER 'Trans proline' 0 CA--C 1.559 1.745 1 C-N-CA 126.427 4.751 . . . . 0.0 110.746 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.655 HD21 HG22 ' A' ' 52' ' ' VAL 0.28 0.1 OUTLIER -163.97 -61.88 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.261 1 N-CA-C 123.144 4.498 . . . . 0.0 123.144 -173.092 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.632 ' NH2' ' H ' ' A' ' 53' ' ' ALA 0.293 0.0 OUTLIER 54.57 104.41 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 117.2 2.296 . . . . 0.0 117.2 -172.718 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.655 HG22 HD21 ' A' ' 50' ' ' ASN . 0.6 OUTLIER -136.03 90.59 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 O-C-N 119.886 -1.759 . . . . 0.0 109.307 165.076 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.632 ' H ' ' NH2' ' A' ' 51' ' ' ARG . . . -73.49 80.69 1.45 Allowed 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 123.538 1.637 . . . . 0.0 110.878 174.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.09 49.75 1.23 Allowed 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 124.411 2.053 . . . . 0.0 112.718 -174.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.629 HE21 ' HD2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -163.02 -50.08 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 110.481 -3.054 . . . . 0.0 110.414 -177.206 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.8 mp . . . . . 0 N--CA 1.481 1.085 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 163.27 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.4 tpp . . . . . 0 CA--C 1.555 1.14 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.434 ' NZ ' HD12 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -132.18 151.93 79.25 Favored Pre-proline 0 CA--C 1.562 1.418 0 CA-C-O 115.57 -2.157 . . . . 0.0 107.367 174.358 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -62.74 -12.7 30.05 Favored 'Trans proline' 0 N--CA 1.487 1.128 0 CA-C-N 124.457 2.627 . . . . 0.0 118.596 -174.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER -154.81 150.33 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 N-CA-C 103.448 -2.797 . . . . 0.0 103.448 174.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.257 80.3 m -61.86 110.46 1.55 Allowed 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 105.202 -2.148 . . . . 0.0 105.202 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.434 HD12 ' NZ ' ' A' ' 2' ' ' LYS . 40.4 mt -51.85 -17.46 0.97 Allowed 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.586 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.373 23.1 m-85 -57.78 -29.38 64.8 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 120.28 1.4 . . . . 0.0 112.687 165.652 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -63.43 -50.96 67.72 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.399 174.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.1 t -56.89 -43.04 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 CA-C-O 121.302 0.572 . . . . 0.0 112.418 175.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.437 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -61.12 -50.77 71.86 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 112.436 -2.165 . . . . 0.0 111.847 -176.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.586 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -68.78 -40.65 79.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.624 1.97 . . . . 0.0 115.182 175.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -62.79 -33.93 76.21 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.048 1.339 . . . . 0.0 110.079 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.68 -22.64 17.43 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 113.891 -1.504 . . . . 0.0 111.663 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.53 25.35 56.91 Favored Glycine 0 CA--C 1.554 2.524 0 C-N-CA 125.699 1.619 . . . . 0.0 113.18 173.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.538 HG22 HG21 ' A' ' 19' ' ' THR . 6.9 p -126.25 94.5 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.222 0 C-N-CA 122.992 0.517 . . . . 0.0 110.066 -167.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 55.6 p -7.62 127.11 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.734 0 C-N-CA 127.334 2.254 . . . . 0.0 113.672 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -50.17 -38.89 41.88 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 117.924 2.565 . . . . 0.0 117.924 -171.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -51.2 -40.11 57.98 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 118.906 0.775 . . . . 0.0 112.472 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.538 HG21 HG22 ' A' ' 15' ' ' VAL . 20.4 m -55.39 -53.26 58.48 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.835 2.054 . . . . 0.0 112.169 171.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.675 ' O ' HG23 ' A' ' 24' ' ' VAL . 73.6 t -63.73 -53.42 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-O 118.675 -0.679 . . . . 0.0 109.698 -173.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.413 3.2 m -60.22 -34.09 73.17 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 117.198 2.295 . . . . 0.0 117.198 -177.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 mtp85 -59.06 -49.54 77.51 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.249 -1.796 . . . . 0.0 115.36 166.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.827 HG11 HG21 ' A' ' 38' ' ' VAL . 29.5 t -57.82 -47.24 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 126.533 1.933 . . . . 0.0 108.749 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 20' ' ' VAL . 39.3 t -57.35 -42.07 79.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 O-C-N 126.594 2.434 . . . . 0.0 112.299 -166.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.47 ' OD1' HG23 ' A' ' 52' ' ' VAL . 5.9 m-20 -94.54 15.01 19.04 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 125.209 1.568 . . . . 0.0 112.773 175.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 69.03 9.63 7.51 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.15 2.18 . . . . 0.0 116.571 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.66 38.63 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.789 -2.46 . . . . 0.0 117.197 -173.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.4 p 58.88 -50.16 0.06 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 126.343 1.857 . . . . 0.0 115.758 -164.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -146.86 93.8 2.33 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.44 HG11 ' HD3' ' A' ' 35' ' ' ARG . 11.1 p -116.63 155.34 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.58 124.87 21.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.82 -63.56 1.07 Allowed 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.92 1.822 . . . . 0.0 115.92 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.695 ' HE3' ' H ' ' A' ' 33' ' ' LYS 0.362 0.1 OUTLIER -42.6 -35.63 1.15 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 119.652 3.204 . . . . 0.0 119.652 173.078 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 m -65.46 -50.55 64.95 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 112.879 -1.964 . . . . 0.0 108.178 175.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.674 ' HD2' HG13 ' A' ' 23' ' ' VAL . 6.5 mmm180 -57.16 -45.79 83.32 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 178.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.59 -36.43 73.99 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.5 ttmt -76.06 -44.32 39.6 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 112.266 -2.243 . . . . 0.0 111.186 -177.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.827 HG21 HG11 ' A' ' 23' ' ' VAL . 55.1 t -63.91 -47.94 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 126.463 1.905 . . . . 0.0 108.18 177.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 46.2 mt-10 -54.55 -44.84 73.21 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.452 2.701 . . . . 0.0 111.405 -178.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.56 -50.89 69.53 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.142 -2.299 . . . . 0.0 111.0 177.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.52 -41.37 89.83 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 113.206 -1.816 . . . . 0.0 114.019 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.549 ' SD ' ' HG3' ' A' ' 49' ' ' PRO . 26.5 mtt -62.07 -44.83 95.82 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 119.949 -1.719 . . . . 0.0 112.962 -174.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.52 93.49 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 126.271 2.232 . . . . 0.0 111.496 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -65.91 -34.18 77.53 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.914 -2.403 . . . . 0.0 113.351 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.5 mt -97.24 13.92 27.8 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.294 2.237 . . . . 0.0 114.486 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.37 33.75 21.48 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 117.573 2.435 . . . . 0.0 117.573 175.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -92.1 152.68 19.81 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.925 -171.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.294 0.0 OUTLIER -126.65 109.65 22.85 Favored Pre-proline 0 N--CA 1.474 0.74 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.694 -179.217 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.549 ' HG3' ' SD ' ' A' ' 42' ' ' MET . 71.7 Cg_exo -50.61 85.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 124.982 3.788 . . . . 0.0 116.103 -169.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.44 ' HB3' ' H ' ' A' ' 51' ' ' ARG . 0.2 OUTLIER -179.92 -110.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.944 2.498 . . . . 0.0 110.697 158.297 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.662 ' NH1' HE21 ' A' ' 55' ' ' GLN 0.493 52.2 mtp85 39.24 -10.26 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 121.51 3.893 . . . . 0.0 121.51 -171.097 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.47 HG23 ' OD1' ' A' ' 25' ' ' ASN . 2.7 m -77.36 8.84 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 CA-C-N 113.714 -1.584 . . . . 0.0 115.123 145.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -118.77 87.97 2.84 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 140.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -48.86 114.16 0.93 Allowed 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 111.438 -2.619 . . . . 0.0 116.467 -171.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.662 HE21 ' NH1' ' A' ' 51' ' ' ARG . 4.4 mp0 56.18 42.67 27.86 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 112.918 -1.946 . . . . 0.0 113.954 175.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.492 ' H ' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 117.188 2.292 . . . . 0.0 117.188 -176.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.574 ' HA ' HG23 ' A' ' 52' ' ' VAL . 23.1 mmt . . . . . 0 N--CA 1.48 1.042 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HE3' ' H ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -164.33 168.57 9.04 Favored Pre-proline 0 CA--C 1.567 1.612 0 CA-C-O 116.205 -1.855 . . . . 0.0 110.907 169.642 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -105.05 -11.81 0.09 OUTLIER 'Trans proline' 0 CA--C 1.543 0.957 0 N-CA-C 117.035 1.898 . . . . 0.0 117.035 175.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.53 1.1 t -164.79 153.0 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 -164.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 40.0 p -95.32 145.33 25.18 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.262 0.937 . . . . 0.0 109.556 -175.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.851 ' HG ' HE22 ' A' ' 54' ' ' GLN . 4.6 mt -59.94 -14.9 17.94 Favored 'General case' 0 N--CA 1.506 2.343 0 N-CA-C 117.095 2.258 . . . . 0.0 117.095 -163.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.491 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 47.2 m-85 -55.87 -38.42 70.1 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 120.468 1.485 . . . . 0.0 111.448 174.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -64.73 -44.51 89.94 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-O 117.636 -1.174 . . . . 0.0 112.767 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.423 ' HA ' HD13 ' A' ' 45' ' ' LEU . 81.1 t -59.64 -43.61 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-N 118.747 0.703 . . . . 0.0 112.886 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.9 69.94 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 113.173 -1.83 . . . . 0.0 113.394 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.491 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.5 OUTLIER -66.75 -39.55 87.94 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.473 1.909 . . . . 0.0 114.274 174.585 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -63.43 -33.7 76.13 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.414 1.086 . . . . 0.0 110.31 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.28 -19.58 19.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.106 1.362 . . . . 0.0 112.216 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.83 25.1 56.92 Favored Glycine 0 CA--C 1.549 2.216 0 C-N-CA 126.613 2.054 . . . . 0.0 113.399 174.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.471 HG22 HG21 ' A' ' 19' ' ' THR 0.268 3.9 p -129.83 119.16 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.33 0 C-N-CA 124.914 1.285 . . . . 0.0 108.24 -166.482 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.7 p -27.47 143.55 0.01 OUTLIER 'General case' 0 N--CA 1.526 3.344 0 C-N-CA 128.647 2.779 . . . . 0.0 111.849 -174.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.534 ' CE2' ' HB2' ' A' ' 6' ' ' LEU . 64.2 t80 -57.62 -34.33 69.19 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 119.238 -2.164 . . . . 0.0 114.665 175.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.266 14.8 tp60 -56.41 -45.95 80.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 117.434 -1.27 . . . . 0.0 112.596 173.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' HG23 ' A' ' 23' ' ' VAL . 86.4 m -53.31 -54.17 40.35 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.885 1.274 . . . . 0.0 111.388 175.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' HG23 ' A' ' 24' ' ' VAL . 70.6 t -64.18 -49.26 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.837 -176.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.281 69.6 p -57.42 -39.38 76.07 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 119.196 3.036 . . . . 0.0 119.196 -174.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 19' ' ' THR . 36.6 mtp85 -61.58 -51.18 69.6 Favored 'General case' 0 C--N 1.319 -0.72 1 CA-C-N 106.857 -4.701 . . . . 0.0 114.198 167.123 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 19' ' ' THR . 95.1 t -58.58 -43.01 86.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.861 1.265 . . . . 0.0 109.764 -176.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 20' ' ' VAL . 75.9 t -49.14 -53.22 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 CA-C-N 112.705 -2.043 . . . . 0.0 111.816 -171.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.331 16.4 m120 -107.37 37.43 2.4 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 113.67 -1.605 . . . . 0.0 114.589 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.69 HE21 ' CZ ' ' A' ' 35' ' ' ARG 0.253 2.2 tp60 73.92 -5.46 2.03 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 129.289 3.036 . . . . 0.0 117.873 166.133 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 36.69 36.32 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 113.302 -1.772 . . . . 0.0 115.256 -176.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.0 p 55.31 -48.37 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -151.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.262 71.7 m80 -157.57 130.91 7.77 Favored 'General case' 0 CA--C 1.567 1.618 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -170.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -145.5 150.68 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 116.967 2.21 . . . . 0.0 116.967 162.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.3 p -51.47 139.47 19.88 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -57.48 9.34 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -173.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.523 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -40.2 -43.22 1.63 Allowed 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 176.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.8 m -57.79 -48.79 78.69 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 126.528 1.931 . . . . 0.0 108.577 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.69 ' CZ ' HE21 ' A' ' 26' ' ' GLN . 43.7 mtt-85 -65.33 -44.8 86.63 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 117.475 2.398 . . . . 0.0 117.475 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.21 -29.94 64.15 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 115.494 1.664 . . . . 0.0 115.494 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -80.31 -42.28 23.31 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 111.381 -2.645 . . . . 0.0 112.048 -178.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.54 -49.7 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 125.686 1.595 . . . . 0.0 109.204 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -55.63 -46.84 77.34 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.605 3.162 . . . . 0.0 111.757 -176.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -51.17 64.02 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.339 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.97 -42.05 84.23 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 112.974 -1.921 . . . . 0.0 114.598 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -56.09 -45.2 79.49 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 178.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.09 -43.74 91.1 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.646 -2.07 . . . . 0.0 113.071 177.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -66.1 -38.46 88.27 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 112.759 -2.019 . . . . 0.0 113.014 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 9' ' ' VAL . 30.3 mt -85.3 13.66 6.25 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 127.089 2.156 . . . . 0.0 113.842 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.401 0.2 OUTLIER 44.99 31.5 0.71 Allowed 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 115.98 1.844 . . . . 0.0 115.98 -176.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -98.59 101.14 12.47 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.058 -160.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -28.1 117.82 0.26 Allowed Pre-proline 0 N--CA 1.502 2.173 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 167.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -65.86 64.99 0.43 Allowed 'Trans proline' 0 CA--C 1.549 1.235 0 C-N-CA 122.75 2.3 . . . . 0.0 116.529 170.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 51' ' ' ARG . 0.9 OUTLIER -167.83 164.04 14.09 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 112.087 -2.324 . . . . 0.0 109.134 161.545 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HG3' HD11 ' A' ' 6' ' ' LEU . 0.9 OUTLIER -124.1 74.23 1.28 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 168.626 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.574 HG23 ' HA ' ' A' ' 1' ' ' MET . 0.6 OUTLIER -90.88 103.13 14.12 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.331 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 -176.494 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 53.67 82.83 0.08 Allowed 'General case' 0 N--CA 1.51 2.567 0 CA-C-O 122.787 1.28 . . . . 0.0 111.927 -177.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.851 HE22 ' HG ' ' A' ' 6' ' ' LEU . 10.3 tt0 -81.69 117.23 21.86 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 113.932 -1.486 . . . . 0.0 108.632 174.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.538 ' H ' ' HE3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -89.48 75.3 7.61 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 111.477 -2.601 . . . . 0.0 112.046 -178.036 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 N--CA 1.489 1.496 0 CA-C-N 109.66 -3.427 . . . . 0.0 115.507 -174.69 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -129.9 157.7 76.03 Favored Pre-proline 0 CA--C 1.551 0.985 0 N-CA-C 117.956 2.576 . . . . 0.0 117.956 -175.028 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HA ' ' OE1' ' A' ' 55' ' ' GLN . 42.3 Cg_exo -67.7 -36.84 17.79 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 CA-C-N 121.038 1.406 . . . . 0.0 115.467 167.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.434 0.5 OUTLIER -155.74 153.26 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.685 -170.726 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -77.56 107.0 9.71 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 101.388 -3.56 . . . . 0.0 101.388 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.412 HD11 ' OH ' ' A' ' 47' ' ' TYR . 76.8 mt -51.14 -10.24 0.07 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 120.161 3.393 . . . . 0.0 120.161 -175.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -53.75 -31.9 50.23 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.644 0.656 . . . . 0.0 112.221 162.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.76 -52.74 62.99 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 176.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.15 -43.23 81.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 172.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.05 -51.09 71.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 113.119 -1.855 . . . . 0.0 111.876 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -39.5 91.24 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.219 2.207 . . . . 0.0 114.146 174.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -65.79 -34.05 77.28 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.141 0.977 . . . . 0.0 110.909 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.39 -13.63 37.31 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.829 1.251 . . . . 0.0 111.332 177.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.9 23.12 64.67 Favored Glycine 0 N--CA 1.491 2.32 0 C-N-CA 127.199 2.333 . . . . 0.0 113.387 172.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.49 124.28 71.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.514 1.126 . . . . 0.0 111.331 -168.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.2 p -32.2 129.63 0.18 Allowed 'General case' 0 N--CA 1.526 3.336 0 C-N-CA 125.347 1.459 . . . . 0.0 109.631 175.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -45.26 -34.57 2.93 Favored 'General case' 0 N--CA 1.521 3.098 0 N-CA-C 118.318 2.711 . . . . 0.0 118.318 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.675 ' H ' ' NE2' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -50.58 -30.2 12.66 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.436 ' O ' HG23 ' A' ' 23' ' ' VAL . 13.9 p -66.77 -56.67 9.43 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 168.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.661 ' O ' HG23 ' A' ' 24' ' ' VAL . 78.5 t -57.47 -53.48 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 C-N-CA 123.901 0.88 . . . . 0.0 110.237 -164.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 2.0 m -60.93 -35.04 75.68 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -177.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -64.51 -47.33 79.3 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 19' ' ' THR . 93.0 t -59.56 -40.9 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.207 1.403 . . . . 0.0 108.851 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 20' ' ' VAL . 91.9 t -51.14 -46.18 31.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 O-C-N 125.461 1.726 . . . . 0.0 111.492 -171.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.303 20.3 m120 -107.42 32.4 4.69 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 173.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 64.52 0.34 1.08 Allowed 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 130.089 3.355 . . . . 0.0 118.95 175.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.59 35.25 0.18 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 113.064 -1.88 . . . . 0.0 114.698 -173.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.9 p 62.52 -44.95 0.18 Allowed 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -158.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.298 69.1 m80 -165.51 116.75 1.09 Allowed 'General case' 0 CA--C 1.561 1.395 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 -168.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.561 HG12 ' NH1' ' A' ' 35' ' ' ARG . 1.0 OUTLIER -136.4 162.67 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 159.584 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 p -45.94 135.61 7.13 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -176.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.67 -61.1 2.3 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -171.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.3 pptp? -39.69 -37.47 0.52 Allowed 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 117.82 2.526 . . . . 0.0 117.82 176.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.6 m -61.41 -50.03 74.5 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.447 1.499 . . . . 0.0 108.866 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.561 ' NH1' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.82 -43.84 97.7 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 178.486 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.99 -35.46 76.88 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -80.18 -46.04 17.04 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 112.657 -2.065 . . . . 0.0 112.243 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 HG21 ' A' ' 23' ' ' VAL . 79.7 t -59.91 -49.93 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.527 1.131 . . . . 0.0 108.953 173.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -56.35 -41.54 76.27 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.816 2.046 . . . . 0.0 114.91 -178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.93 -53.28 52.72 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 111.679 -2.51 . . . . 0.0 110.469 175.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.55 -40.45 78.9 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 113.298 -1.773 . . . . 0.0 113.476 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.0 mtt -59.44 -48.55 81.2 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -176.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.88 -41.05 95.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 112.175 -2.284 . . . . 0.0 112.996 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -65.6 -37.18 85.89 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.292 -1.776 . . . . 0.0 113.286 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.9 mt -90.81 14.33 13.89 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.538 2.335 . . . . 0.0 112.878 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.275 3.7 p-10 53.92 19.05 1.82 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 120.029 3.344 . . . . 0.0 120.029 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.412 ' OH ' HD11 ' A' ' 6' ' ' LEU . 42.4 t80 -87.45 91.82 8.87 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 112.243 -2.253 . . . . 0.0 110.887 -169.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -22.2 118.85 0.15 Allowed Pre-proline 0 N--CA 1.51 2.557 0 CA-C-N 114.855 -1.066 . . . . 0.0 111.236 153.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -52.96 36.48 0.02 OUTLIER 'Trans proline' 0 CA--C 1.54 0.789 1 N-CA-C 123.582 4.416 . . . . 0.0 123.582 173.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -178.53 123.75 0.1 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.124 1.37 . . . . 0.0 110.804 169.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.27 0.0 OUTLIER -76.25 35.85 0.14 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 120.386 3.476 . . . . 0.0 120.386 -176.141 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 13.8 m -116.58 53.81 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 CA-C-N 113.702 -1.59 . . . . 0.0 111.412 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -137.43 -11.85 1.61 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -171.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 44.42 -91.4 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 CA-C-O 117.1 -1.428 . . . . 0.0 113.537 -163.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.441 ' OE1' ' HA ' ' A' ' 3' ' ' PRO 0.624 1.8 mp0 -108.47 69.72 0.73 Allowed 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 116.653 2.094 . . . . 0.0 116.653 -172.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 N--CA 1.491 1.622 1 CA-C-N 101.822 -6.99 . . . . 0.0 117.098 -177.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 116.317 1.969 . . . . 0.0 116.317 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.412 ' HA ' ' NH2' ' A' ' 51' ' ' ARG 0.284 0.0 OUTLIER -147.64 155.31 45.15 Favored Pre-proline 0 CA--C 1.55 0.963 0 N-CA-C 117.36 2.356 . . . . 0.0 117.36 -178.7 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.494 ' HD2' HH12 ' A' ' 51' ' ' ARG . 48.0 Cg_exo -68.87 -50.7 0.54 Allowed 'Trans proline' 0 N--CA 1.486 1.033 0 CA-C-N 121.469 1.56 . . . . 0.0 111.744 161.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.378 1.2 t -156.51 146.99 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 CA-C-O 122.134 0.969 . . . . 0.0 108.606 -177.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.417 1.2 m -51.85 109.17 0.34 Allowed 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 131.014 3.725 . . . . 0.0 107.701 175.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -48.71 -24.46 1.39 Allowed 'General case' 0 N--CA 1.513 2.71 0 N-CA-C 117.726 2.491 . . . . 0.0 117.726 171.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . 0.262 54.0 m-85 -61.62 -31.57 71.66 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 168.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.66 -46.56 87.64 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 118.154 -0.927 . . . . 0.0 110.464 173.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.402 ' HA ' HD13 ' A' ' 45' ' ' LEU . 60.9 t -56.94 -42.74 79.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 174.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.59 -54.9 39.85 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.809 1.644 . . . . 0.0 112.709 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.34 -36.61 84.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.157 1.783 . . . . 0.0 113.387 177.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -64.93 -37.38 87.45 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.873 0.844 . . . . 0.0 109.859 177.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.66 -10.86 50.09 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.604 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.54 24.19 73.39 Favored Glycine 0 N--CA 1.487 2.061 0 C-N-CA 127.528 2.49 . . . . 0.0 113.431 172.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -125.98 122.49 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.026 0.93 . . . . 0.0 111.879 -167.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.7 p -29.41 121.42 0.15 Allowed 'General case' 0 N--CA 1.524 3.249 0 C-N-CA 127.929 2.491 . . . . 0.0 107.95 171.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -49.85 -27.47 5.14 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 -173.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.8 tp60 -46.1 -40.51 11.0 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 124.94 1.4 . . . . 0.0 112.133 174.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 23' ' ' VAL . 10.4 p -61.07 -55.24 34.92 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 173.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.689 ' O ' HG23 ' A' ' 24' ' ' VAL 0.255 74.2 t -59.96 -46.65 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 124.617 1.167 . . . . 0.0 109.648 -169.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.9 p -59.77 -45.87 90.93 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.5 mtp85 -57.5 -46.47 83.73 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.595 -2.093 . . . . 0.0 114.843 170.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.591 HG21 HG21 ' A' ' 38' ' ' VAL . 79.0 t -60.18 -44.94 96.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.724 1.209 . . . . 0.0 109.089 -176.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 20' ' ' VAL . 82.2 t -52.92 -46.17 52.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 O-C-N 126.213 2.196 . . . . 0.0 111.269 -169.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.251 16.6 m120 -106.57 27.68 8.58 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 65.7 9.08 5.66 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 118.518 2.785 . . . . 0.0 118.518 171.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 34.25 33.68 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 128.266 2.626 . . . . 0.0 116.423 -175.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 58.84 -42.75 0.07 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 -160.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -149.0 92.78 2.01 Favored 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.7 p -110.18 151.92 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 N-CA-C 117.223 2.305 . . . . 0.0 117.223 171.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -65.07 136.41 56.71 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 176.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.64 -43.38 96.96 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -175.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.792 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -49.85 -45.14 50.12 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 173.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.9 m -64.34 -47.47 79.25 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 112.658 -2.064 . . . . 0.0 108.386 177.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.8 OUTLIER -56.45 -42.46 78.2 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.126 1.37 . . . . 0.0 114.631 179.45 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -60.96 -39.83 91.01 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 113.394 -1.73 . . . . 0.0 113.733 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -72.99 -43.59 62.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.661 1.985 . . . . 0.0 111.031 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.591 HG21 HG21 ' A' ' 23' ' ' VAL . 60.8 t -66.08 -48.98 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.087 179.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.7 mt-10 -52.49 -45.07 66.03 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 130.913 3.685 . . . . 0.0 110.354 -178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.71 -51.14 66.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 111.834 -2.439 . . . . 0.0 111.172 176.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -46.15 87.16 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.339 -1.755 . . . . 0.0 113.306 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.41 -45.38 80.69 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 125.679 1.592 . . . . 0.0 112.972 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.57 -46.45 88.3 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 112.903 -1.953 . . . . 0.0 112.34 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -64.43 -38.49 91.2 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.034 -2.348 . . . . 0.0 112.837 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 9' ' ' VAL . 11.4 mt -87.32 11.92 13.2 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.939 2.496 . . . . 0.0 114.185 -178.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.41 0.2 OUTLIER 52.47 23.58 2.6 Favored 'General case' 0 CA--C 1.569 1.69 0 C-N-CA 128.196 2.598 . . . . 0.0 113.388 -176.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -96.56 87.63 4.44 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.386 -1.446 . . . . 0.0 110.52 -159.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -10.08 110.89 0.04 OUTLIER Pre-proline 0 N--CA 1.519 2.987 0 CA-C-N 113.178 -1.828 . . . . 0.0 113.509 153.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -63.48 50.71 0.14 Allowed 'Trans proline' 0 CA--C 1.542 0.878 0 N-CA-C 119.764 2.948 . . . . 0.0 119.764 175.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -179.75 148.02 0.31 Allowed 'General case' 0 CA--C 1.564 1.491 0 C-N-CA 127.368 2.267 . . . . 0.0 111.321 163.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.494 HH12 ' HD2' ' A' ' 3' ' ' PRO 0.261 0.0 OUTLIER -68.77 95.66 0.69 Allowed 'General case' 0 N--CA 1.487 1.375 0 CA-C-N 119.588 1.085 . . . . 0.0 113.795 175.201 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.6 m -83.98 54.96 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 CA-C-O 122.547 1.165 . . . . 0.0 111.235 -177.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.15 148.31 51.99 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 114.064 -1.425 . . . . 0.0 110.55 176.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 51.99 76.8 0.16 Allowed 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 123.343 1.544 . . . . 0.0 113.185 -175.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.465 ' H ' ' CD ' ' A' ' 55' ' ' GLN . 0.5 OUTLIER -81.24 31.03 0.33 Allowed 'General case' 0 N--CA 1.49 1.563 0 CA-C-N 109.413 -3.54 . . . . 0.0 113.567 178.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.5 mt . . . . . 0 N--CA 1.481 1.121 0 CA-C-N 113.14 -1.845 . . . . 0.0 113.939 -175.295 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 116.629 2.085 . . . . 0.0 116.629 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.447 ' HD3' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -161.29 146.07 10.35 Favored Pre-proline 0 CA--C 1.581 2.151 0 CA-C-O 115.745 -2.074 . . . . 0.0 114.171 -163.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -70.49 -2.2 10.32 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 N-CA-C 121.239 3.515 . . . . 0.0 121.239 -171.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.447 ' O ' ' HD3' ' A' ' 2' ' ' LYS 0.414 0.5 OUTLIER -156.11 147.33 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 102.902 -2.999 . . . . 0.0 102.902 179.527 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.308 4.2 p -70.39 97.6 1.29 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -177.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.4 mt -41.49 -14.27 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 -175.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.463 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 49.3 m-85 -53.74 -33.3 55.28 Favored 'General case' 0 CA--C 1.561 1.368 0 O-C-N 123.514 0.508 . . . . 0.0 110.913 165.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -59.07 -52.4 65.89 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 118.474 -0.774 . . . . 0.0 113.024 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 66.5 t -57.99 -45.04 88.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.506 0.722 . . . . 0.0 112.855 174.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.93 -49.18 78.81 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 113.444 -1.707 . . . . 0.0 112.016 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.463 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.4 OUTLIER -67.82 -43.61 79.2 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.139 1.776 . . . . 0.0 115.198 176.864 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -32.38 74.03 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.792 0.837 . . . . 0.0 111.311 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.7 -17.39 26.84 Favored 'General case' 0 CA--C 1.562 1.408 0 CA-C-N 114.427 -1.26 . . . . 0.0 111.062 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.03 23.42 69.03 Favored Glycine 0 N--CA 1.49 2.264 0 C-N-CA 125.721 1.629 . . . . 0.0 113.524 173.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.449 HG22 HG21 ' A' ' 19' ' ' THR 0.253 4.5 p -123.28 126.07 72.81 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.426 0 C-N-CA 124.627 1.171 . . . . 0.0 107.929 -170.119 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.451 ' O ' ' HB ' ' A' ' 19' ' ' THR . 83.2 p -33.24 139.48 0.05 Allowed 'General case' 0 N--CA 1.528 3.432 0 C-N-CA 126.21 1.804 . . . . 0.0 111.269 -177.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.365 55.2 t80 -40.45 -65.87 0.37 Allowed 'General case' 0 N--CA 1.519 3.019 0 N-CA-C 115.092 1.515 . . . . 0.0 115.092 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.551 HE21 ' CZ ' ' A' ' 22' ' ' ARG 0.401 0.0 OUTLIER -58.0 -23.47 54.18 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 121.785 3.994 . . . . 0.0 121.785 -177.39 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.516 ' O ' HG23 ' A' ' 23' ' ' VAL . 83.4 m -53.64 -48.43 69.38 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.595 163.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.584 ' O ' HG23 ' A' ' 24' ' ' VAL . 98.9 t -65.57 -51.31 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.199 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.253 1.3 m -57.26 -36.03 70.47 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 -178.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.551 ' CZ ' HE21 ' A' ' 18' ' ' GLN . 10.8 mtt85 -59.21 -49.24 78.6 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 116.406 2.002 . . . . 0.0 116.406 166.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 38' ' ' VAL . 77.3 t -59.41 -41.0 83.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.454 -176.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 20' ' ' VAL . 92.1 t -54.68 -50.23 61.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.319 0 CA-C-N 112.974 -1.921 . . . . 0.0 112.409 -167.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.398 3.9 m120 -100.6 29.74 4.31 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 170.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.81 14.65 7.53 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 129.16 2.984 . . . . 0.0 118.445 169.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.04 47.46 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 111.036 -2.802 . . . . 0.0 115.413 -173.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.254 91.5 p 57.32 -59.86 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 126.288 1.835 . . . . 0.0 115.214 -161.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -141.16 94.6 2.72 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -177.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.28 150.68 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.3 p -60.89 142.06 56.63 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -38.58 -79.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.125 2.17 . . . . 0.0 115.682 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.93 -34.37 55.06 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 38' ' ' VAL . 47.8 m -61.74 -49.28 77.04 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.618 178.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.415 ' HB3' ' OE1' ' A' ' 39' ' ' GLU . 12.2 mtm105 -58.39 -53.37 59.02 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 115.305 1.594 . . . . 0.0 115.305 173.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -50.85 -38.57 49.89 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -76.82 -47.88 20.13 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 111.242 -2.708 . . . . 0.0 113.127 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 23' ' ' VAL . 43.2 t -61.18 -48.54 88.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.377 176.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.415 ' OE1' ' HB3' ' A' ' 35' ' ' ARG . 47.0 mt-10 -57.46 -45.83 84.32 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 128.161 2.584 . . . . 0.0 114.973 -178.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.12 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 112.855 -1.975 . . . . 0.0 110.665 176.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.42 -36.94 74.38 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 112.763 -2.017 . . . . 0.0 115.081 174.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 20.5 mtt -60.65 -53.33 58.72 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -171.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.06 -40.31 97.31 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 113.499 -1.682 . . . . 0.0 113.311 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.63 -39.29 93.44 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.264 -2.244 . . . . 0.0 113.693 -176.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 90.2 mt -94.3 25.3 3.91 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.933 1.693 . . . . 0.0 112.682 -176.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 59.54 21.57 10.12 Favored 'General case' 0 CA--C 1.57 1.741 0 C-N-CA 125.473 1.509 . . . . 0.0 114.32 174.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -93.19 166.57 12.26 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.956 0.902 . . . . 0.0 110.009 -175.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -145.56 124.78 6.77 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.702 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER -38.66 177.7 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 124.606 3.538 . . . . 0.0 117.85 178.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.747 ' ND2' HE22 ' A' ' 54' ' ' GLN . 0.5 OUTLIER 58.91 -46.2 0.06 Allowed 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 130.037 3.335 . . . . 0.0 116.63 -165.11 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.834 HH21 ' HG3' ' A' ' 55' ' ' GLN 0.285 22.2 mtp85 -45.6 73.56 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 119.072 2.99 . . . . 0.0 119.072 -170.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.0 m -124.6 40.11 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-N 111.633 -2.53 . . . . 0.0 112.851 154.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -176.42 -146.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 112.82 -1.991 . . . . 0.0 109.596 -162.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.747 HE22 ' ND2' ' A' ' 50' ' ' ASN . 1.1 mp0 57.74 -76.94 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.169 2.188 . . . . 0.0 116.257 177.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.834 ' HG3' HH21 ' A' ' 51' ' ' ARG 0.265 0.0 OUTLIER -97.7 72.77 2.31 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 124.468 2.08 . . . . 0.0 110.494 171.027 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.1 mt . . . . . 0 N--CA 1.479 0.986 0 CA-C-N 111.536 -2.574 . . . . 0.0 114.868 -162.895 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.7 mtm . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 116.785 2.142 . . . . 0.0 116.785 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.66 ' HG3' ' HE1' ' A' ' 47' ' ' TYR . 44.5 tttt -21.63 98.22 0.06 OUTLIER Pre-proline 0 CA--C 1.573 1.849 0 C-N-CA 127.184 2.194 . . . . 0.0 112.997 -165.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -97.69 29.53 0.16 Allowed 'Trans proline' 0 CA--C 1.54 0.782 0 N-CA-C 119.776 2.952 . . . . 0.0 119.776 -148.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.457 1.1 t 173.11 150.99 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 C-N-CA 129.564 3.146 . . . . 0.0 103.374 -166.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.8 p -101.99 145.44 29.28 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 117.57 -1.652 . . . . 0.0 108.944 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.475 ' HG ' ' HE3' ' A' ' 2' ' ' LYS . 10.3 mt -57.24 -9.58 1.01 Allowed 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 121.455 3.872 . . . . 0.0 121.455 -165.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -58.82 -37.56 76.67 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.926 0.784 . . . . 0.0 111.514 170.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.434 ' OD2' HD22 ' A' ' 45' ' ' LEU . 54.1 t0 -62.31 -48.43 79.9 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 118.062 -0.971 . . . . 0.0 111.603 176.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.21 -40.89 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 N-CA-C 112.235 0.458 . . . . 0.0 112.235 176.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.47 -55.26 36.9 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 125.827 1.651 . . . . 0.0 114.716 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -41.68 94.36 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 127.153 2.181 . . . . 0.0 113.841 178.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CB ' HD11 ' A' ' 45' ' ' LEU . 35.7 t80 -65.91 -31.47 72.43 Favored 'General case' 0 CA--C 1.551 0.981 0 O-C-N 124.411 1.07 . . . . 0.0 110.592 -179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.84 -16.86 22.59 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.111 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.94 23.2 59.92 Favored Glycine 0 CA--C 1.547 2.04 0 C-N-CA 126.496 1.998 . . . . 0.0 113.459 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.272 9.9 p -128.54 129.0 68.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 -167.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.8 p -35.44 146.86 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 128.283 2.633 . . . . 0.0 112.181 -172.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -59.37 -32.8 70.46 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 119.192 -2.192 . . . . 0.0 114.648 173.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.271 27.2 tp60 -55.28 -38.93 69.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 117.473 -1.251 . . . . 0.0 113.01 171.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.459 ' O ' HG23 ' A' ' 23' ' ' VAL . 20.3 m -59.9 -53.39 58.49 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.469 0.708 . . . . 0.0 110.917 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.591 ' O ' HG23 ' A' ' 24' ' ' VAL 0.377 62.7 t -65.52 -43.11 94.41 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.826 -171.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.9 p -58.31 -48.1 81.6 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.452 HH11 ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -55.07 -53.6 53.82 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 110.932 -2.849 . . . . 0.0 113.491 170.597 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.763 HG11 HG21 ' A' ' 38' ' ' VAL . 76.4 t -62.24 -44.81 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.991 -174.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 20' ' ' VAL . 41.9 t -64.28 -41.64 93.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 CA-C-N 113.771 -1.558 . . . . 0.0 111.23 -168.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -77.22 5.07 9.1 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 113.787 -1.551 . . . . 0.0 113.832 169.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.512 ' OE1' ' HD2' ' A' ' 35' ' ' ARG . 14.9 mm100 69.97 3.68 4.45 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.895 2.478 . . . . 0.0 114.653 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.61 42.35 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 128.745 2.818 . . . . 0.0 116.898 -173.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.259 84.8 p 65.41 -62.19 0.23 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.584 1.954 . . . . 0.0 112.266 -164.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.8 m170 -138.2 137.57 37.7 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 124.2 0.938 . . . . 0.0 109.357 172.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.42 ' CG1' ' HD3' ' A' ' 35' ' ' ARG 0.253 1.4 p -138.21 153.84 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 120.278 1.399 . . . . 0.0 113.671 175.381 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -55.66 126.41 25.31 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.01 -60.88 1.27 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.1 -31.82 69.26 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.7 m -60.5 -48.17 82.92 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.145 1.378 . . . . 0.0 107.506 176.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.512 ' HD2' ' OE1' ' A' ' 26' ' ' GLN . 2.8 mtp85 -61.14 -44.66 96.98 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 116.773 2.138 . . . . 0.0 116.773 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.61 -34.36 71.04 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.864 178.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -80.28 -43.52 21.17 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 113.04 -1.891 . . . . 0.0 113.534 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.763 HG21 HG11 ' A' ' 23' ' ' VAL . 64.1 t -60.82 -48.28 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.549 1.54 . . . . 0.0 107.778 173.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.57 -40.76 88.4 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.916 2.086 . . . . 0.0 112.623 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.29 -49.66 70.94 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 113.783 -1.553 . . . . 0.0 111.137 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.01 -40.85 77.43 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 112.055 -2.339 . . . . 0.0 113.432 169.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 28.6 ttm -61.78 -46.24 90.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.632 1.573 . . . . 0.0 112.189 -172.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.44 -48.55 79.17 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.016 -1.447 . . . . 0.0 111.097 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.98 -39.15 93.83 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 113.19 -1.823 . . . . 0.0 113.561 -177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.444 HD11 ' CB ' ' A' ' 12' ' ' TYR . 61.6 mt -92.03 22.79 4.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -176.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.6 p30 57.03 19.35 4.6 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 117.624 2.453 . . . . 0.0 117.624 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.66 ' HE1' ' HG3' ' A' ' 2' ' ' LYS . 41.5 t80 -85.12 100.11 11.5 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.136 -1.393 . . . . 0.0 112.325 -163.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -31.21 112.3 0.32 Allowed Pre-proline 0 N--CA 1.491 1.594 0 CA-C-O 116.41 -1.757 . . . . 0.0 113.024 160.282 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 48' ' ' ILE 0.259 44.3 Cg_exo -57.86 32.39 0.04 OUTLIER 'Trans proline' 0 N--CA 1.487 1.112 1 N-CA-C 124.801 4.885 . . . . 0.0 124.801 -166.884 . . . . . . . . 4 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 177.9 104.97 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 175.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 9.61 88.32 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 115.702 1.742 . . . . 0.0 115.702 144.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.478 HG23 ' H ' ' A' ' 2' ' ' LYS . 1.5 m -119.99 -169.85 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 113.703 -1.59 . . . . 0.0 109.545 174.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -36.58 134.62 0.46 Allowed 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.475 -0.765 . . . . 0.0 111.694 164.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -113.45 158.52 20.57 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.659 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.601 ' H ' ' NE2' ' A' ' 55' ' ' GLN . 0.5 OUTLIER -40.19 98.29 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.336 0 CA-C-N 113.031 -1.895 . . . . 0.0 108.806 149.251 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 73.1 mt . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -173.731 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 ttp . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 115.549 1.685 . . . . 0.0 115.549 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -131.56 -174.24 0.38 Allowed Pre-proline 0 CA--C 1.556 1.186 0 CA-C-O 114.735 -2.555 . . . . 0.0 110.234 -175.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -52.81 -38.09 77.49 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 CA-C-N 124.92 2.793 . . . . 0.0 114.983 177.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.481 1.1 t -165.21 129.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 100.523 -3.88 . . . . 0.0 100.523 173.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.7 p -81.31 139.05 35.62 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.895 -1.128 . . . . 0.0 108.491 -162.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.471 HD21 ' CE2' ' A' ' 47' ' ' TYR . 53.8 mt -62.09 -6.2 2.8 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 120.909 3.67 . . . . 0.0 120.909 -155.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.257 70.4 m-85 -57.69 -37.91 74.26 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.319 1.418 . . . . 0.0 111.611 173.357 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.497 ' OD2' HD22 ' A' ' 45' ' ' LEU . 11.1 t70 -55.94 -53.29 58.58 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 171.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.1 t -59.95 -44.32 94.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.129 0.572 . . . . 0.0 111.818 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.67 -49.07 77.7 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.058 1.343 . . . . 0.0 112.818 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.481 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.9 OUTLIER -69.42 -41.71 76.01 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.91 2.084 . . . . 0.0 114.185 178.095 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -63.96 -35.11 79.61 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.539 1.136 . . . . 0.0 110.003 177.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.81 -19.77 24.28 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.298 1.439 . . . . 0.0 111.528 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.72 28.21 61.53 Favored Glycine 0 N--CA 1.488 2.153 0 C-N-CA 125.721 1.629 . . . . 0.0 112.772 174.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.522 HG22 HG21 ' A' ' 19' ' ' THR 0.27 5.1 p -132.31 123.4 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.191 0 C-N-CA 124.82 1.248 . . . . 0.0 107.707 -170.531 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.7 p -32.46 145.09 0.02 OUTLIER 'General case' 0 N--CA 1.528 3.431 0 C-N-CA 128.005 2.522 . . . . 0.0 111.803 -171.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -57.89 -35.92 71.68 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 119.067 -2.27 . . . . 0.0 115.313 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -57.32 -40.23 77.46 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 118.772 -0.632 . . . . 0.0 112.187 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.558 ' O ' HG23 ' A' ' 23' ' ' VAL . 57.4 m -55.24 -50.2 70.06 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.685 0.794 . . . . 0.0 110.122 173.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.492 ' O ' HG23 ' A' ' 24' ' ' VAL 0.332 74.2 t -66.54 -42.39 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.174 0.59 . . . . 0.0 112.459 -174.611 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.6 p -63.28 -47.38 82.59 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.406 ' NH2' ' HB1' ' A' ' 27' ' ' ALA . 15.4 mtp85 -51.61 -47.19 63.72 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.395 -2.184 . . . . 0.0 112.996 168.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.577 HG21 HG21 ' A' ' 38' ' ' VAL . 78.6 t -60.18 -48.41 88.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-O 122.035 0.921 . . . . 0.0 110.076 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.603 HG11 ' HG3' ' A' ' 51' ' ' ARG . 61.9 t -59.76 -47.98 89.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 112.859 -1.973 . . . . 0.0 111.222 -172.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -84.99 23.13 1.26 Allowed 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.914 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.271 0.0 OUTLIER 59.22 7.79 0.96 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 128.382 2.673 . . . . 0.0 116.249 174.047 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.406 ' HB1' ' NH2' ' A' ' 22' ' ' ARG . . . 29.47 36.25 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 128.548 2.739 . . . . 0.0 116.075 -167.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p 59.33 -46.88 0.07 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 126.639 1.975 . . . . 0.0 115.759 -162.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -144.1 95.57 2.75 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 106.234 -1.765 . . . . 0.0 106.234 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.4 p -111.93 150.62 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.1 p -65.77 142.22 58.05 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.25 -69.47 0.11 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -49.62 -36.65 25.1 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 117.779 2.511 . . . . 0.0 117.779 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.2 m -58.82 -52.27 66.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.603 -1.635 . . . . 0.0 108.333 173.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.0 mtm105 -56.6 -47.52 79.42 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 175.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.09 -34.38 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -178.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -74.73 -42.95 57.34 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 112.542 -2.117 . . . . 0.0 112.02 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.577 HG21 HG21 ' A' ' 23' ' ' VAL . 60.4 t -64.62 -48.9 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 112.897 -1.956 . . . . 0.0 109.56 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -57.32 -47.15 82.28 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.655 2.782 . . . . 0.0 112.368 -178.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.34 -48.3 80.43 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 112.749 -2.023 . . . . 0.0 110.892 177.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.26 -43.63 88.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 112.527 -2.124 . . . . 0.0 114.703 175.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 26.9 mtt -59.28 -46.31 88.87 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 -175.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.21 -44.35 95.55 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.881 -1.509 . . . . 0.0 112.437 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -61.54 -34.52 75.68 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.107 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.497 HD22 ' OD2' ' A' ' 8' ' ' ASP . 54.5 mt -99.79 13.08 34.94 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.625 2.37 . . . . 0.0 115.269 -177.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.378 0.2 OUTLIER 54.74 18.41 2.1 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 126.778 2.031 . . . . 0.0 115.763 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.471 ' CE2' HD21 ' A' ' 6' ' ' LEU . 61.4 t80 -83.83 102.29 12.24 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.428 -1.42 . . . . 0.0 108.467 -171.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.78 HD12 HD21 ' A' ' 50' ' ' ASN . 0.3 OUTLIER -42.75 125.82 3.1 Favored Pre-proline 0 N--CA 1.5 2.048 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.459 168.136 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -54.81 56.17 0.03 OUTLIER 'Trans proline' 0 CA--C 1.552 1.376 0 C-N-CA 124.581 3.521 . . . . 0.0 119.001 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.78 HD21 HD12 ' A' ' 48' ' ' ILE . 0.1 OUTLIER 177.34 148.61 0.14 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 128.259 2.623 . . . . 0.0 115.807 169.664 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.603 ' HG3' HG11 ' A' ' 24' ' ' VAL . 1.1 mtm105 -78.91 92.35 4.9 Favored 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 175.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 56' ' ' LEU . 5.5 m -76.33 66.35 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 176.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -41.12 -57.21 2.13 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 119.188 3.033 . . . . 0.0 119.188 -159.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -85.1 58.01 4.78 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 121.861 0.838 . . . . 0.0 112.476 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 52.02 33.8 12.62 Favored 'General case' 0 N--CA 1.518 2.927 0 CA-C-N 113.768 -1.56 . . . . 0.0 111.147 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 52' ' ' VAL . 29.5 mt . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -158.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.552 ' HA ' HE22 ' A' ' 55' ' ' GLN . 75.7 mtm . . . . . 0 N--CA 1.483 1.204 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HE2' HG22 ' A' ' 5' ' ' THR . 3.9 mppt? 65.04 166.98 0.11 Allowed Pre-proline 0 CA--C 1.567 1.629 0 CA-C-N 113.792 -1.549 . . . . 0.0 112.996 -177.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -79.83 -19.57 9.65 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 N-CA-C 116.458 1.676 . . . . 0.0 116.458 163.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.47 0.5 OUTLIER -160.4 138.77 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 103.225 -2.88 . . . . 0.0 103.225 178.462 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.487 HG22 ' HE2' ' A' ' 2' ' ' LYS . 14.4 p -87.38 142.25 28.02 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.919 -168.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mt -58.94 -12.04 4.07 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 121.511 3.893 . . . . 0.0 121.511 -158.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -60.64 -34.14 73.83 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.557 0.617 . . . . 0.0 110.544 173.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.423 ' OD1' HD22 ' A' ' 45' ' ' LEU . 4.9 t70 -59.4 -50.55 73.51 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 170.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.49 -42.59 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 174.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.93 51.69 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 112.934 -1.939 . . . . 0.0 112.992 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -39.53 93.24 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.57 1.948 . . . . 0.0 114.309 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.483 ' CB ' HD11 ' A' ' 45' ' ' LEU . 41.5 t80 -64.44 -36.12 83.13 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.184 0.994 . . . . 0.0 110.39 176.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.98 -13.94 37.73 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.645 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.75 25.42 69.74 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 127.753 2.597 . . . . 0.0 113.31 172.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.9 p -126.25 128.62 71.73 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 CA-C-O 121.08 0.467 . . . . 0.0 111.894 -167.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 75.8 p -28.74 124.25 0.12 Allowed 'General case' 0 N--CA 1.52 3.053 0 C-N-CA 128.639 2.775 . . . . 0.0 109.323 174.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -45.31 -39.38 6.57 Favored 'General case' 0 N--CA 1.529 3.476 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -170.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.344 0.0 OUTLIER -54.05 -34.7 60.74 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 118.734 2.864 . . . . 0.0 118.734 -178.912 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' HG23 ' A' ' 23' ' ' VAL . 69.4 p -59.06 -47.11 86.42 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.755 1.222 . . . . 0.0 112.044 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.611 ' O ' HG23 ' A' ' 24' ' ' VAL . 92.6 t -66.02 -54.31 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.546 1.139 . . . . 0.0 109.675 -177.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.511 20.1 m -64.11 -26.89 68.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 19' ' ' THR . 26.2 mtp85 -61.27 -48.43 81.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 110.542 -3.026 . . . . 0.0 115.273 163.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.604 HG21 HG21 ' A' ' 38' ' ' VAL . 54.2 t -57.65 -46.5 86.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.417 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 20' ' ' VAL . 85.9 t -55.4 -48.04 77.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.852 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -104.93 19.7 20.11 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.26 2.9 mp0 64.92 14.8 9.53 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 174.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.426 ' HB1' ' CZ ' ' A' ' 22' ' ' ARG . . . 44.36 6.28 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 110.524 -3.035 . . . . 0.0 119.066 175.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.2 t 65.04 -51.76 0.34 Allowed 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 124.224 1.01 . . . . 0.0 110.867 -155.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -130.1 101.94 6.03 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.159 175.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -108.7 134.61 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 176.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 47.0 p -72.43 133.95 45.14 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.9 -63.38 1.11 Allowed 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.375 0.0 OUTLIER -45.38 -33.38 2.52 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 117.492 2.404 . . . . 0.0 117.492 178.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 38' ' ' VAL . 28.8 m -62.56 -49.73 74.1 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 -176.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -56.64 -45.16 81.76 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.202 1.801 . . . . 0.0 112.884 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -60.44 -38.21 83.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 113.759 -1.564 . . . . 0.0 113.844 -175.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 ttpt -78.19 -44.96 24.35 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 126.93 2.092 . . . . 0.0 110.415 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.604 HG21 HG21 ' A' ' 23' ' ' VAL . 49.0 t -62.05 -45.71 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.647 1.579 . . . . 0.0 108.233 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.01 -43.12 69.82 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 129.228 3.011 . . . . 0.0 113.058 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.43 -50.02 71.43 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 111.548 -2.569 . . . . 0.0 110.96 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.92 -45.7 86.14 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 113.39 -1.732 . . . . 0.0 113.758 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.563 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -58.69 -47.53 84.22 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 127.069 2.148 . . . . 0.0 113.885 -177.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.33 85.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 113.145 -1.843 . . . . 0.0 111.527 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -66.54 -37.4 84.91 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 112.193 -2.276 . . . . 0.0 113.317 -178.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.483 HD11 ' CB ' ' A' ' 12' ' ' TYR . 57.5 mt -88.83 14.28 10.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 116.055 1.872 . . . . 0.0 116.055 178.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 53.48 28.54 7.76 Favored 'General case' 0 CA--C 1.57 1.725 0 C-N-CA 126.602 1.961 . . . . 0.0 113.62 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.563 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 27.7 t80 -89.51 169.27 11.5 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.543 -168.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.384 0.0 OUTLIER -126.46 100.23 29.28 Favored Pre-proline 0 N--CA 1.476 0.828 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.469 ' O ' HG13 ' A' ' 24' ' ' VAL 0.389 0.0 OUTLIER -4.2 -83.59 0.0 OUTLIER 'Trans proline' 0 N--CA 1.485 1.027 1 C-N-CA 126.829 5.019 . . . . 0.0 121.016 -175.277 . . . . . . . . 5 4 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -86.25 42.59 1.0 Allowed 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 -167.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.632 HH11 ' HB3' ' A' ' 53' ' ' ALA . 47.1 ptt85 46.29 109.36 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 127.46 2.304 . . . . 0.0 116.669 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.5 m -83.84 71.0 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 119.703 -1.873 . . . . 0.0 106.781 169.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.632 ' HB3' HH11 ' A' ' 51' ' ' ARG . . . -119.67 25.85 9.74 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 113.498 -1.683 . . . . 0.0 114.606 -174.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.498 HE21 ' CZ ' ' A' ' 51' ' ' ARG . 17.2 mp0 -111.25 25.45 11.72 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 122.215 1.007 . . . . 0.0 112.31 -175.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.552 HE22 ' HA ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -140.25 61.75 1.52 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 124.345 2.021 . . . . 0.0 110.444 -176.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 56' ' ' LEU . 5.7 mp . . . . . 0 N--CA 1.486 1.37 0 CA-C-N 111.21 -2.723 . . . . 0.0 114.273 -172.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.304 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 116.833 2.16 . . . . 0.0 116.833 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 5' ' ' THR . 0.0 OUTLIER -171.91 152.35 2.96 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-O 115.662 -2.113 . . . . 0.0 116.379 179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.651 ' HD3' ' HG3' ' A' ' 51' ' ' ARG . 84.7 Cg_exo -56.91 -22.55 46.62 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 C-N-CA 123.376 2.718 . . . . 0.0 118.65 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.408 ' O ' ' HG2' ' A' ' 2' ' ' LYS 0.429 0.5 OUTLIER -150.5 143.76 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 104.886 -2.265 . . . . 0.0 104.886 177.847 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.499 ' HA ' ' HE2' ' A' ' 2' ' ' LYS 0.274 1.1 p -66.96 97.08 0.46 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 -178.65 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.423 ' HG ' ' HG3' ' A' ' 2' ' ' LYS . 21.4 mt -36.35 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.623 0 N-CA-C 118.882 2.919 . . . . 0.0 118.882 -176.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.419 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 51.7 m-85 -54.94 -33.46 62.27 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.574 1.079 . . . . 0.0 110.863 167.206 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -56.44 -52.79 63.36 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.939 172.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.53 -44.89 90.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 118.652 0.66 . . . . 0.0 112.003 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.11 -50.03 74.9 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.37 -178.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.419 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.7 OUTLIER -67.76 -43.23 80.34 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.339 1.856 . . . . 0.0 115.497 174.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -65.47 -34.63 78.73 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.468 1.107 . . . . 0.0 111.131 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -17.95 25.36 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.801 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.46 26.02 68.9 Favored Glycine 0 N--CA 1.485 1.935 0 C-N-CA 125.822 1.677 . . . . 0.0 113.038 174.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.577 HG22 HG21 ' A' ' 19' ' ' THR . 5.4 p -129.64 108.38 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.189 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -169.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.8 p -17.27 145.93 0.0 OUTLIER 'General case' 0 N--CA 1.527 3.404 0 C-N-CA 127.051 2.14 . . . . 0.0 114.516 -174.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -52.32 -46.67 66.1 Favored 'General case' 0 N--CA 1.52 3.042 0 O-C-N 119.758 -1.839 . . . . 0.0 114.129 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -51.54 -41.94 61.43 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.435 1.084 . . . . 0.0 112.516 177.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.577 HG21 HG22 ' A' ' 15' ' ' VAL . 52.2 m -57.33 -50.7 72.1 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.296 1.039 . . . . 0.0 111.998 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 24' ' ' VAL . 88.5 t -65.16 -51.0 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.044 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m -58.02 -32.79 68.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.385 1.074 . . . . 0.0 112.645 -177.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.9 mtp85 -65.28 -49.44 69.54 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 168.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.541 HG21 HG21 ' A' ' 38' ' ' VAL . 58.3 t -62.08 -38.11 80.05 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 114.163 -1.38 . . . . 0.0 108.707 -178.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 20' ' ' VAL . 51.3 t -48.65 -54.33 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.578 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -87.37 16.15 5.67 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.175 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.678 ' HA ' HH12 ' A' ' 35' ' ' ARG 0.375 0.2 OUTLIER 69.19 -1.42 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 130.212 3.405 . . . . 0.0 118.494 177.758 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 5.83 51.32 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 109.738 -3.392 . . . . 0.0 118.086 -164.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t 63.58 -57.29 0.19 Allowed 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 110.95 -2.841 . . . . 0.0 115.427 -174.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -130.59 21.64 5.1 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 116.913 2.19 . . . . 0.0 116.913 -163.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.321 93.6 t -74.06 111.68 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 N-CA-C 119.509 3.152 . . . . 0.0 119.509 -160.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 m -13.16 132.34 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.27 -2.241 . . . . 0.0 116.074 -174.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.64 -55.43 11.29 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -172.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.16 -49.48 42.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 117.936 2.569 . . . . 0.0 117.936 173.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 38' ' ' VAL . 61.6 m -55.96 -49.53 73.3 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.254 1.021 . . . . 0.0 108.609 176.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.678 HH12 ' HA ' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -58.42 -47.68 83.15 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 115.694 1.739 . . . . 0.0 115.694 176.663 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.05 79.83 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -79.65 -42.21 25.29 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 112.662 -2.063 . . . . 0.0 112.534 -177.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.541 HG21 HG21 ' A' ' 23' ' ' VAL . 59.9 t -60.84 -50.81 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 174.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -55.9 -44.24 78.01 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.631 2.773 . . . . 0.0 112.738 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.8 -51.27 65.54 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.673 -2.058 . . . . 0.0 110.83 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.46 84.37 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 112.935 -1.939 . . . . 0.0 113.356 175.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.406 ' HG3' HG12 ' A' ' 38' ' ' VAL . 4.9 mtt -59.17 -49.32 78.3 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -174.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.67 -41.87 98.12 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 111.865 -2.425 . . . . 0.0 113.131 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.12 -38.15 87.48 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 112.525 -2.125 . . . . 0.0 114.022 -176.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.2 mt -94.91 21.82 7.17 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 126.717 2.007 . . . . 0.0 113.314 -174.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.59 25.98 13.86 Favored 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.473 ' HE1' ' HB2' ' A' ' 2' ' ' LYS . 44.1 t80 -98.48 166.45 11.35 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 114.075 -1.42 . . . . 0.0 108.311 -171.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.22 119.63 10.44 Favored Pre-proline 0 CA--C 1.55 0.952 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.995 -174.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -41.46 138.85 2.07 Favored 'Trans proline' 0 CA--C 1.554 1.514 0 C-N-CA 124.43 3.42 . . . . 0.0 113.932 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.439 ' HA ' HG13 ' A' ' 24' ' ' VAL . 0.1 OUTLIER 41.11 66.31 0.68 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -165.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.651 ' HG3' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -119.98 81.42 1.73 Allowed 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 169.632 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.524 HG13 HG11 ' A' ' 24' ' ' VAL . 1.1 m -106.16 176.4 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.545 170.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.72 82.25 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 123.209 1.481 . . . . 0.0 113.777 175.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.439 ' HB2' ' NH2' ' A' ' 51' ' ' ARG . 37.8 mt-30 -125.82 14.36 8.01 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 113.535 -1.666 . . . . 0.0 112.464 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -90.08 64.97 6.36 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 124.42 2.057 . . . . 0.0 111.544 -178.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 8.7 mp . . . . . 0 N--CA 1.483 1.204 0 CA-C-N 111.625 -2.534 . . . . 0.0 113.737 -176.776 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 115.867 1.803 . . . . 0.0 115.867 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.472 ' HA ' ' HB3' ' A' ' 51' ' ' ARG . 58.3 pttt -166.55 114.32 0.72 Allowed Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 116.198 -1.858 . . . . 0.0 106.333 177.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -75.13 26.27 0.37 Allowed 'Trans proline' 0 C--N 1.355 0.875 0 N-CA-C 120.947 3.403 . . . . 0.0 120.947 -161.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.387 0.5 OUTLIER -178.11 151.47 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.123 0 CA-C-N 111.115 -2.766 . . . . 0.0 106.705 -178.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.284 5.0 p -80.93 102.97 10.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 102.636 -3.098 . . . . 0.0 102.636 177.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -46.36 -13.79 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.829 0 N-CA-C 118.681 2.845 . . . . 0.0 118.681 -174.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 47.9 m-85 -53.99 -32.75 55.04 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 118.44 0.564 . . . . 0.0 111.2 165.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.433 ' OD2' HD22 ' A' ' 45' ' ' LEU . 10.4 t70 -57.9 -50.27 73.92 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 72.2 t -59.27 -43.32 89.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 118.492 0.587 . . . . 0.0 111.771 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.19 -49.94 75.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.638 -175.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.414 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -68.79 -41.77 78.3 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.894 2.078 . . . . 0.0 114.718 175.378 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -63.9 -33.66 76.21 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.975 0.91 . . . . 0.0 110.88 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.89 -18.73 22.44 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-N 113.497 -1.683 . . . . 0.0 111.037 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.24 26.78 56.96 Favored Glycine 0 N--CA 1.487 2.088 0 C-N-CA 126.383 1.945 . . . . 0.0 113.703 173.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.61 HG21 HG23 ' A' ' 34' ' ' THR . 9.1 p -125.6 114.84 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 124.326 1.051 . . . . 0.0 110.932 -170.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -21.73 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.514 2.74 0 C-N-CA 128.636 2.774 . . . . 0.0 110.989 175.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -42.23 -40.55 2.44 Favored 'General case' 0 N--CA 1.52 3.052 0 N-CA-C 115.58 1.696 . . . . 0.0 115.58 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -50.35 -38.91 44.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.582 1.176 . . . . 0.0 113.611 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.645 ' O ' HG23 ' A' ' 23' ' ' VAL 0.256 24.3 p -62.7 -51.23 68.03 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 173.283 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . 0.411 76.5 t -59.54 -41.91 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 123.867 0.867 . . . . 0.0 112.53 -167.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.72 -38.12 89.91 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 19' ' ' THR . 22.2 mtp85 -62.97 -38.54 91.51 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 117.486 2.402 . . . . 0.0 117.486 172.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.809 HG21 HG21 ' A' ' 38' ' ' VAL . 97.2 t -56.97 -47.82 82.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 126.717 2.007 . . . . 0.0 108.824 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.408 HG13 ' HA ' ' A' ' 50' ' ' ASN . 55.3 t -59.37 -55.96 20.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 109.285 -3.598 . . . . 0.0 114.303 -169.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -82.92 0.5 44.09 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 125.464 1.728 . . . . 0.0 114.336 175.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 55.0 36.93 28.05 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 124.744 2.212 . . . . 0.0 110.184 -170.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.381 . . -68.79 84.14 0.3 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 118.821 2.897 . . . . 0.0 118.821 -165.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 57.8 p 80.43 -88.76 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.728 169.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -112.36 44.05 1.51 Allowed 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.862 HG23 ' HE ' ' A' ' 35' ' ' ARG . 4.3 p -34.07 135.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 111.931 -2.395 . . . . 0.0 113.246 151.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.73 ' H ' ' CZ ' ' A' ' 35' ' ' ARG . 45.4 t -111.23 126.43 54.86 Favored 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -170.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -42.03 -59.66 1.67 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -47.37 83.41 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.61 HG23 HG21 ' A' ' 15' ' ' VAL . 28.6 m -58.4 -48.26 81.22 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 112.605 -2.088 . . . . 0.0 105.599 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.862 ' HE ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -57.4 -39.42 76.07 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 113.798 -1.546 . . . . 0.0 115.06 -174.791 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -62.58 -40.82 98.12 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.453 -1.703 . . . . 0.0 114.269 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.9 ttpt -75.56 -40.97 56.02 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.47 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.809 HG21 HG21 ' A' ' 23' ' ' VAL . 20.6 t -62.2 -48.92 86.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.14 0 C-N-CA 127.486 2.314 . . . . 0.0 106.638 176.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -55.6 -43.31 75.93 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 128.409 2.683 . . . . 0.0 113.786 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.19 -51.65 62.71 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 110.73 -2.941 . . . . 0.0 110.4 172.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.87 -54.77 40.63 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.828 ' HB2' ' HB3' ' A' ' 47' ' ' TYR 0.36 0.0 OUTLIER -64.29 -25.55 68.1 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 116.87 2.174 . . . . 0.0 116.87 -174.66 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.17 -47.62 73.39 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.82 172.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.95 -34.2 75.68 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.588 1.555 . . . . 0.0 112.558 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.433 HD22 ' OD2' ' A' ' 8' ' ' ASP . 36.6 mt -95.68 7.24 46.84 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.304 2.642 . . . . 0.0 115.344 -176.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.416 0.2 OUTLIER 60.4 14.57 4.83 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 178.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.828 ' HB3' ' HB2' ' A' ' 42' ' ' MET . 83.6 t80 -73.44 105.37 4.78 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -52.0 119.58 14.54 Favored Pre-proline 0 N--CA 1.495 1.78 0 C-N-CA 118.484 -1.286 . . . . 0.0 112.741 163.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -47.52 139.0 18.24 Favored 'Trans proline' 0 CA--C 1.556 1.612 0 C-N-CA 123.127 2.551 . . . . 0.0 112.773 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.408 ' HA ' HG13 ' A' ' 24' ' ' VAL . 0.5 OUTLIER 59.44 53.15 5.33 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 118.091 2.626 . . . . 0.0 118.091 -177.431 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.472 ' HB3' ' HA ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -95.8 53.7 1.44 Allowed 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 161.019 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.508 ' HA ' HE22 ' A' ' 55' ' ' GLN . 54.9 t -135.99 84.69 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 N-CA-C 102.482 -3.155 . . . . 0.0 102.482 161.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -161.93 -63.83 0.05 Allowed 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 110.999 -2.819 . . . . 0.0 107.895 -167.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.465 ' NE2' ' HE ' ' A' ' 51' ' ' ARG . 31.5 mt-30 -92.68 43.6 1.13 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 124.141 1.924 . . . . 0.0 115.181 -169.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.508 HE22 ' HA ' ' A' ' 52' ' ' VAL . 0.0 OUTLIER -165.52 -55.44 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 111.024 -2.807 . . . . 0.0 110.05 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 76.4 mt . . . . . 0 N--CA 1.493 1.692 0 CA-C-N 114.813 -1.085 . . . . 0.0 112.529 166.636 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.439 ' H3 ' HG22 ' A' ' 52' ' ' VAL . 4.3 ppp? . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.656 ' HD2' HE22 ' A' ' 55' ' ' GLN . 77.4 tttt 61.36 61.95 2.73 Favored Pre-proline 0 CA--C 1.568 1.662 0 C-N-CA 122.639 0.376 . . . . 0.0 111.45 156.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -84.2 -21.02 3.93 Favored 'Trans proline' 0 N--CA 1.485 0.986 0 C-N-CA 117.521 -1.186 . . . . 0.0 114.438 141.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.416 0.4 OUTLIER -159.18 154.53 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 174.044 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.443 HG22 HD11 ' A' ' 56' ' ' LEU . 1.4 p -90.83 135.68 33.57 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 103.324 -2.843 . . . . 0.0 103.324 -179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.758 HD11 ' HG2' ' A' ' 51' ' ' ARG . 20.1 mt -54.91 -18.55 5.1 Favored 'General case' 0 N--CA 1.51 2.552 0 C-N-CA 128.945 2.898 . . . . 0.0 116.053 -162.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -55.03 -33.57 62.78 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 119.566 1.076 . . . . 0.0 111.142 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -65.55 -47.83 74.52 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.169 176.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.5 t -55.79 -45.9 79.66 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 C-N-CA 124.516 1.126 . . . . 0.0 112.625 173.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.05 -54.98 36.18 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 126.172 1.789 . . . . 0.0 112.671 176.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -38.07 89.75 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.123 1.769 . . . . 0.0 113.728 177.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -66.23 -34.8 78.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.022 1.329 . . . . 0.0 110.7 178.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.62 -4.57 55.11 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.13 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 70.15 23.45 77.21 Favored Glycine 0 N--CA 1.492 2.374 0 C-N-CA 127.274 2.368 . . . . 0.0 113.089 172.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.252 8.8 p -123.73 137.02 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -166.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 p -55.03 138.12 44.73 Favored 'General case' 0 N--CA 1.502 2.147 0 C-N-CA 124.842 1.257 . . . . 0.0 109.013 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.672 ' HE1' ' HB2' ' A' ' 6' ' ' LEU . 72.9 t80 -49.95 -28.56 6.95 Favored 'General case' 0 N--CA 1.518 2.941 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 -172.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 -46.96 -47.38 21.8 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 124.853 1.345 . . . . 0.0 112.292 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 23' ' ' VAL . 65.3 p -58.78 -51.81 68.4 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.638 ' O ' HG23 ' A' ' 24' ' ' VAL . 89.1 t -62.96 -51.82 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.817 1.647 . . . . 0.0 109.549 -173.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.8 t -59.13 -41.23 87.73 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 19' ' ' THR . 19.6 mtp85 -60.25 -45.2 94.08 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 113.804 -1.543 . . . . 0.0 114.854 173.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.626 HG21 HG21 ' A' ' 38' ' ' VAL . 42.6 t -57.56 -44.04 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 126.631 1.972 . . . . 0.0 109.277 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 20' ' ' VAL . 75.0 t -58.07 -42.05 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 CA-C-N 111.315 -2.675 . . . . 0.0 112.491 -171.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.581 HD21 ' CZ ' ' A' ' 51' ' ' ARG . 6.6 m120 -91.38 4.22 52.97 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 113.529 -1.668 . . . . 0.0 113.354 173.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.433 ' OE1' HG12 ' A' ' 30' ' ' VAL . 1.1 tm0? 58.1 17.18 4.31 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 128.852 2.861 . . . . 0.0 114.63 -173.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 27.59 38.55 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 110.615 -2.993 . . . . 0.0 116.307 -174.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 97.6 p 55.36 -28.86 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 119.246 3.054 . . . . 0.0 119.246 -160.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -161.85 80.04 0.56 Allowed 'General case' 0 CA--C 1.564 1.501 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 -161.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.433 HG12 ' OE1' ' A' ' 26' ' ' GLN . 8.8 p -117.27 147.26 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 120.452 -1.405 . . . . 0.0 114.674 -179.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.4 p -63.06 135.11 57.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.042 0.937 . . . . 0.0 113.458 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.15 -66.23 0.43 Allowed 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.309 1.6 pptp? -48.02 -33.22 7.64 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 120.299 3.444 . . . . 0.0 120.299 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -61.77 -49.67 75.45 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.608 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 14.2 mtm105 -57.83 -46.89 84.08 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.39 -36.09 70.84 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -75.54 -44.1 45.27 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 110.872 -2.876 . . . . 0.0 111.493 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.626 HG21 HG21 ' A' ' 23' ' ' VAL . 48.7 t -63.93 -45.24 97.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.415 176.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 45.5 mt-10 -55.39 -43.78 75.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 129.532 3.133 . . . . 0.0 111.784 -177.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.11 -50.93 66.36 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 113.469 -1.696 . . . . 0.0 111.583 175.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.36 89.02 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 113.547 -1.66 . . . . 0.0 114.137 176.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.409 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 0.7 OUTLIER -57.61 -45.21 85.64 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.926 1.69 . . . . 0.0 114.356 179.833 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.98 -46.31 85.18 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 113.553 -1.658 . . . . 0.0 111.035 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -64.81 -37.27 87.07 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 113.122 -1.854 . . . . 0.0 113.726 -178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.9 mt -96.37 17.82 15.2 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.94 2.496 . . . . 0.0 114.391 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.383 0.2 OUTLIER 51.41 21.74 1.28 Allowed 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 127.402 2.281 . . . . 0.0 115.772 177.436 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.409 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 27.8 t80 -74.72 154.72 38.29 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.436 -0.79 . . . . 0.0 110.54 -168.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -110.68 93.56 17.09 Favored Pre-proline 0 N--CA 1.473 0.718 0 CA-C-N 112.181 -2.282 . . . . 0.0 111.813 -179.023 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.634 ' O ' HG13 ' A' ' 24' ' ' VAL 0.267 0.1 OUTLIER -9.57 -73.49 0.0 OUTLIER 'Trans proline' 0 N--CA 1.482 0.843 1 C-N-CA 126.797 4.998 . . . . 0.0 117.059 -169.259 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.265 0.2 OUTLIER -80.42 120.48 24.49 Favored 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 174.687 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.758 ' HG2' HD11 ' A' ' 6' ' ' LEU 0.367 0.0 OUTLIER -72.36 89.15 1.21 Allowed 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 172.478 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.439 HG22 ' H3 ' ' A' ' 1' ' ' MET . 3.5 m -85.86 40.21 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 118.072 2.619 . . . . 0.0 118.072 -160.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -167.51 28.53 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 112.647 -2.07 . . . . 0.0 111.774 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.555 HE22 ' NH2' ' A' ' 51' ' ' ARG . 22.6 tp60 49.07 -95.75 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.475 1.51 . . . . 0.0 111.267 -167.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.656 HE22 ' HD2' ' A' ' 2' ' ' LYS . 50.3 tt0 66.26 -45.03 0.41 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.939 1.696 . . . . 0.0 111.604 -173.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.443 HD11 HG22 ' A' ' 5' ' ' THR . 1.0 OUTLIER . . . . . 0 N--CA 1.484 1.236 0 C-N-CA 125.605 1.562 . . . . 0.0 114.041 -177.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HB3' ' NE2' ' A' ' 55' ' ' GLN . 57.5 ttp . . . . . 0 CA--C 1.565 1.555 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.588 ' HD2' ' HB2' ' A' ' 53' ' ' ALA . 19.4 ptmt 175.55 142.77 0.22 Allowed Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.927 2.091 . . . . 0.0 107.928 165.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -64.21 -26.94 64.43 Favored 'Trans proline' 0 C--N 1.357 0.978 0 CA-C-N 122.772 2.026 . . . . 0.0 116.905 -153.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.487 0.8 OUTLIER -167.77 145.16 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 102.121 -3.289 . . . . 0.0 102.121 -175.324 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 22.5 p -93.85 134.16 36.51 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.079 -1.013 . . . . 0.0 108.39 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.486 HD21 ' CZ ' ' A' ' 47' ' ' TYR . 14.6 mt -48.45 -17.69 0.18 Allowed 'General case' 0 N--CA 1.511 2.603 0 N-CA-C 118.454 2.761 . . . . 0.0 118.454 -163.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 45.5 m-85 -58.1 -35.38 71.35 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.78 0.718 . . . . 0.0 111.316 172.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -64.18 -45.77 86.92 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 117.525 -1.226 . . . . 0.0 111.339 176.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.63 ' HA ' HD13 ' A' ' 45' ' ' LEU . 71.2 t -57.61 -42.22 80.85 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 CA-C-N 119.052 0.842 . . . . 0.0 112.987 174.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.484 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -62.18 -52.98 61.62 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 111.646 -2.525 . . . . 0.0 111.748 -176.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.405 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.67 -38.07 83.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.202 2.201 . . . . 0.0 113.204 177.491 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.427 ' CB ' HD11 ' A' ' 45' ' ' LEU . 30.1 t80 -64.35 -35.39 80.73 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.417 1.487 . . . . 0.0 109.521 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.15 -18.32 24.67 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.876 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.44 29.54 57.95 Favored Glycine 0 N--CA 1.49 2.24 0 C-N-CA 126.391 1.948 . . . . 0.0 113.003 172.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.1 p -125.36 137.9 56.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 123.908 0.883 . . . . 0.0 109.028 -170.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.0 p -43.41 122.07 2.48 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 127.038 2.135 . . . . 0.0 107.852 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -33.05 -48.76 0.22 Allowed 'General case' 0 N--CA 1.524 3.241 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 177.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.554 0.0 OUTLIER -57.84 -20.98 40.11 Favored 'General case' 0 C--N 1.314 -0.963 1 N-CA-C 124.232 4.901 . . . . 0.0 124.232 -179.956 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.54 ' O ' HG23 ' A' ' 23' ' ' VAL 0.696 0.7 OUTLIER -76.56 -43.56 38.43 Favored 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 160.753 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.58 ' O ' HG23 ' A' ' 24' ' ' VAL . 77.4 t -59.72 -49.39 83.96 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.635 -176.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.3 p -58.01 -44.43 87.26 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -173.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -60.36 -47.39 86.27 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 108.695 -3.866 . . . . 0.0 114.852 168.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 19' ' ' THR . 91.4 t -59.19 -40.66 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -176.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 20' ' ' VAL . 68.5 t -53.62 -50.0 52.89 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 CA-C-N 113.914 -1.493 . . . . 0.0 112.966 -172.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.651 HD21 ' ND2' ' A' ' 50' ' ' ASN 0.308 3.7 m120 -99.34 27.78 4.98 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 123.103 1.43 . . . . 0.0 114.706 170.519 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 71.31 -16.58 0.36 Allowed 'General case' 0 C--O 1.236 0.364 0 C-N-CA 131.589 3.956 . . . . 0.0 116.583 173.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 45.18 37.93 2.98 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.113 2.165 . . . . 0.0 111.781 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 99.2 p 57.55 -46.34 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.751 -2.022 . . . . 0.0 115.821 -150.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -154.73 109.82 3.07 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.192 -165.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.638 ' H ' ' NH2' ' A' ' 35' ' ' ARG . 25.3 t -132.97 132.55 59.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 120.628 1.558 . . . . 0.0 114.763 157.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -16.16 135.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 119.18 3.03 . . . . 0.0 119.18 175.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 35' ' ' ARG . . . -59.93 -49.08 79.08 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.559 1.144 . . . . 0.0 113.416 -173.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -44.2 43.65 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 175.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.0 m -62.03 -51.27 68.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 113.068 -1.878 . . . . 0.0 108.273 175.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.638 ' NH2' ' H ' ' A' ' 30' ' ' VAL . 38.3 mtt-85 -53.87 -46.81 71.42 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.386 1.074 . . . . 0.0 113.856 178.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.88 -37.42 76.52 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.792 -1.095 . . . . 0.0 113.539 -176.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -76.44 -45.3 32.02 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.741 -2.027 . . . . 0.0 111.908 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.4 t -61.29 -47.91 91.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-N 113.884 -1.507 . . . . 0.0 108.513 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -58.53 -46.12 87.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.009 3.324 . . . . 0.0 111.503 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.54 -48.98 73.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 113.434 -1.712 . . . . 0.0 110.873 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.8 -43.94 86.01 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 112.95 -1.932 . . . . 0.0 112.661 173.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.499 ' HG2' ' HD2' ' A' ' 47' ' ' TYR . 9.9 mtt -55.04 -46.65 75.33 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 125.436 1.495 . . . . 0.0 112.169 -178.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -47.45 83.26 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 112.951 -1.931 . . . . 0.0 111.731 -175.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -61.03 -40.31 93.09 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 112.413 -2.176 . . . . 0.0 112.916 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 9' ' ' VAL . 19.4 mt -87.13 6.23 33.81 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 128.393 2.677 . . . . 0.0 116.645 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.43 0.2 OUTLIER 52.6 23.1 2.45 Favored 'General case' 0 CA--C 1.566 1.559 0 C-N-CA 128.09 2.556 . . . . 0.0 113.792 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.499 ' HD2' ' HG2' ' A' ' 42' ' ' MET . 51.8 t80 -82.05 97.96 8.4 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 118.614 -2.554 . . . . 0.0 110.824 -172.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -32.91 121.7 0.43 Allowed Pre-proline 0 N--CA 1.494 1.726 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.633 155.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -65.54 48.17 0.2 Allowed 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.073 2.515 . . . . 0.0 118.0 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.651 ' ND2' HD21 ' A' ' 25' ' ' ASN . 0.1 OUTLIER -171.73 93.33 0.15 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.046 -1.888 . . . . 0.0 114.341 176.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.0 ttp-105 -9.4 96.91 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.357 0 CA-C-N 113.779 -1.555 . . . . 0.0 111.417 146.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 16.1 m -107.31 39.39 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 174.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.588 ' HB2' ' HD2' ' A' ' 2' ' ' LYS . . . -86.39 16.16 4.75 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 111.921 -2.4 . . . . 0.0 113.232 -175.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -94.94 64.11 2.8 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 124.467 2.08 . . . . 0.0 114.116 -169.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.523 ' NE2' ' HB3' ' A' ' 1' ' ' MET . 0.8 OUTLIER -171.71 -24.75 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.705 1 CA-C-N 107.9 -4.227 . . . . 0.0 113.727 178.857 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 N--CA 1.484 1.261 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 169.945 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.8 mtt . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 116.585 2.069 . . . . 0.0 116.585 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.5 mtpt -166.08 54.44 0.33 Allowed Pre-proline 0 N--CA 1.488 1.429 0 C-N-CA 126.793 2.037 . . . . 0.0 107.301 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.86 -28.86 79.13 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 122.463 2.109 . . . . 0.0 116.724 -165.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.327 0.5 OUTLIER -150.53 118.89 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 113.901 -1.5 . . . . 0.0 109.665 175.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.8 p -67.81 147.15 52.96 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -152.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.542 ' HB2' ' HE2' ' A' ' 17' ' ' TYR . 11.8 mt -48.89 -17.54 0.2 Allowed 'General case' 0 N--CA 1.517 2.889 0 N-CA-C 118.797 2.888 . . . . 0.0 118.797 -162.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.425 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 30.3 m-85 -60.83 -40.58 93.32 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 118.596 0.635 . . . . 0.0 111.241 179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.427 ' OD2' HD22 ' A' ' 45' ' ' LEU . 6.4 t70 -51.81 -55.86 17.37 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.299 1.04 . . . . 0.0 112.057 166.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.6 t -58.94 -39.72 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 7' ' ' TYR . . . -58.07 -55.57 33.18 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 126.384 1.873 . . . . 0.0 112.701 172.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -38.37 89.3 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.52 1.928 . . . . 0.0 114.237 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.422 ' CG ' HD11 ' A' ' 45' ' ' LEU . 43.2 t80 -64.57 -37.28 87.02 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.466 1.107 . . . . 0.0 109.808 178.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.17 -12.33 44.23 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.829 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.39 26.61 67.57 Favored Glycine 0 CA--C 1.549 2.169 0 C-N-CA 127.533 2.492 . . . . 0.0 113.337 172.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.0 p -124.06 132.08 71.9 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 123.909 0.883 . . . . 0.0 110.663 -171.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.2 p -36.79 127.76 0.86 Allowed 'General case' 0 N--CA 1.522 3.137 0 C-N-CA 126.638 1.975 . . . . 0.0 108.952 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.542 ' HE2' ' HB2' ' A' ' 6' ' ' LEU . 58.7 t80 -48.05 -33.0 7.41 Favored 'General case' 0 N--CA 1.514 2.762 0 N-CA-C 115.848 1.795 . . . . 0.0 115.848 176.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -52.38 -46.19 66.11 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-O 117.115 -1.421 . . . . 0.0 111.315 175.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.574 ' O ' HG23 ' A' ' 23' ' ' VAL 0.905 0.6 OUTLIER -67.86 -40.01 83.68 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.963 2.209 . . . . 0.0 116.963 176.544 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.65 ' O ' HG23 ' A' ' 24' ' ' VAL 0.278 78.2 t -59.61 -46.79 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 CA-C-O 117.294 -1.336 . . . . 0.0 110.279 -177.614 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.347 3.5 m -68.08 -29.7 68.71 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 120.358 3.466 . . . . 0.0 120.358 -174.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 19' ' ' THR . 33.7 mtp85 -63.91 -52.18 61.08 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 110.808 -2.905 . . . . 0.0 113.184 162.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.736 HG22 HG21 ' A' ' 30' ' ' VAL . 62.8 t -62.39 -42.27 94.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 C-N-CA 124.488 1.115 . . . . 0.0 110.255 -172.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 20' ' ' VAL . 52.3 t -51.65 -54.87 10.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 O-C-N 125.418 1.699 . . . . 0.0 111.112 -162.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.289 17.7 m120 -105.89 42.01 1.32 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 113.948 -1.478 . . . . 0.0 112.858 176.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.384 10.6 pt20 80.97 -9.97 1.27 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.546 3.539 . . . . 0.0 118.417 163.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 40.36 30.55 0.08 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.717 2.007 . . . . 0.0 115.075 -168.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.9 p 61.02 -44.82 0.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 115.98 1.845 . . . . 0.0 115.98 -155.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.276 78.4 m80 -152.53 126.4 9.0 Favored 'General case' 0 CA--C 1.558 1.275 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 -170.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.736 HG21 HG22 ' A' ' 23' ' ' VAL . 3.7 p -141.53 162.75 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.568 0 CA-C-N 120.157 1.344 . . . . 0.0 112.656 170.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -59.45 130.03 44.88 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 170.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.93 -59.53 4.23 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -175.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.6 tptp -41.41 -41.3 1.98 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.7 m -58.51 -47.0 85.59 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 113.639 -1.619 . . . . 0.0 109.173 -178.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.6 mmt85 -55.34 -45.19 76.43 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -35.13 76.05 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -78.55 -42.3 29.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 112.477 -2.147 . . . . 0.0 112.217 -179.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.401 HG21 HG11 ' A' ' 23' ' ' VAL . 84.3 t -60.83 -50.8 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 126.007 1.723 . . . . 0.0 108.059 173.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -54.95 -44.9 74.77 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 125.327 1.451 . . . . 0.0 112.922 -178.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.89 -49.26 71.18 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 112.479 -2.146 . . . . 0.0 111.213 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.17 -45.59 83.52 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 113.581 -1.645 . . . . 0.0 113.249 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.489 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.1 mmt -60.11 -47.39 86.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.667 -1.151 . . . . 0.0 114.019 -177.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 113.27 -1.786 . . . . 0.0 111.449 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -64.78 -40.62 95.56 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 112.027 -2.351 . . . . 0.0 112.358 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.427 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.3 mt -85.78 6.67 26.93 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 127.81 2.444 . . . . 0.0 112.517 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.474 0.2 OUTLIER 44.16 34.05 0.92 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 -171.257 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 60.7 t80 -98.34 88.46 4.16 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 111.324 -2.671 . . . . 0.0 108.778 -166.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -6.64 114.56 0.03 OUTLIER Pre-proline 0 N--CA 1.496 1.853 0 CA-C-N 111.65 -2.523 . . . . 0.0 114.219 155.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -68.29 57.92 0.94 Allowed 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 122.339 2.026 . . . . 0.0 116.668 173.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.585 HD22 ' H ' ' A' ' 51' ' ' ARG . 0.2 OUTLIER -169.96 -177.28 2.55 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.636 1.974 . . . . 0.0 110.786 168.727 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.585 ' H ' HD22 ' A' ' 50' ' ' ASN . 0.6 OUTLIER -132.92 96.48 3.79 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.362 1.065 . . . . 0.0 108.538 177.803 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.84 135.79 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 N-CA-C 104.211 -2.515 . . . . 0.0 104.211 163.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.85 100.61 0.96 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 119.298 0.954 . . . . 0.0 110.962 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -74.02 -38.16 64.13 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 113.115 -1.857 . . . . 0.0 110.834 171.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.512 ' H ' ' CD ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -89.58 77.76 7.15 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 113.136 -1.847 . . . . 0.0 106.118 173.088 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 N--CA 1.483 1.215 0 CA-C-N 111.577 -2.556 . . . . 0.0 115.165 173.082 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.507 ' HG2' ' HG3' ' A' ' 54' ' ' GLN . 23.7 ptt? . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 115.646 1.721 . . . . 0.0 115.646 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.526 ' HG2' ' HG ' ' A' ' 6' ' ' LEU 0.349 0.2 OUTLIER 49.33 127.63 0.0 OUTLIER Pre-proline 0 CA--C 1.577 2.005 0 N-CA-C 118.965 2.95 . . . . 0.0 118.965 159.942 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -76.0 24.45 0.43 Allowed 'Trans proline' 0 C--N 1.361 1.197 0 N-CA-C 120.331 3.166 . . . . 0.0 120.331 -176.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.438 ' O ' ' HD3' ' A' ' 2' ' ' LYS 0.427 0.5 OUTLIER -176.7 148.12 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 N-CA-C 102.578 -3.119 . . . . 0.0 102.578 -176.862 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.337 0.8 OUTLIER -71.09 106.09 3.6 Favored 'General case' 0 CA--C 1.563 1.475 0 N-CA-C 101.75 -3.426 . . . . 0.0 101.75 -179.392 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.526 ' HG ' ' HG2' ' A' ' 2' ' ' LYS . 51.7 mt -45.48 -16.3 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.894 0 N-CA-C 118.341 2.719 . . . . 0.0 118.341 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.61 ' HB3' ' OE2' ' A' ' 11' ' ' GLU 0.314 56.4 m-85 -54.54 -32.5 58.37 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.621 1.555 . . . . 0.0 111.447 166.395 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.516 ' OD2' HD22 ' A' ' 45' ' ' LEU . 23.3 t0 -60.19 -49.67 76.71 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.327 175.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.98 -46.25 87.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 174.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.75 -49.51 77.44 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 111.67 -2.513 . . . . 0.0 111.66 -176.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.61 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.7 OUTLIER -67.89 -43.09 80.14 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.629 2.372 . . . . 0.0 114.678 177.243 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -63.24 -32.89 74.41 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.864 0.728 . . . . 0.0 110.601 177.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -92.75 -16.44 25.43 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 113.94 -1.482 . . . . 0.0 111.723 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.77 25.78 66.5 Favored Glycine 0 CA--C 1.55 2.24 0 C-N-CA 126.56 2.028 . . . . 0.0 113.618 173.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.428 HG22 HG21 ' A' ' 19' ' ' THR 0.276 4.3 p -129.94 125.12 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.511 0 C-N-CA 124.115 0.966 . . . . 0.0 108.394 -167.012 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -32.96 139.26 0.05 Allowed 'General case' 0 N--CA 1.526 3.37 0 C-N-CA 127.507 2.323 . . . . 0.0 111.274 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -52.52 -41.73 63.71 Favored 'General case' 0 N--CA 1.512 2.672 0 CA-C-N 121.117 1.78 . . . . 0.0 115.047 -177.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.667 HE21 ' CZ ' ' A' ' 22' ' ' ARG 0.529 0.0 OUTLIER -61.77 -30.51 70.84 Favored 'General case' 0 C--N 1.318 -0.77 1 N-CA-C 122.718 4.34 . . . . 0.0 122.718 175.331 . . . . . . . . 5 4 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 23' ' ' VAL . 87.4 m -55.19 -49.34 72.16 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 112.801 -2.0 . . . . 0.0 109.581 162.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.681 ' O ' HG23 ' A' ' 24' ' ' VAL 0.284 73.9 t -64.67 -48.06 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.772 -178.15 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.338 3.3 m -63.37 -33.24 75.12 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.667 ' CZ ' HE21 ' A' ' 18' ' ' GLN . 20.7 mtt85 -60.9 -48.84 79.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.085 -1.87 . . . . 0.0 114.354 167.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.568 HG21 HG21 ' A' ' 38' ' ' VAL . 89.7 t -61.07 -39.98 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.695 1.198 . . . . 0.0 108.954 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 20' ' ' VAL . 42.1 t -55.28 -42.53 66.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-N 113.53 -1.668 . . . . 0.0 112.996 -170.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.12 19.4 19.62 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 171.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.28 0.7 OUTLIER 65.47 11.65 7.56 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 129.459 3.104 . . . . 0.0 118.731 176.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 26.73 42.08 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 110.57 -3.014 . . . . 0.0 116.096 -173.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.275 69.7 m 58.14 -44.45 0.05 Allowed 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 117.906 2.558 . . . . 0.0 117.906 -165.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -152.68 101.32 2.62 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.276 4.2 p -132.04 147.82 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -57.21 143.09 40.53 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -172.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -46.35 -67.16 0.31 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -40.63 66.77 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -177.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.556 ' O ' HG23 ' A' ' 38' ' ' VAL . 36.8 m -56.95 -52.47 65.09 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 113.058 -1.883 . . . . 0.0 106.938 177.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mtm105 -61.39 -48.55 80.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.792 1.237 . . . . 0.0 114.265 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.11 86.97 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.294 1.837 . . . . 0.0 114.826 -176.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -75.43 -42.84 52.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 112.059 -2.337 . . . . 0.0 110.761 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.568 HG21 HG21 ' A' ' 23' ' ' VAL . 38.9 t -63.78 -49.83 80.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 CA-C-N 114.187 -1.37 . . . . 0.0 107.76 178.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -54.39 -46.42 73.08 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 126.661 1.985 . . . . 0.0 112.599 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.2 -48.61 80.75 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 112.361 -2.2 . . . . 0.0 111.134 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.23 -39.97 80.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.584 -2.098 . . . . 0.0 113.293 173.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 30.5 mtt -61.01 -52.11 66.39 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -172.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.28 -41.33 85.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.254 -1.793 . . . . 0.0 113.673 174.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -59.46 -37.83 79.2 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 113.402 -1.726 . . . . 0.0 113.45 -178.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.516 HD22 ' OD2' ' A' ' 8' ' ' ASP . 52.9 mt -91.99 26.06 2.6 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 52.38 33.6 13.28 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.82 1.772 . . . . 0.0 114.139 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 66.3 t80 -101.45 -177.49 3.45 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.423 1.489 . . . . 0.0 109.751 -174.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.472 ' N ' ' CG ' ' A' ' 47' ' ' TYR 0.258 0.0 OUTLIER -145.39 113.37 4.76 Favored Pre-proline 0 N--CA 1.485 1.31 0 CA-C-O 117.374 -1.298 . . . . 0.0 108.683 -177.24 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 48' ' ' ILE . 82.2 Cg_exo -54.38 34.79 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.454 2 N-CA-C 124.685 4.84 . . . . 0.0 124.685 -170.487 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.28 16.09 2.05 Favored 'General case' 0 N--CA 1.489 1.513 1 N-CA-C 121.998 4.073 . . . . 0.0 121.998 176.626 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.465 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.1 OUTLIER 33.31 74.96 0.05 Allowed 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 122.605 1.193 . . . . 0.0 111.247 -169.144 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -63.79 107.1 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 -170.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -40.06 125.45 1.97 Allowed 'General case' 0 N--CA 1.506 2.358 0 CA-C-O 123.695 1.712 . . . . 0.0 111.846 167.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.507 ' HG3' ' HG2' ' A' ' 1' ' ' MET . 0.9 OUTLIER 4.84 70.2 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 119.218 3.044 . . . . 0.0 119.218 -155.769 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.298 1.7 mp0 69.71 -25.01 0.15 Allowed 'General case' 0 N--CA 1.498 1.958 0 CA-C-N 110.785 -2.916 . . . . 0.0 115.757 172.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.0 tp . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 152.336 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.3 mtt . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.826 ' HG2' ' H ' ' A' ' 55' ' ' GLN . 1.0 OUTLIER -174.27 156.21 2.35 Favored Pre-proline 0 CA--C 1.563 1.452 0 C-N-CA 127.398 2.279 . . . . 0.0 108.583 179.481 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.472 ' HD3' ' HG3' ' A' ' 51' ' ' ARG . 23.4 Cg_exo -95.97 -25.58 0.11 Allowed 'Trans proline' 0 N--CA 1.488 1.178 0 CA-C-N 123.797 2.392 . . . . 0.0 115.426 -170.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.451 0.5 OUTLIER -155.02 137.78 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 N-CA-C 103.418 -2.808 . . . . 0.0 103.418 -167.544 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.2 p -61.45 90.05 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 105.339 -2.097 . . . . 0.0 105.339 174.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.638 HD12 HE22 ' A' ' 55' ' ' GLN . 17.7 mt -35.17 -16.89 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.347 0 N-CA-C 119.596 3.184 . . . . 0.0 119.596 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.488 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 52.0 m-85 -53.34 -33.89 55.35 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.407 0.683 . . . . 0.0 110.899 164.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.455 ' OD2' HD22 ' A' ' 45' ' ' LEU . 14.1 t70 -57.23 -50.6 72.37 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.335 1.235 . . . . 0.0 114.335 172.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.419 ' HA ' HD13 ' A' ' 45' ' ' LEU . 84.6 t -59.95 -43.12 91.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 C-N-CA 123.252 0.621 . . . . 0.0 112.592 173.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.78 -55.11 39.4 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 112.065 -2.334 . . . . 0.0 112.175 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.488 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.9 OUTLIER -66.24 -40.59 90.33 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.717 2.007 . . . . 0.0 115.049 177.508 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -65.22 -35.76 82.05 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.964 0.887 . . . . 0.0 110.73 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.11 -19.33 27.17 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 113.632 -1.622 . . . . 0.0 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 26.19 57.93 Favored Glycine 0 CA--C 1.545 1.951 0 C-N-CA 126.793 2.139 . . . . 0.0 113.001 172.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.6 p -119.56 126.4 75.28 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 125.325 1.45 . . . . 0.0 110.605 -171.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.2 p -28.3 121.4 0.12 Allowed 'General case' 0 N--CA 1.517 2.915 0 C-N-CA 129.154 2.982 . . . . 0.0 110.476 173.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -44.46 -45.1 8.97 Favored 'General case' 0 N--CA 1.521 3.091 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -174.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.426 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.665 0.6 OUTLIER -56.56 -18.63 12.4 Favored 'General case' 0 C--N 1.321 -0.643 1 N-CA-C 125.265 5.283 . . . . 0.0 125.265 176.22 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.485 ' O ' HG23 ' A' ' 23' ' ' VAL . 71.0 p -64.66 -53.01 54.13 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 113.714 -1.584 . . . . 0.0 113.65 159.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.615 ' O ' HG23 ' A' ' 24' ' ' VAL 0.25 80.1 t -60.99 -50.86 78.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 O-C-N 121.106 -0.996 . . . . 0.0 110.87 -164.298 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.29 13.8 m -59.76 -35.18 74.08 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -179.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.449 ' HB2' ' O ' ' A' ' 19' ' ' THR . 11.2 mtt85 -67.23 -42.73 83.54 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 112.055 -2.339 . . . . 0.0 117.103 170.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.737 HG11 HG21 ' A' ' 38' ' ' VAL . 75.7 t -60.63 -43.13 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 125.813 1.645 . . . . 0.0 108.161 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.2 t -49.04 -49.45 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.289 0 O-C-N 125.708 1.88 . . . . 0.0 111.416 -171.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.407 HD21 ' ND2' ' A' ' 50' ' ' ASN 0.377 14.3 m120 -106.46 29.85 6.51 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 116.476 2.028 . . . . 0.0 116.476 173.163 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 18.3 tt0 61.05 17.76 8.3 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 129.493 3.117 . . . . 0.0 115.604 170.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.58 39.88 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 111.735 -2.484 . . . . 0.0 116.998 -176.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.257 86.1 p 61.01 -56.72 0.09 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 126.313 1.845 . . . . 0.0 113.663 -163.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.288 98.8 m-70 -138.26 115.49 11.04 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 118.44 -0.79 . . . . 0.0 111.969 167.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.4 p -127.17 156.11 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 172.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.9 p -54.63 134.71 47.01 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 174.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.99 -53.28 57.83 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 -175.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -48.4 -41.71 29.79 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.442 ' O ' HG23 ' A' ' 38' ' ' VAL . 27.9 m -56.46 -48.72 76.48 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 114.271 -1.331 . . . . 0.0 107.881 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 2.4 mmm180 -59.22 -42.64 91.46 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 117.72 2.489 . . . . 0.0 117.72 177.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -36.07 76.13 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 113.479 -1.691 . . . . 0.0 115.445 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -77.99 -44.56 26.3 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 111.949 -2.387 . . . . 0.0 111.283 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.737 HG21 HG11 ' A' ' 23' ' ' VAL . 41.6 t -64.25 -45.36 96.44 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 113.803 -1.544 . . . . 0.0 108.636 177.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 51.9 mt-10 -58.44 -42.09 86.53 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.565 3.146 . . . . 0.0 112.985 -177.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -52.03 65.06 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 112.585 -2.098 . . . . 0.0 109.843 174.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.66 -38.15 74.6 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 113.285 -1.78 . . . . 0.0 114.999 175.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.449 ' SD ' ' HG3' ' A' ' 49' ' ' PRO . 36.3 mtt -59.81 -53.21 60.61 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -173.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.04 94.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 113.07 -1.877 . . . . 0.0 112.386 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.42 -37.29 86.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 112.619 -2.082 . . . . 0.0 113.732 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.455 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.5 mt -98.75 20.76 12.46 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 126.455 1.902 . . . . 0.0 113.539 -179.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 56.72 25.24 9.91 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 116.52 2.045 . . . . 0.0 116.52 175.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.536 ' OH ' HD11 ' A' ' 6' ' ' LEU . 54.4 t80 -86.82 170.83 11.35 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.294 -172.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -148.25 113.41 3.84 Favored Pre-proline 0 CA--C 1.547 0.836 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.861 -170.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.449 ' HG3' ' SD ' ' A' ' 42' ' ' MET . 5.3 Cg_exo -68.6 57.77 1.03 Allowed 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.615 2.21 . . . . 0.0 117.39 -171.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.407 ' ND2' HD21 ' A' ' 25' ' ' ASN . 0.1 OUTLIER -175.46 83.75 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 113.737 -1.574 . . . . 0.0 110.419 175.637 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.472 ' HG3' ' HD3' ' A' ' 3' ' ' PRO 0.461 0.0 OUTLIER -124.91 87.57 2.74 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.848 -1.157 . . . . 0.0 110.824 -174.711 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . 0.385 9.9 m -50.28 -48.43 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 N-CA-C 117.843 2.534 . . . . 0.0 117.843 -170.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -104.92 58.84 0.69 Allowed 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 124.339 2.018 . . . . 0.0 107.972 -175.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . 0.29 0.1 OUTLIER -55.04 113.34 1.32 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 111.224 -2.717 . . . . 0.0 113.674 -175.393 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.826 ' H ' ' HG2' ' A' ' 2' ' ' LYS . 2.0 mp0 58.92 30.44 20.17 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 110.962 -2.835 . . . . 0.0 113.632 -178.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 58.3 mt . . . . . 0 N--CA 1.474 0.727 0 CA-C-N 112.775 -2.012 . . . . 0.0 114.281 172.293 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.572 ' HA ' HE22 ' A' ' 55' ' ' GLN 0.303 15.3 ptt? . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.67 ' HD3' HD21 ' A' ' 50' ' ' ASN . 10.5 mttt -155.41 146.81 16.79 Favored Pre-proline 0 CA--C 1.554 1.102 0 CA-C-O 118.14 -0.933 . . . . 0.0 111.367 175.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -46.63 140.2 12.61 Favored 'Trans proline' 0 CA--C 1.551 1.34 0 C-N-CA 124.012 3.141 . . . . 0.0 117.146 -135.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.476 ' O ' HG22 ' A' ' 5' ' ' THR . 0.8 OUTLIER 52.22 -6.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.728 1 N-CA-C 122.388 4.218 . . . . 0.0 122.388 171.011 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 4' ' ' VAL 0.31 7.0 t 71.82 149.59 0.09 Allowed 'General case' 0 N--CA 1.491 1.602 1 C-N-CA 133.92 4.888 . . . . 0.0 117.587 -177.862 . . . . . . . . 4 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.511 HD11 ' HG2' ' A' ' 51' ' ' ARG . 33.9 mt -62.55 -27.85 69.45 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -175.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -58.1 -37.54 74.71 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.876 0.871 . . . . 0.0 109.695 172.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.538 ' OD2' HD22 ' A' ' 45' ' ' LEU . 22.6 t70 -64.94 -49.51 70.08 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.885 178.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.42 -43.34 90.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 173.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.404 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -57.1 -46.53 82.5 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.415 1.886 . . . . 0.0 113.214 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -69.54 -43.96 71.9 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 126.315 1.846 . . . . 0.0 115.673 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.43 ' CB ' HD11 ' A' ' 45' ' ' LEU . 37.5 t80 -64.55 -33.22 75.4 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-O 121.559 0.695 . . . . 0.0 110.546 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.38 -20.64 23.73 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.555 -1.657 . . . . 0.0 111.568 -179.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.18 27.9 61.18 Favored Glycine 0 N--CA 1.489 2.229 0 C-N-CA 125.524 1.535 . . . . 0.0 112.773 171.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.424 HG22 HG21 ' A' ' 19' ' ' THR 0.255 8.6 p -132.28 120.94 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.476 0.71 . . . . 0.0 109.727 -167.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.6 p -26.35 139.67 0.01 OUTLIER 'General case' 0 N--CA 1.524 3.27 0 C-N-CA 128.233 2.613 . . . . 0.0 110.623 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 6' ' ' LEU . 66.1 t80 -54.51 -34.8 62.31 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 119.483 -2.011 . . . . 0.0 114.728 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -53.51 -44.69 69.29 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.909 0.756 . . . . 0.0 111.62 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' HG23 ' A' ' 23' ' ' VAL . 36.6 m -55.13 -52.53 62.98 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.958 1.303 . . . . 0.0 111.127 176.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.65 ' O ' HG23 ' A' ' 24' ' ' VAL . 76.9 t -65.33 -50.83 70.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 118.393 -0.813 . . . . 0.0 110.911 -175.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.384 7.6 m -63.15 -31.15 72.22 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 118.453 2.76 . . . . 0.0 118.453 -178.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.6 mtp85 -60.01 -48.85 80.0 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 111.356 -2.657 . . . . 0.0 115.121 164.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 38' ' ' VAL . 69.8 t -59.72 -45.11 94.85 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 124.949 1.3 . . . . 0.0 108.797 -179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 20' ' ' VAL . 94.8 t -53.14 -44.69 52.64 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 CA-C-N 112.753 -2.021 . . . . 0.0 112.108 -171.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.285 11.1 m120 -104.22 25.82 9.6 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 173.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.438 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER 58.87 19.99 7.59 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 128.668 2.787 . . . . 0.0 115.997 172.265 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.79 45.64 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.022 0 CA-C-N 111.371 -2.65 . . . . 0.0 116.699 -175.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.253 88.5 p 59.44 -52.93 0.06 Allowed 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 126.129 1.772 . . . . 0.0 114.802 -162.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.8 m170 -138.44 117.15 12.25 Favored 'General case' 0 CA--C 1.566 1.575 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.438 HG12 ' OE1' ' A' ' 26' ' ' GLN . 3.3 p -118.18 147.56 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 172.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.3 p -61.92 139.43 58.39 Favored 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.43 -66.53 0.39 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB2' ' HZ2' ' A' ' 33' ' ' LYS 0.271 0.0 OUTLIER -52.94 -34.07 53.74 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -179.317 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.5 m -62.48 -50.89 69.65 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 177.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -57.69 -46.91 83.7 Favored 'General case' 0 N--CA 1.434 -1.254 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 175.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.03 -36.35 65.42 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -175.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -74.56 -44.61 50.18 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 110.811 -2.904 . . . . 0.0 111.748 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.578 HG21 HG21 ' A' ' 23' ' ' VAL . 61.1 t -66.6 -50.01 70.03 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 CA-C-N 113.677 -1.602 . . . . 0.0 109.606 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -49.77 -45.59 49.82 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.648 3.179 . . . . 0.0 111.394 178.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.15 -49.15 77.01 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 111.404 -2.634 . . . . 0.0 110.887 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.61 -46.67 88.82 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 113.356 -1.747 . . . . 0.0 114.965 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.4 mtt -56.55 -45.41 81.26 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.342 1.857 . . . . 0.0 113.662 -177.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.64 -47.42 78.58 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 113.282 -1.781 . . . . 0.0 112.177 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.42 -43.28 94.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 112.612 -2.085 . . . . 0.0 113.104 -177.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.538 HD22 ' OD2' ' A' ' 8' ' ' ASP . 31.0 mt -81.15 14.09 2.5 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.333 1.2 p-10 50.28 41.85 24.88 Favored 'General case' 0 CA--C 1.574 1.893 0 CA-C-O 122.777 1.275 . . . . 0.0 113.338 177.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -105.11 179.41 4.28 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 114.83 -1.077 . . . . 0.0 108.916 -173.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.272 0.0 OUTLIER -148.73 108.65 3.53 Favored Pre-proline 0 N--CA 1.481 1.082 0 O-C-N 121.36 -0.838 . . . . 0.0 112.1 -174.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -47.82 104.04 0.07 OUTLIER 'Trans proline' 0 CA--C 1.555 1.534 1 C-N-CA 125.408 4.072 . . . . 0.0 111.321 -176.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.67 HD21 ' HD3' ' A' ' 2' ' ' LYS . 0.1 OUTLIER 172.15 -57.31 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 125.59 1.556 . . . . 0.0 114.061 168.007 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.667 ' H ' ' ND2' ' A' ' 50' ' ' ASN 0.352 13.0 tpp85 71.72 -28.18 0.18 Allowed 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 126.912 2.085 . . . . 0.0 115.388 -173.781 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 9.5 p -66.08 -31.12 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 1 N-CA-C 123.365 4.58 . . . . 0.0 123.365 -179.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -86.23 65.14 8.93 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-O 122.974 1.368 . . . . 0.0 110.412 -178.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 13.2 mt-30 -74.78 107.5 6.91 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 112.484 -2.143 . . . . 0.0 114.519 -173.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.572 HE22 ' HA ' ' A' ' 1' ' ' MET . 3.8 mp0 56.82 20.25 5.06 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 125.635 1.835 . . . . 0.0 113.7 -164.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.9 tp . . . . . 0 N--CA 1.479 1.02 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.869 -171.564 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.444 ' HA ' ' O ' ' A' ' 55' ' ' GLN . 58.0 mtt . . . . . 0 N--CA 1.485 1.295 0 N-CA-C 116.633 2.086 . . . . 0.0 116.633 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.435 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -167.51 155.5 8.51 Favored Pre-proline 0 CA--C 1.563 1.456 0 CA-C-O 115.991 -1.957 . . . . 0.0 110.584 -179.124 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -45.73 -43.7 18.57 Favored 'Trans proline' 0 N--CA 1.488 1.172 0 C-N-CA 123.435 2.756 . . . . 0.0 117.612 -157.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.427 0.8 OUTLIER -152.06 140.44 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 -177.716 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.307 2.7 p -71.07 94.14 1.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 105.616 -1.994 . . . . 0.0 105.616 -175.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.423 ' H ' ' HE3' ' A' ' 2' ' ' LYS . 28.9 mt -27.87 -16.66 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.86 1 N-CA-C 123.028 4.455 . . . . 0.0 123.028 177.547 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -56.5 -36.45 69.17 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-N 118.97 0.805 . . . . 0.0 111.158 165.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.02 -52.25 59.06 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 172.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.22 -45.93 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.166 0.987 . . . . 0.0 112.387 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.54 -47.45 79.4 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.366 -1.743 . . . . 0.0 113.238 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -44.48 76.67 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 115.296 175.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.449 ' CB ' HD11 ' A' ' 45' ' ' LEU . 52.4 t80 -63.59 -33.53 75.81 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.993 1.317 . . . . 0.0 111.248 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.63 -15.35 25.44 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.92 -1.491 . . . . 0.0 111.21 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.95 26.69 68.32 Favored Glycine 0 N--CA 1.494 2.504 0 C-N-CA 125.949 1.738 . . . . 0.0 112.6 171.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.447 HG22 HG21 ' A' ' 19' ' ' THR . 8.5 p -131.78 117.68 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.478 1.111 . . . . 0.0 108.441 -168.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 53.7 p -22.24 142.87 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.984 0 C-N-CA 127.066 2.146 . . . . 0.0 112.73 -174.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.25 83.3 t80 -50.73 -42.89 57.79 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 119.919 -1.738 . . . . 0.0 114.295 171.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -52.52 -41.9 63.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 123.872 0.733 . . . . 0.0 112.754 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 23' ' ' VAL . 46.4 m -56.55 -51.86 66.97 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.75 175.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 24' ' ' VAL 0.328 86.9 t -64.91 -45.39 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 118.085 -0.959 . . . . 0.0 112.4 -173.599 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.313 3.7 m -63.57 -36.0 82.36 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 -178.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -60.17 -47.45 85.89 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 167.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.78 HG11 HG21 ' A' ' 38' ' ' VAL . 73.3 t -59.98 -39.59 80.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.668 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.9 t -53.06 -50.94 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 CA-C-N 113.898 -1.501 . . . . 0.0 112.293 -171.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -84.45 7.46 19.68 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 171.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.557 ' HG2' ' HD3' ' A' ' 35' ' ' ARG . 0.9 OUTLIER 62.66 14.24 7.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 128.091 2.557 . . . . 0.0 113.781 -177.006 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 31.05 42.53 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 111.937 -2.392 . . . . 0.0 115.967 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.4 m 56.25 -36.1 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -165.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.281 79.1 m80 -157.29 103.25 1.97 Allowed 'General case' 0 CA--C 1.566 1.565 0 N-CA-C 105.299 -2.111 . . . . 0.0 105.299 -178.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.98 156.88 41.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 120.093 -1.629 . . . . 0.0 114.53 169.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -60.57 136.26 58.0 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.435 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . . . -55.21 -53.84 50.96 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 -175.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HE2' ' HB3' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -54.32 -38.97 66.59 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 177.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.7 m -62.07 -52.02 65.63 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 176.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.557 ' HD3' ' HG2' ' A' ' 26' ' ' GLN . 3.6 mtm105 -56.82 -45.07 82.56 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -61.38 -35.71 78.24 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 113.141 -1.845 . . . . 0.0 114.039 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -75.63 -42.12 52.44 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 111.712 -2.494 . . . . 0.0 111.046 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.78 HG21 HG11 ' A' ' 23' ' ' VAL . 46.3 t -61.77 -48.37 88.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 125.347 1.459 . . . . 0.0 107.399 174.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -55.02 -41.33 71.18 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 128.105 2.562 . . . . 0.0 113.78 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.42 -51.04 61.08 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 111.698 -2.501 . . . . 0.0 111.447 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.29 -43.41 88.02 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 113.689 -1.596 . . . . 0.0 113.936 178.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.551 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -58.02 -47.55 82.74 Favored 'General case' 0 CA--C 1.598 2.805 0 C-N-CA 128.805 2.842 . . . . 0.0 111.297 -176.926 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.01 82.9 Favored 'General case' 0 C--N 1.318 -0.767 0 O-C-N 126.439 2.337 . . . . 0.0 111.771 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -65.99 -41.41 91.15 Favored 'General case' 0 CA--C 1.586 2.346 0 C-N-CA 126.447 1.899 . . . . 0.0 111.94 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.449 HD11 ' CB ' ' A' ' 12' ' ' TYR . 56.4 mt -88.54 13.21 12.54 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.689 1.996 . . . . 0.0 114.649 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.267 2.2 p-10 56.76 32.33 21.05 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-N 114.202 -1.363 . . . . 0.0 114.535 176.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.551 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 6.7 t80 -94.79 174.28 7.18 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 -175.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -147.92 115.76 4.08 Favored Pre-proline 0 CA--C 1.549 0.932 0 CA-C-O 118.367 -0.825 . . . . 0.0 109.138 -178.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -37.76 145.68 0.13 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 124.275 3.317 . . . . 0.0 114.402 -177.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 m120 36.79 37.68 0.07 Allowed 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 121.335 3.828 . . . . 0.0 121.335 -168.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.712 ' HD2' HE22 ' A' ' 54' ' ' GLN . 2.7 mmm180 -92.16 69.35 5.24 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.97 171.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.5 m -64.98 167.56 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.515 2.776 0 CA-C-N 112.517 -2.129 . . . . 0.0 111.005 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.65 113.8 1.98 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.994 -1.066 . . . . 0.0 113.307 171.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.712 HE22 ' HD2' ' A' ' 51' ' ' ARG . 42.2 mt-30 -127.17 -50.7 1.42 Allowed 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 113.287 -1.779 . . . . 0.0 110.549 -174.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.602 HE22 ' NH1' ' A' ' 51' ' ' ARG 0.265 7.0 mp0 -69.37 115.21 8.38 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 122.79 1.281 . . . . 0.0 114.37 166.898 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.4 tp . . . . . 0 CA--C 1.551 0.988 0 CA-C-N 112.859 -1.973 . . . . 0.0 114.608 -168.828 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.357 0 N-CA-C 118.312 2.708 . . . . 0.0 118.312 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.7 ' HB3' HE21 ' A' ' 55' ' ' GLN . 0.0 OUTLIER -165.52 5.51 0.0 OUTLIER Pre-proline 0 CA--C 1.562 1.408 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -174.81 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . 0.399 0.2 OUTLIER -1.73 -23.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.95 2 N-CA-C 126.923 5.701 . . . . 0.0 126.923 -130.266 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.428 ' H ' ' C ' ' A' ' 2' ' ' LYS 0.466 0.4 OUTLIER -143.84 148.83 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 127.052 2.141 . . . . 0.0 106.517 -172.228 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.258 1.6 p -68.94 90.71 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 106.202 -1.777 . . . . 0.0 106.202 179.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.9 mt -34.99 -14.86 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 -175.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -56.24 -29.94 61.72 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.183 0.901 . . . . 0.0 112.826 164.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -54.86 -50.56 68.36 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 168.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.41 -44.21 95.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 123.09 0.556 . . . . 0.0 111.889 175.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.1 -48.7 80.63 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.17 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -42.41 88.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.519 1.928 . . . . 0.0 114.902 176.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.47 ' CB ' HD11 ' A' ' 45' ' ' LEU . 41.6 t80 -66.52 -32.68 74.19 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.913 1.285 . . . . 0.0 111.434 177.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.63 -8.24 47.77 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.686 1.194 . . . . 0.0 111.674 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.59 20.53 79.83 Favored Glycine 0 N--CA 1.496 2.7 0 C-N-CA 126.92 2.2 . . . . 0.0 113.04 171.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.23 127.19 65.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.239 0.616 . . . . 0.0 112.253 -164.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -27.95 128.72 0.06 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 127.717 2.407 . . . . 0.0 110.53 176.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -42.81 -36.0 1.34 Allowed 'General case' 0 N--CA 1.521 3.111 0 C-N-CA 124.998 1.319 . . . . 0.0 114.111 177.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -51.18 -43.67 61.37 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.247 177.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . 46.9 p -59.19 -54.31 48.34 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 176.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.506 ' O ' HG23 ' A' ' 24' ' ' VAL . 87.5 t -61.33 -49.64 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 C-N-CA 125.248 1.419 . . . . 0.0 109.951 -172.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.0 p -53.54 -47.06 70.33 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.381 1.473 . . . . 0.0 113.674 -179.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -60.37 -45.66 92.74 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 110.754 -2.93 . . . . 0.0 116.985 171.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.645 HG21 HG21 ' A' ' 38' ' ' VAL . 94.4 t -62.55 -39.88 86.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.242 -178.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 20' ' ' VAL . 78.2 t -51.55 -55.09 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-N 113.312 -1.767 . . . . 0.0 112.486 -175.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.291 34.3 m120 -92.29 22.87 4.19 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 175.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.274 20.4 tt0 67.09 1.2 2.27 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 128.349 2.66 . . . . 0.0 117.433 171.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.21 35.81 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 111.675 -2.511 . . . . 0.0 116.827 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p 59.24 -43.95 0.07 Allowed 'General case' 0 N--CA 1.495 1.786 0 N-CA-C 117.97 2.582 . . . . 0.0 117.97 -167.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.274 69.3 m80 -152.49 103.59 2.83 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 104.614 -2.365 . . . . 0.0 104.614 -174.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.1 p -123.29 151.7 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 118.361 2.726 . . . . 0.0 118.361 171.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 p -67.48 145.93 54.48 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 -175.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.411 ' HB1' ' OE2' ' A' ' 36' ' ' GLU . . . -46.1 -73.87 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.569 ' H ' ' HE2' ' A' ' 33' ' ' LYS 0.292 0.0 OUTLIER -51.21 -28.9 12.56 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 119.832 3.271 . . . . 0.0 119.832 179.564 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 23.7 m -65.05 -56.97 9.96 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 175.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 mtm105 -55.35 -51.35 67.07 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.411 ' OE2' ' HB1' ' A' ' 32' ' ' ALA . 0.4 OUTLIER -54.65 -34.64 62.48 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 116.469 2.026 . . . . 0.0 116.469 -175.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -77.19 -51.06 11.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 111.347 -2.66 . . . . 0.0 111.806 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.645 HG21 HG21 ' A' ' 23' ' ' VAL . 48.5 t -58.8 -46.39 90.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 125.86 1.664 . . . . 0.0 108.177 -179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -59.0 -44.11 91.61 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.147 2.179 . . . . 0.0 116.208 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.9 -50.01 70.41 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 112.626 -2.079 . . . . 0.0 110.511 174.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.15 -37.88 75.53 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-N 112.283 -2.235 . . . . 0.0 114.866 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 35.0 mtt -59.56 -51.29 70.47 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.21 -40.38 95.91 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 112.43 -2.168 . . . . 0.0 111.818 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.13 -41.07 95.15 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.783 -2.008 . . . . 0.0 113.495 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.47 HD11 ' CB ' ' A' ' 12' ' ' TYR . 63.1 mt -98.94 25.14 6.93 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 127.031 2.132 . . . . 0.0 112.24 -175.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 60.41 21.12 10.75 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 117.698 2.481 . . . . 0.0 117.698 173.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -87.93 159.64 18.26 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.518 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.21 104.9 7.21 Favored Pre-proline 0 N--CA 1.478 0.944 0 CA-C-N 112.347 -2.206 . . . . 0.0 108.504 -171.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.502 ' O ' ' HB2' ' A' ' 50' ' ' ASN . 12.3 Cg_exo -36.14 109.61 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.68 1 C-N-CA 125.771 4.314 . . . . 0.0 113.499 -173.479 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.502 ' HB2' ' O ' ' A' ' 49' ' ' PRO . 0.2 OUTLIER 134.35 -53.28 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 C-N-CA 127.512 2.325 . . . . 0.0 113.904 157.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -4.82 89.68 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 127.129 2.172 . . . . 0.0 111.294 161.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.3 m -63.28 142.83 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -148.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.72 75.12 3.38 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 124.232 1.968 . . . . 0.0 113.627 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -119.12 -47.82 2.46 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 111.521 -2.581 . . . . 0.0 108.746 177.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.7 HE21 ' HB3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -90.86 84.4 5.81 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-O 124.265 1.983 . . . . 0.0 110.655 172.236 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.657 ' H ' HD12 ' A' ' 56' ' ' LEU . 1.3 mp . . . . . 0 N--CA 1.48 1.026 0 CA-C-N 110.535 -3.03 . . . . 0.0 115.461 -157.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.451 ' HB2' ' HG3' ' A' ' 55' ' ' GLN . 91.7 mtp . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 116.182 1.919 . . . . 0.0 116.182 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.758 ' HB2' ' HG2' ' A' ' 55' ' ' GLN . 11.9 mttm -164.51 -170.06 0.23 Allowed Pre-proline 0 CA--C 1.562 1.437 0 CA-C-O 116.44 -1.743 . . . . 0.0 110.244 175.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -58.13 94.49 0.07 OUTLIER 'Trans proline' 0 C--N 1.359 1.102 0 CA-C-N 122.674 1.991 . . . . 0.0 109.335 153.084 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.429 0.4 OUTLIER 68.96 112.61 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 127.403 2.281 . . . . 0.0 112.765 165.554 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -77.31 145.26 37.5 Favored 'General case' 0 CA--C 1.556 1.204 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 -169.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.607 HD12 HH22 ' A' ' 51' ' ' ARG . 14.2 mt -61.92 0.92 0.32 Allowed 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 121.429 3.863 . . . . 0.0 121.429 -155.236 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -58.37 -38.18 76.76 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 119.539 1.063 . . . . 0.0 110.997 174.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.435 ' OD1' HD22 ' A' ' 45' ' ' LEU . 4.6 t70 -61.69 -46.96 87.48 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 114.935 -1.03 . . . . 0.0 113.14 173.566 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.23 -45.36 96.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.463 1.105 . . . . 0.0 112.827 174.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.458 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -55.12 -54.0 48.74 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.026 2.13 . . . . 0.0 112.35 176.247 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.28 -37.96 86.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.126 1.371 . . . . 0.0 114.266 177.855 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -67.98 -34.41 76.49 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 123.505 0.503 . . . . 0.0 110.317 179.34 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.57 -19.55 27.67 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.277 178.583 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.56 29.17 53.49 Favored Glycine 0 N--CA 1.486 2.016 0 C-N-CA 127.007 2.241 . . . . 0.0 113.704 174.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.296 8.5 p -130.21 130.58 65.76 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.623 0 C-N-CA 123.563 0.745 . . . . 0.0 109.12 -175.706 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.6 p -44.29 142.17 1.61 Allowed 'General case' 0 N--CA 1.506 2.368 0 C-N-CA 128.658 2.783 . . . . 0.0 110.381 -173.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.483 ' CE1' ' HB2' ' A' ' 6' ' ' LEU . 74.3 t80 -48.84 -47.94 42.15 Favored 'General case' 0 N--CA 1.521 3.078 0 N-CA-C 117.489 2.403 . . . . 0.0 117.489 -170.105 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.424 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.558 0.0 OUTLIER -56.57 -25.34 52.1 Favored 'General case' 0 C--N 1.322 -0.607 1 N-CA-C 124.359 4.948 . . . . 0.0 124.359 179.835 . . . . . . . . 5 4 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.55 ' O ' HG23 ' A' ' 23' ' ' VAL . 5.1 m -58.13 -53.13 61.74 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 111.608 -2.542 . . . . 0.0 111.512 165.501 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.558 ' O ' HG23 ' A' ' 24' ' ' VAL . 95.0 t -63.77 -49.57 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.46 -169.462 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.431 ' HA ' HH12 ' A' ' 51' ' ' ARG 0.446 1.0 OUTLIER -58.32 -37.95 76.14 Favored 'General case' 0 CA--C 1.466 -2.278 0 N-CA-C 119.106 3.002 . . . . 0.0 119.106 176.247 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.55 ' HG3' HH11 ' A' ' 22' ' ' ARG . 2.5 mtt85 -63.54 -44.38 94.35 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 110.412 -3.086 . . . . 0.0 114.78 169.012 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.678 HG11 HG21 ' A' ' 38' ' ' VAL . 99.4 t -61.19 -42.87 95.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 114.091 -1.413 . . . . 0.0 110.342 -176.6 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 20' ' ' VAL . 96.5 t -54.88 -50.01 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 112.899 -1.955 . . . . 0.0 112.395 -168.292 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -91.72 17.48 8.89 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 171.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.454 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.4 OUTLIER 67.49 11.74 8.53 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 128.99 2.916 . . . . 0.0 114.85 172.326 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.9 40.03 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 127.723 2.409 . . . . 0.0 116.441 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.6 p 57.91 -34.67 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 118.076 2.621 . . . . 0.0 118.076 -160.227 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -157.6 99.32 1.72 Allowed 'General case' 0 CA--C 1.564 1.487 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -168.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.454 HG12 ' OE1' ' A' ' 26' ' ' GLN 0.258 4.6 p -137.96 152.88 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 N-CA-C 116.854 2.168 . . . . 0.0 116.854 175.551 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.5 p -61.29 145.32 51.8 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 118.86 2.911 . . . . 0.0 118.86 -173.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.36 -63.83 1.0 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.574 1.949 . . . . 0.0 113.359 -177.323 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 33' ' ' LYS 0.254 11.6 tptp -56.96 -42.01 79.35 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.885 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.6 m -57.82 -50.49 73.09 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 113.344 -1.753 . . . . 0.0 108.054 178.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.56 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 15.8 mtm105 -57.05 -48.88 77.47 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 174.567 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -60.47 -34.47 74.07 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 113.708 -1.587 . . . . 0.0 114.896 -176.199 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -78.47 -43.19 27.72 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.212 2.205 . . . . 0.0 111.001 -179.434 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.678 HG21 HG11 ' A' ' 23' ' ' VAL . 81.3 t -63.24 -46.79 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.095 174.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 31.9 mt-10 -52.76 -45.51 67.12 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 126.452 1.901 . . . . 0.0 111.966 179.083 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.56 -52.5 60.8 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 110.582 -3.008 . . . . 0.0 111.037 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.33 -52.16 65.82 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 112.85 -1.977 . . . . 0.0 115.674 178.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.543 ' HB2' ' HB3' ' A' ' 47' ' ' TYR 0.264 0.0 OUTLIER -59.98 -33.32 71.8 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 116.702 2.112 . . . . 0.0 116.702 -178.111 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.91 -50.62 63.82 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.542 179.471 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -62.76 -33.77 75.85 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.521 -179.58 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.435 HD22 ' OD1' ' A' ' 8' ' ' ASP . 62.0 mt -99.14 14.64 28.66 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 127.425 2.29 . . . . 0.0 116.951 -177.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.353 0.2 OUTLIER 54.48 19.33 2.31 Favored 'General case' 0 CA--C 1.565 1.534 0 C-N-CA 127.127 2.171 . . . . 0.0 116.776 176.309 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.543 ' HB3' ' HB2' ' A' ' 42' ' ' MET . 62.3 t80 -82.99 95.4 8.0 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 -177.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.518 HD12 ' OD1' ' A' ' 50' ' ' ASN . 0.4 OUTLIER -51.67 124.32 26.08 Favored Pre-proline 0 N--CA 1.484 1.273 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 172.509 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -68.43 71.35 0.95 Allowed 'Trans proline' 0 CA--C 1.55 1.316 0 C-N-CA 122.972 2.448 . . . . 0.0 112.832 176.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.518 ' OD1' HD12 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -160.51 58.42 0.33 Allowed 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 123.467 1.603 . . . . 0.0 115.239 170.847 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.607 HH22 HD12 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -63.8 96.46 0.13 Allowed 'General case' 0 C--O 1.242 0.693 0 O-C-N 119.619 -1.926 . . . . 0.0 115.65 -160.961 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.639 HG22 ' HE2' ' A' ' 2' ' ' LYS . 8.4 m -69.6 68.52 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 126.864 2.066 . . . . 0.0 108.456 -174.628 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 98.71 -175.32 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 C-N-CA 128.048 2.539 . . . . 0.0 106.2 -176.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.588 ' HA ' ' HE ' ' A' ' 51' ' ' ARG . 30.3 tt0 -87.88 94.48 9.78 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 120.995 -1.066 . . . . 0.0 109.959 -175.959 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.758 ' HG2' ' HB2' ' A' ' 2' ' ' LYS 0.337 21.7 mp0 -54.7 86.06 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 117.914 2.561 . . . . 0.0 117.914 165.921 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 CA--C 1.542 0.654 0 CA-C-N 110.876 -2.875 . . . . 0.0 114.561 -178.085 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.609 ' HB2' ' HA ' ' A' ' 5' ' ' THR . 19.1 ptp . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.486 ' HB3' ' HD3' ' A' ' 3' ' ' PRO 0.26 43.8 tptt -69.28 -48.42 26.13 Favored Pre-proline 0 N--CA 1.489 1.521 0 CA-C-O 117.484 -1.246 . . . . 0.0 113.743 -175.17 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.486 ' HD3' ' HB3' ' A' ' 2' ' ' LYS . 45.5 Cg_exo -63.5 -27.18 70.09 Favored 'Trans proline' 0 N--CA 1.486 1.083 0 C-N-CA 122.651 2.234 . . . . 0.0 117.13 173.019 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.331 0.3 OUTLIER -170.9 143.87 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.473 1.509 . . . . 0.0 108.795 -173.43 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.643 HG23 HE22 ' A' ' 55' ' ' GLN . 2.5 p -75.85 120.63 21.47 Favored 'General case' 0 CA--C 1.573 1.858 0 CA-C-N 120.878 1.672 . . . . 0.0 109.246 176.395 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.412 HD22 HG12 ' A' ' 20' ' ' VAL . 15.8 mt -31.35 -28.82 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.88 0 N-CA-C 121.27 3.804 . . . . 0.0 121.27 -178.215 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -54.2 -37.06 64.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.414 0.686 . . . . 0.0 109.152 173.353 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.463 ' OD2' HD22 ' A' ' 45' ' ' LEU . 21.7 t70 -60.58 -41.32 94.41 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 118.555 -0.736 . . . . 0.0 111.791 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 62.0 t -62.45 -50.82 78.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 170.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -48.75 -48.89 40.46 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.986 1.315 . . . . 0.0 112.19 175.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.54 -44.42 70.98 Favored 'General case' 0 C--N 1.316 -0.861 1 C-N-CA 132.539 4.335 . . . . 0.0 113.49 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.428 ' CB ' HD11 ' A' ' 45' ' ' LEU . 54.3 t80 -63.97 -34.59 78.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.022 0.929 . . . . 0.0 110.538 174.031 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.02 -12.5 38.39 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.522 -177.282 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.58 28.87 66.63 Favored Glycine 0 N--CA 1.495 2.599 0 C-N-CA 125.981 1.753 . . . . 0.0 113.82 177.115 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.405 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 9.3 p -124.85 142.22 42.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-O 122.49 1.138 . . . . 0.0 110.167 -170.409 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.5 p -55.82 128.69 36.18 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 129.328 3.051 . . . . 0.0 107.442 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -53.2 -31.67 44.19 Favored 'General case' 0 N--CA 1.509 2.487 0 N-CA-C 118.125 2.639 . . . . 0.0 118.125 -167.035 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.8 tp60 -49.2 -44.56 43.25 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 117.354 -1.307 . . . . 0.0 113.827 175.626 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.637 ' O ' HG23 ' A' ' 23' ' ' VAL . 44.7 p -52.59 -48.82 66.01 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 124.018 0.824 . . . . 0.0 112.548 178.376 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.67 ' O ' HG23 ' A' ' 24' ' ' VAL . 85.4 t -68.46 -52.1 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 113.802 -1.545 . . . . 0.0 110.187 -174.925 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.8 m -59.05 -32.01 69.37 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' A' ' 19' ' ' THR . 23.9 mtp85 -65.53 -46.98 77.47 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 111.26 -2.7 . . . . 0.0 113.937 170.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.773 HG21 HG21 ' A' ' 38' ' ' VAL . 92.7 t -58.59 -43.88 88.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.595 1.558 . . . . 0.0 108.018 -178.574 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 20' ' ' VAL . 58.1 t -55.45 -47.76 77.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.161 0 CA-C-N 111.951 -2.386 . . . . 0.0 111.54 -173.336 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.424 HD21 ' CZ ' ' A' ' 51' ' ' ARG . 10.2 m120 -95.67 13.88 24.89 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 176.159 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 62.23 16.9 8.8 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 116.605 2.076 . . . . 0.0 116.605 179.027 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.462 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . . . 36.48 22.77 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 110.582 -3.008 . . . . 0.0 118.22 178.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 t 63.69 -51.76 0.24 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 125.121 1.369 . . . . 0.0 112.346 -160.66 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -138.16 109.67 7.0 Favored 'General case' 0 CA--C 1.56 1.328 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 178.323 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.869 HG11 HH11 ' A' ' 35' ' ' ARG . 4.6 p -124.06 144.03 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.34 0 O-C-N 120.309 -1.494 . . . . 0.0 113.243 179.53 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.4 p -71.02 137.74 49.29 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 177.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -50.79 72.36 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -178.187 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.468 ' O ' ' HG2' ' A' ' 36' ' ' GLU 0.302 0.0 OUTLIER -59.57 -28.62 67.3 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 118.164 2.654 . . . . 0.0 118.164 177.545 . . . . . . . . 4 4 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.7 m -67.24 -50.28 61.24 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 112.585 -2.098 . . . . 0.0 107.567 174.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.869 HH11 HG11 ' A' ' 30' ' ' VAL . 13.6 mtp85 -59.06 -42.68 90.9 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 115.86 1.8 . . . . 0.0 115.86 179.58 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 3.2 pt-20 -58.98 -35.23 72.84 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 113.659 -1.609 . . . . 0.0 113.956 -177.968 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -76.95 -44.23 32.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 110.991 -2.822 . . . . 0.0 112.529 -176.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.773 HG21 HG21 ' A' ' 23' ' ' VAL . 42.7 t -64.66 -46.34 92.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 112.305 -2.225 . . . . 0.0 108.967 177.292 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -56.54 -42.18 78.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.824 2.85 . . . . 0.0 111.272 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.0 69.29 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.513 -1.676 . . . . 0.0 111.47 174.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.47 91.88 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 113.432 -1.713 . . . . 0.0 115.203 176.958 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.82 -44.53 93.99 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -178.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.3 -46.4 88.92 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 124.495 1.122 . . . . 0.0 112.446 178.661 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -61.99 -39.55 92.6 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.592 -2.094 . . . . 0.0 113.803 177.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.463 HD22 ' OD2' ' A' ' 8' ' ' ASP . 26.2 mt -90.21 15.83 9.65 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.601 1.56 . . . . 0.0 114.201 178.225 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 49.62 31.56 4.34 Favored 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 127.189 2.196 . . . . 0.0 112.6 176.895 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.478 ' OH ' ' HB3' ' A' ' 51' ' ' ARG . 10.4 t80 -97.52 139.91 32.74 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-O 122.863 1.316 . . . . 0.0 108.773 -165.657 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.327 0.0 OUTLIER -90.19 100.83 2.87 Favored Pre-proline 0 N--CA 1.478 0.971 0 CA-C-N 110.807 -2.906 . . . . 0.0 114.5 176.277 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.412 ' O ' HG13 ' A' ' 24' ' ' VAL . 19.9 Cg_exo -26.26 -73.21 0.03 OUTLIER 'Trans proline' 0 N--CA 1.484 0.962 1 C-N-CA 126.127 4.551 . . . . 0.0 116.966 -174.662 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -88.31 32.95 0.75 Allowed 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 118.763 2.875 . . . . 0.0 118.763 -168.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.504 ' HG3' HE21 ' A' ' 54' ' ' GLN . 15.9 ptt-85 26.2 89.65 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 127.57 2.348 . . . . 0.0 116.486 179.683 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.7 m -86.47 46.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 120.699 -1.25 . . . . 0.0 110.901 -174.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 134.64 143.87 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 C-N-CA 130.115 3.366 . . . . 0.0 106.855 -164.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.504 HE21 ' HG3' ' A' ' 51' ' ' ARG . 16.8 mp0 -127.07 145.77 50.61 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 114.056 -1.429 . . . . 0.0 109.31 175.941 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.643 HE22 HG23 ' A' ' 5' ' ' THR 0.276 5.0 pp0? -118.95 90.34 3.31 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 113.098 -1.865 . . . . 0.0 109.665 162.235 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 N--CA 1.491 1.612 0 CA-C-N 108.755 -3.839 . . . . 0.0 114.72 -171.149 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 2' ' ' LYS . 10.2 mmt . . . . . 0 CA--C 1.548 0.895 0 N-CA-C 118.879 2.918 . . . . 0.0 118.879 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 1' ' ' MET . 43.7 mttp 177.71 143.23 0.27 Allowed Pre-proline 0 N--CA 1.491 1.61 0 C-N-CA 126.353 1.861 . . . . 0.0 108.272 -174.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -79.55 -16.88 11.6 Favored 'Trans proline' 0 N--CA 1.485 1.009 0 N-CA-C 118.599 2.499 . . . . 0.0 118.599 158.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.442 0.5 OUTLIER -153.59 146.36 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 -174.853 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.294 1.3 p -68.62 100.48 1.13 Allowed 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 105.32 -2.104 . . . . 0.0 105.32 -179.261 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.413 HD21 ' CE2' ' A' ' 47' ' ' TYR . 21.2 mt -43.86 -14.26 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.73 0 N-CA-C 117.602 2.445 . . . . 0.0 117.602 -176.449 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.418 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 2.3 m-30 -55.93 -35.45 66.65 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.019 0.527 . . . . 0.0 110.334 165.909 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.475 ' OD2' HD22 ' A' ' 45' ' ' LEU . 32.6 t70 -59.0 -47.64 84.46 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.8 0.84 . . . . 0.0 113.08 174.395 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.8 t -59.31 -45.86 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 172.104 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.05 -48.07 81.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 112.348 -2.205 . . . . 0.0 112.123 -177.358 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.418 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.5 OUTLIER -67.53 -42.2 83.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.221 2.208 . . . . 0.0 115.453 177.038 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.4 ' CB ' HD11 ' A' ' 45' ' ' LEU . 46.5 t80 -64.79 -33.05 75.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 124.017 0.823 . . . . 0.0 110.712 177.379 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.12 -16.43 24.93 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.397 -179.768 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.36 25.35 68.48 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 126.747 2.118 . . . . 0.0 113.479 173.558 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.437 HG22 HG21 ' A' ' 19' ' ' THR . 5.4 p -126.0 111.32 26.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 123.445 0.698 . . . . 0.0 110.197 -167.264 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 91.7 p -16.83 135.65 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.19 0 C-N-CA 127.889 2.476 . . . . 0.0 111.724 179.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.309 31.6 t80 -47.83 -53.29 16.0 Favored 'General case' 0 N--CA 1.521 3.086 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 -175.763 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.579 HE21 ' CZ ' ' A' ' 22' ' ' ARG 0.366 0.0 OUTLIER -58.44 -24.77 61.1 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 120.961 3.689 . . . . 0.0 120.961 179.593 . . . . . . . . 4 4 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 94.6 m -56.1 -50.21 71.67 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-N 113.506 -1.679 . . . . 0.0 109.233 165.255 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 24' ' ' VAL 0.297 79.9 t -65.5 -43.65 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-O 118.542 -0.742 . . . . 0.0 110.733 -177.126 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.89 81.58 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.034 0.834 . . . . 0.0 112.446 -177.54 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.579 ' CZ ' HE21 ' A' ' 18' ' ' GLN . 18.9 mtt85 -61.37 -45.97 92.13 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 116.013 1.857 . . . . 0.0 116.013 169.168 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.608 HG21 HG21 ' A' ' 38' ' ' VAL . 70.1 t -59.86 -41.25 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 125.019 1.328 . . . . 0.0 108.458 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 20' ' ' VAL . 82.3 t -53.27 -49.87 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 113.687 -1.597 . . . . 0.0 112.665 -171.115 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -92.09 14.34 16.26 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 171.61 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.526 ' OE1' HG12 ' A' ' 30' ' ' VAL . 0.3 OUTLIER 60.02 21.08 10.21 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 127.971 2.508 . . . . 0.0 113.823 178.072 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.17 45.16 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 111.674 -2.512 . . . . 0.0 116.574 -175.192 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.2 t 64.09 -57.36 0.22 Allowed 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 125.959 1.704 . . . . 0.0 111.929 -163.589 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -146.08 104.86 3.86 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 125.858 1.663 . . . . 0.0 107.646 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.526 HG12 ' OE1' ' A' ' 26' ' ' GLN . 9.8 p -113.51 157.61 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 120.891 1.678 . . . . 0.0 114.453 177.311 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -60.81 121.01 11.24 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.647 0.737 . . . . 0.0 112.913 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -41.24 -62.62 0.81 Allowed 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 16.8 tptp -43.3 -43.13 4.78 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 179.529 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -59.85 -52.42 65.53 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 179.05 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.2 mtm105 -54.43 -47.67 72.56 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.575 1.695 . . . . 0.0 115.575 177.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.46 -36.5 69.12 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -176.635 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -76.72 -42.12 42.56 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 111.354 -2.657 . . . . 0.0 111.364 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.608 HG21 HG21 ' A' ' 23' ' ' VAL . 60.5 t -64.98 -49.53 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 C-N-CA 125.892 1.677 . . . . 0.0 108.029 176.379 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -52.54 -40.4 62.46 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 128.54 2.736 . . . . 0.0 112.875 179.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.51 -52.98 55.04 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 112.3 -2.227 . . . . 0.0 111.663 173.544 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.98 86.04 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 113.404 -1.725 . . . . 0.0 114.254 177.484 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.97 -45.48 86.66 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.501 1.92 . . . . 0.0 115.947 -177.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.83 -46.39 82.15 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 112.721 -2.036 . . . . 0.0 112.563 177.135 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.84 -35.44 80.67 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 111.964 -2.38 . . . . 0.0 113.926 -174.893 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.475 HD22 ' OD2' ' A' ' 8' ' ' ASP . 46.4 mt -91.56 18.39 7.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.528 1.931 . . . . 0.0 113.96 179.936 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.42 0.2 OUTLIER 52.03 36.96 20.03 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.789 1.235 . . . . 0.0 113.876 178.537 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.413 ' CE2' HD21 ' A' ' 6' ' ' LEU . 11.1 t80 -100.41 175.64 5.63 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -172.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.75 107.53 4.67 Favored Pre-proline 0 N--CA 1.478 0.932 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -176.578 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.537 ' O ' HG13 ' A' ' 24' ' ' VAL 0.318 0.0 OUTLIER -5.12 -60.25 0.0 OUTLIER 'Trans proline' 0 N--CA 1.481 0.756 1 C-N-CA 126.362 4.708 . . . . 0.0 120.472 -173.805 . . . . . . . . 5 4 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.625 HD21 ' NH2' ' A' ' 51' ' ' ARG . 12.5 t-20 -123.61 94.01 4.11 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 117.264 2.32 . . . . 0.0 117.264 -179.592 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.625 ' NH2' HD21 ' A' ' 50' ' ' ASN 0.42 1.5 tmm_? 36.82 -155.96 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 116.215 -1.85 . . . . 0.0 110.489 126.882 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.601 HG13 ' HB2' ' A' ' 54' ' ' GLN . 9.8 p 97.49 126.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 117.495 -3.253 . . . . 0.0 111.486 145.62 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -57.08 70.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 123.843 1.782 . . . . 0.0 115.372 168.146 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.601 ' HB2' HG13 ' A' ' 52' ' ' VAL . 41.9 mt-30 -148.4 -39.27 0.17 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 128.742 2.817 . . . . 0.0 110.8 176.054 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.484 0.0 OUTLIER -79.8 98.19 6.95 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 122.599 1.19 . . . . 0.0 113.156 170.62 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 45.8 mt . . . . . 0 N--CA 1.482 1.168 0 CA-C-N 110.406 -3.088 . . . . 0.0 114.238 -173.764 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.7 ptt? . . . . . 0 N--CA 1.487 1.382 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.504 ' HB3' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -126.45 111.01 23.26 Favored Pre-proline 0 CA--C 1.556 1.201 0 CA-C-O 116.306 -1.807 . . . . 0.0 106.169 178.274 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -72.85 132.6 18.72 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 CA-C-N 121.907 1.717 . . . . 0.0 111.219 172.932 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.36 0.5 OUTLIER 63.34 144.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 C-N-CA 129.103 2.961 . . . . 0.0 109.866 175.498 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.301 2.8 p -73.07 99.22 2.72 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.6 mt -41.0 -14.4 0.01 OUTLIER 'General case' 0 N--CA 1.527 3.401 0 N-CA-C 118.546 2.795 . . . . 0.0 118.546 -176.956 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.502 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 56.2 m-85 -54.62 -33.17 60.06 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 119.096 0.862 . . . . 0.0 111.071 165.338 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.441 ' OD2' HD22 ' A' ' 45' ' ' LEU . 15.0 t70 -59.13 -48.82 80.2 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 118.408 -0.806 . . . . 0.0 113.09 173.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 68.6 t -58.05 -44.26 86.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 173.358 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.88 -51.22 70.62 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 112.029 -2.351 . . . . 0.0 111.531 -177.261 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.502 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.1 -39.57 86.77 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.515 1.926 . . . . 0.0 114.282 176.894 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -66.34 -36.35 82.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-O 122.236 1.017 . . . . 0.0 110.881 179.052 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.61 -15.15 40.67 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 113.198 -1.819 . . . . 0.0 110.856 178.694 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.45 26.65 60.89 Favored Glycine 0 CA--C 1.544 1.888 0 C-N-CA 126.936 2.208 . . . . 0.0 113.128 170.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -124.36 128.75 73.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.25 0.62 . . . . 0.0 110.655 -167.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.72 ' HB2' HE22 ' A' ' 18' ' ' GLN . 74.7 p -33.08 122.14 0.38 Allowed 'General case' 0 N--CA 1.514 2.725 0 C-N-CA 127.445 2.298 . . . . 0.0 109.13 175.288 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.317 41.8 t80 -40.92 -47.8 3.04 Favored 'General case' 0 N--CA 1.522 3.147 0 N-CA-C 117.628 2.455 . . . . 0.0 117.628 -175.873 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.72 HE22 ' HB2' ' A' ' 16' ' ' SER 0.403 0.0 OUTLIER -57.53 -16.99 11.52 Favored 'General case' 0 C--N 1.32 -0.681 1 N-CA-C 122.073 4.101 . . . . 0.0 122.073 179.108 . . . . . . . . 5 4 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 23' ' ' VAL . 69.0 p -64.96 -52.61 55.34 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 114.203 -1.362 . . . . 0.0 112.866 162.014 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.677 ' O ' HG23 ' A' ' 24' ' ' VAL 0.27 73.7 t -60.99 -47.6 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.204 -171.39 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 p -57.12 -42.58 81.13 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 122.775 1.274 . . . . 0.0 112.411 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.425 ' NH1' ' HB2' ' A' ' 18' ' ' GLN . 17.1 mtt85 -67.7 -38.97 84.37 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 119.773 3.249 . . . . 0.0 119.773 173.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.813 HG11 HG21 ' A' ' 38' ' ' VAL . 24.7 t -55.11 -46.62 77.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 127.237 2.215 . . . . 0.0 107.979 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.677 HG23 ' O ' ' A' ' 20' ' ' VAL . 98.2 t -55.7 -46.81 79.67 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 110.974 -2.83 . . . . 0.0 111.239 -168.006 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.282 13.8 m120 -99.07 26.81 5.52 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.87 -1.513 . . . . 0.0 114.437 176.65 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.454 ' C ' ' H ' ' A' ' 28' ' ' SER . 17.5 pt20 49.29 44.54 23.52 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-O 123.809 1.766 . . . . 0.0 112.905 171.543 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . 0.296 . . -72.87 36.15 0.08 Allowed 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 110.211 -3.177 . . . . 0.0 118.858 -176.501 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.454 ' H ' ' C ' ' A' ' 26' ' ' GLN . 4.7 m 4.83 93.99 0.01 OUTLIER 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 108.854 -3.794 . . . . 0.0 117.902 176.617 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 30.7 m80 171.89 -68.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 102.67 -3.085 . . . . 0.0 102.67 -167.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -25.16 101.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.328 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 129.1 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 86.1 p -100.6 156.29 17.39 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 112.234 -2.257 . . . . 0.0 114.811 -177.048 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -15.21 -63.38 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.403 1.881 . . . . 0.0 115.28 167.646 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.82 -51.85 12.19 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 176.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 38' ' ' VAL . 76.3 m -59.56 -51.45 69.77 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.481 1.512 . . . . 0.0 107.012 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.495 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -54.87 -43.3 73.02 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.139 2.274 . . . . 0.0 117.139 -179.762 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.86 -39.4 85.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 113.309 -1.769 . . . . 0.0 114.744 176.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -79.11 -40.84 30.06 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 113.079 -1.873 . . . . 0.0 112.072 -177.487 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.813 HG21 HG11 ' A' ' 23' ' ' VAL . 44.7 t -61.17 -47.56 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.74 1.616 . . . . 0.0 106.771 172.706 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 53.2 mt-10 -55.73 -44.68 77.76 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.344 2.258 . . . . 0.0 111.499 -178.585 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.99 -51.7 65.83 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 112.658 -2.065 . . . . 0.0 110.925 177.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.68 -40.7 80.01 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 113.205 -1.816 . . . . 0.0 113.603 176.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.2 mtt -58.25 -48.97 78.74 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 -176.0 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -43.4 94.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.101 -2.318 . . . . 0.0 112.875 177.599 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -64.13 -34.47 78.12 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-N 112.332 -2.213 . . . . 0.0 113.684 -177.533 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.441 HD22 ' OD2' ' A' ' 8' ' ' ASP . 47.0 mt -94.48 18.0 12.08 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.867 1.667 . . . . 0.0 113.042 -178.486 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 56.69 21.41 5.85 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.693 2.397 . . . . 0.0 113.043 178.341 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -89.79 157.43 17.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -170.294 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.55 ' HA ' ' HD3' ' A' ' 49' ' ' PRO 0.429 24.5 mm -118.86 113.84 35.78 Favored Pre-proline 0 CA--C 1.535 0.396 1 N-CA-C 121.921 4.045 . . . . 0.0 121.921 178.112 . . . . . . . . 4 3 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.567 ' O ' HG13 ' A' ' 24' ' ' VAL 0.375 0.1 OUTLIER -12.97 -55.91 0.01 OUTLIER 'Trans proline' 0 N--CA 1.481 0.76 1 C-N-CA 127.791 5.661 . . . . 0.0 121.733 -164.901 . . . . . . . . 5 4 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -112.81 36.1 3.61 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 120.266 3.432 . . . . 0.0 120.266 -169.295 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 52' ' ' VAL . 7.6 mmp_? -114.12 104.73 12.41 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 114.656 -1.156 . . . . 0.0 113.152 -162.07 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 51' ' ' ARG . 7.4 p -133.49 121.99 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 125.68 1.592 . . . . 0.0 111.288 1.59 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.62 83.24 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.596 0 CA-C-O 123.71 1.719 . . . . 0.0 112.111 166.859 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.43 ' HB3' HG13 ' A' ' 52' ' ' VAL . 41.6 tt0 -176.85 -65.49 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 111.491 -2.595 . . . . 0.0 110.168 -169.55 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -139.82 86.45 2.1 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 113.48 -1.691 . . . . 0.0 107.396 174.704 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.589 HD11 HG11 ' A' ' 24' ' ' VAL . 23.0 tp . . . . . 0 N--CA 1.48 1.067 1 CA-C-N 108.102 -4.135 . . . . 0.0 112.123 -155.282 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.584 ' HA ' ' HA ' ' A' ' 53' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 118.705 2.854 . . . . 0.0 118.705 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -165.72 165.18 11.27 Favored Pre-proline 0 CA--C 1.561 1.382 0 C-N-CA 127.107 2.163 . . . . 0.0 108.38 -177.015 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -74.87 -44.16 0.37 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 C-N-CA 122.586 2.191 . . . . 0.0 111.06 172.41 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.415 0.4 OUTLIER -144.8 148.92 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 127.374 2.269 . . . . 0.0 109.669 177.368 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.3 p -91.54 145.66 24.43 Favored 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.3 -165.521 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.473 HD22 HG12 ' A' ' 20' ' ' VAL . 8.2 mt -45.71 -27.88 0.9 Allowed 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 118.867 2.914 . . . . 0.0 118.867 -170.384 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -59.58 -39.61 84.7 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.816 0.735 . . . . 0.0 111.744 176.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -55.5 -48.31 74.81 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 171.121 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.0 t -60.0 -40.62 83.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 174.317 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.406 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -60.15 -50.54 73.29 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 113.643 -1.617 . . . . 0.0 113.201 177.563 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.69 -39.35 88.08 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.993 1.717 . . . . 0.0 113.72 177.212 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.403 ' CB ' HD11 ' A' ' 45' ' ' LEU . 36.5 t80 -67.27 -34.97 78.53 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.572 0.749 . . . . 0.0 111.212 177.479 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.42 -14.91 44.76 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.104 177.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.91 29.46 54.38 Favored Glycine 0 N--CA 1.481 1.659 0 C-N-CA 126.124 1.821 . . . . 0.0 112.655 170.831 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -132.4 134.37 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.981 0 CA-C-O 122.202 1.001 . . . . 0.0 109.651 -168.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.5 p -41.21 130.88 2.79 Favored 'General case' 0 N--CA 1.511 2.578 0 C-N-CA 128.135 2.574 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.414 ' HE1' ' HB2' ' A' ' 6' ' ' LEU . 85.9 t80 -51.95 -29.54 20.88 Favored 'General case' 0 N--CA 1.51 2.528 0 N-CA-C 119.586 3.18 . . . . 0.0 119.586 -174.524 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -49.31 -41.52 38.59 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 116.479 -1.724 . . . . 0.0 113.374 172.889 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 22' ' ' ARG . 43.5 p -63.22 -53.85 46.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 176.378 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.726 ' O ' HG23 ' A' ' 24' ' ' VAL . 82.4 t -62.38 -48.18 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 123.831 0.852 . . . . 0.0 110.207 -173.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.0 p -57.81 -42.45 84.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 116.609 2.078 . . . . 0.0 116.609 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 19' ' ' THR . 30.2 mtp85 -62.01 -45.59 92.91 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 109.995 -3.275 . . . . 0.0 115.157 171.212 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.562 HG11 HG21 ' A' ' 38' ' ' VAL . 14.3 t -54.92 -48.31 74.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 127.405 2.282 . . . . 0.0 109.657 179.253 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.726 HG23 ' O ' ' A' ' 20' ' ' VAL . 48.3 t -57.26 -48.68 81.89 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 CA-C-N 109.945 -3.298 . . . . 0.0 112.937 -166.826 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.474 HD21 ' NH2' ' A' ' 51' ' ' ARG 0.301 21.2 m120 -108.54 33.44 4.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.756 -1.565 . . . . 0.0 114.9 176.364 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 73.51 -5.49 1.97 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 128.902 2.881 . . . . 0.0 118.619 167.053 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 39.15 30.02 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.814 2.446 . . . . 0.0 115.266 -175.785 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.6 p 55.21 -44.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 -148.448 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.272 77.9 m80 -153.8 131.96 11.85 Favored 'General case' 0 CA--C 1.556 1.189 0 CA-C-O 117.64 -1.171 . . . . 0.0 109.875 -175.986 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.9 t -150.98 143.19 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.847 1.658 . . . . 0.0 113.887 159.244 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 p -23.34 131.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 119.387 3.106 . . . . 0.0 119.387 166.123 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 35' ' ' ARG . . . -66.45 -47.43 73.17 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.945 0.898 . . . . 0.0 112.791 -176.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.63 -38.93 15.76 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 176.226 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -61.78 -49.61 75.65 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 125.931 1.692 . . . . 0.0 107.653 175.995 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.565 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 12.5 mmt85 -58.18 -46.77 85.17 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.688 1.995 . . . . 0.0 113.054 -178.941 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.26 -37.92 75.92 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 179.506 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -73.3 -43.26 61.26 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 112.27 -2.241 . . . . 0.0 111.87 178.695 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.562 HG21 HG11 ' A' ' 23' ' ' VAL . 85.8 t -63.6 -48.84 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 114.396 -1.275 . . . . 0.0 108.699 177.393 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.565 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 42.0 mt-10 -49.17 -46.81 45.95 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 128.981 2.912 . . . . 0.0 108.995 178.464 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.45 -54.23 31.41 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 112.706 -2.043 . . . . 0.0 111.359 -178.475 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.13 -42.41 69.48 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 113.275 -1.784 . . . . 0.0 114.23 174.332 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.603 ' SD ' ' HD2' ' A' ' 47' ' ' TYR . 3.0 mmt -59.62 -50.37 74.14 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 125.88 1.672 . . . . 0.0 111.587 -179.087 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.98 -42.77 94.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 113.876 -1.511 . . . . 0.0 112.292 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.52 -32.93 74.59 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.501 179.566 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.403 HD11 ' CB ' ' A' ' 12' ' ' TYR . 29.6 mt -92.76 11.53 26.59 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 125.683 1.593 . . . . 0.0 113.727 177.576 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.408 0.2 OUTLIER 46.47 29.76 0.96 Allowed 'General case' 0 CA--C 1.564 1.487 0 C-N-CA 127.298 2.239 . . . . 0.0 113.715 -175.791 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.603 ' HD2' ' SD ' ' A' ' 42' ' ' MET . 24.9 t80 -93.8 103.48 15.61 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.03 -1.044 . . . . 0.0 108.59 -168.037 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.56 HG21 HG13 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -49.78 118.84 9.07 Favored Pre-proline 0 N--CA 1.494 1.764 0 CA-C-N 113.534 -1.666 . . . . 0.0 113.799 169.395 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.48 44.19 0.71 Allowed 'Trans proline' 0 N--CA 1.485 1.019 0 C-N-CA 123.004 2.469 . . . . 0.0 118.318 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -174.45 85.76 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-N 113.097 -1.865 . . . . 0.0 108.059 -175.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.474 ' NH2' HD21 ' A' ' 25' ' ' ASN 0.309 0.0 OUTLIER -25.86 102.26 0.02 OUTLIER 'General case' 0 CA--C 1.57 1.721 0 N-CA-C 117.577 2.436 . . . . 0.0 117.577 -178.868 . . . . . . . . 4 4 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.56 HG13 HG21 ' A' ' 48' ' ' ILE . 2.6 m -69.71 77.69 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 C-N-CA 124.143 0.977 . . . . 0.0 108.687 173.687 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.584 ' HA ' ' HA ' ' A' ' 1' ' ' MET . . . -69.4 77.34 0.39 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 122.585 1.183 . . . . 0.0 111.188 171.112 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -115.3 -52.79 2.65 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 111.629 -2.532 . . . . 0.0 112.393 174.98 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.303 0.0 OUTLIER -90.8 54.38 2.65 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 124.083 1.897 . . . . 0.0 112.126 167.314 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.465 ' H ' ' HG ' ' A' ' 56' ' ' LEU . 2.9 pp . . . . . 0 N--CA 1.478 0.959 0 CA-C-N 111.083 -2.78 . . . . 0.0 116.683 -170.518 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.457 ' HB3' HE22 ' A' ' 55' ' ' GLN . 9.3 tmm? . . . . . 0 N--CA 1.482 1.141 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.6 ' HB3' ' CZ ' ' A' ' 51' ' ' ARG 0.333 2.1 mptt -83.95 138.86 39.93 Favored Pre-proline 0 CA--C 1.552 1.051 0 CA-C-O 115.842 -2.028 . . . . 0.0 113.9 -167.299 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.435 ' HD2' HH12 ' A' ' 51' ' ' ARG . 44.9 Cg_exo -57.1 -52.7 6.1 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.698 2.265 . . . . 0.0 112.917 -168.72 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.465 1.1 t -168.31 148.27 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 103.474 -2.787 . . . . 0.0 103.474 -173.444 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 19.1 p -101.05 141.46 33.91 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.616 -0.677 . . . . 0.0 110.371 -176.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.572 HD22 HG12 ' A' ' 20' ' ' VAL . 21.6 mt -47.02 -23.84 0.53 Allowed 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 119.563 3.171 . . . . 0.0 119.563 -164.863 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -62.28 -35.59 79.47 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.14 0.882 . . . . 0.0 111.727 175.2 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.498 ' OD2' HD22 ' A' ' 45' ' ' LEU . 21.1 t70 -59.55 -46.92 87.49 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 118.383 -0.818 . . . . 0.0 112.885 171.283 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 55.9 t -58.61 -45.46 90.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 172.765 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.01 71.34 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.288 1.435 . . . . 0.0 112.598 -179.657 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.58 -38.81 84.58 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.184 1.794 . . . . 0.0 115.766 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.407 ' CB ' HD11 ' A' ' 45' ' ' LEU . 48.6 t80 -64.82 -35.64 81.76 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.97 0.908 . . . . 0.0 110.346 176.58 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.38 -14.9 44.91 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.149 -1.387 . . . . 0.0 110.241 179.311 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.31 24.96 69.55 Favored Glycine 0 N--CA 1.48 1.582 0 C-N-CA 127.23 2.347 . . . . 0.0 113.275 172.443 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -121.02 124.72 72.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 124.188 0.995 . . . . 0.0 109.749 -167.812 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.4 p -31.12 123.27 0.22 Allowed 'General case' 0 N--CA 1.513 2.715 0 C-N-CA 127.207 2.203 . . . . 0.0 108.534 175.214 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -39.47 -33.18 0.15 Allowed 'General case' 0 N--CA 1.518 2.953 0 N-CA-C 115.863 1.801 . . . . 0.0 115.863 177.221 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 -48.11 -42.4 29.02 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-O 117.745 -1.121 . . . . 0.0 112.733 176.986 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.456 ' O ' HG23 ' A' ' 23' ' ' VAL . 2.3 p -60.83 -55.77 29.08 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 175.764 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.617 ' O ' HG23 ' A' ' 24' ' ' VAL 0.326 94.7 t -60.45 -44.61 96.66 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 C-N-CA 124.666 1.186 . . . . 0.0 110.092 -165.05 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.5 p -59.61 -49.35 78.11 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.198 0.999 . . . . 0.0 113.056 178.885 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 19' ' ' THR . 26.2 mtp85 -56.75 -44.53 81.83 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 111.998 -2.364 . . . . 0.0 113.857 173.278 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.486 HG21 HG21 ' A' ' 38' ' ' VAL . 43.7 t -59.57 -47.83 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.522 1.529 . . . . 0.0 109.069 -178.813 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 20' ' ' VAL . 50.5 t -60.02 -41.38 86.05 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 112.982 -1.917 . . . . 0.0 112.042 -167.776 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.26 14.0 m120 -100.05 23.48 9.85 Favored 'General case' 0 N--CA 1.486 1.338 0 CA-C-N 113.697 -1.592 . . . . 0.0 114.867 173.518 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.34 5.91 4.54 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 170.647 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.96 43.36 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 111.566 -2.561 . . . . 0.0 115.147 -167.904 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.0 p 57.34 -59.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 113.155 -1.839 . . . . 0.0 114.485 -160.261 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -140.16 108.41 5.8 Favored 'General case' 0 CA--C 1.559 1.297 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.145 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.3 p -121.51 157.66 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 171.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 p -68.96 131.44 45.09 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 116.462 2.023 . . . . 0.0 116.462 -175.13 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -24.65 -67.06 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 128.004 2.522 . . . . 0.0 117.026 176.053 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -53.36 -40.54 65.02 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.327 1.603 . . . . 0.0 115.327 -172.346 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -50.45 70.09 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 113.056 -1.884 . . . . 0.0 107.31 -178.108 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -63.45 -40.13 96.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -179.645 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -62.76 -36.56 83.45 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 113.3 -1.773 . . . . 0.0 114.744 -176.743 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.74 -41.45 53.29 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 112.883 -1.962 . . . . 0.0 110.965 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.486 HG21 HG21 ' A' ' 23' ' ' VAL . 47.7 t -64.83 -47.4 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 125.294 1.438 . . . . 0.0 109.099 176.075 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.2 mt-10 -52.48 -43.97 65.33 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 130.066 3.347 . . . . 0.0 109.693 179.095 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.76 -51.35 67.48 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.005 -1.907 . . . . 0.0 111.28 177.738 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.85 93.22 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 113.837 -1.529 . . . . 0.0 113.55 176.261 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.3 mtt -56.59 -45.78 81.18 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 127.573 2.349 . . . . 0.0 113.537 -178.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.52 -47.96 76.93 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 113.077 -1.874 . . . . 0.0 112.628 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -63.04 -39.34 94.46 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-N 112.348 -2.205 . . . . 0.0 113.142 -177.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.498 HD22 ' OD2' ' A' ' 8' ' ' ASP . 52.9 mt -84.76 7.81 19.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.32 2.248 . . . . 0.0 113.902 -177.5 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.403 0.5 OUTLIER 49.22 45.21 23.43 Favored 'General case' 0 CA--C 1.573 1.849 0 C-N-CA 125.304 1.442 . . . . 0.0 112.852 179.679 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.41 ' HE1' HH11 ' A' ' 51' ' ' ARG . 16.7 t80 -95.39 -167.29 1.59 Allowed 'General case' 0 CA--C 1.558 1.254 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.26 -167.519 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.3 103.32 3.13 Favored Pre-proline 0 N--CA 1.479 0.984 0 CA-C-O 117.708 -1.139 . . . . 0.0 109.571 179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . 0.348 0.0 OUTLIER -8.69 -76.99 0.0 OUTLIER 'Trans proline' 0 N--CA 1.488 1.178 1 C-N-CA 125.777 4.318 . . . . 0.0 117.249 -177.278 . . . . . . . . 4 3 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.5 145.22 37.13 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 173.267 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.6 ' CZ ' ' HB3' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -102.62 94.87 5.87 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 105.461 -2.051 . . . . 0.0 105.461 -167.191 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.0 m -77.84 74.31 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.563 1.467 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -171.953 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.79 115.54 6.03 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.814 0.816 . . . . 0.0 109.922 178.345 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.538 ' H ' ' HE3' ' A' ' 2' ' ' LYS . 9.4 tm0? -106.87 -60.98 1.6 Allowed 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 113.002 -1.908 . . . . 0.0 112.628 -171.276 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.457 HE22 ' HB3' ' A' ' 1' ' ' MET . 0.0 OUTLIER -68.66 90.83 0.41 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.915 0.864 . . . . 0.0 109.622 168.21 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.6 mt . . . . . 0 N--CA 1.487 1.416 0 CA-C-N 113.224 -1.807 . . . . 0.0 114.069 -173.45 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.445 ' HA ' HG22 ' A' ' 52' ' ' VAL . 17.5 mmt . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.432 ' HD2' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -172.03 114.55 0.4 Allowed Pre-proline 0 CA--C 1.567 1.614 0 C-N-CA 127.574 2.35 . . . . 0.0 105.769 179.038 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -84.31 -8.37 9.73 Favored 'Trans proline' 0 N--CA 1.486 1.031 0 N-CA-C 118.754 2.559 . . . . 0.0 118.754 170.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.445 1.1 t -162.07 145.53 3.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 N-CA-C 102.906 -2.998 . . . . 0.0 102.906 -178.362 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.491 HG22 ' HG2' ' A' ' 55' ' ' GLN . 34.9 p -93.94 134.94 35.8 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.197 -174.505 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.786 HD11 ' HG3' ' A' ' 51' ' ' ARG . 22.4 mt -51.36 -22.37 2.87 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 120.188 3.403 . . . . 0.0 120.188 -163.591 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -58.37 -32.36 68.49 Favored 'General case' 0 CA--C 1.551 1.0 0 O-C-N 123.406 0.441 . . . . 0.0 109.951 175.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -61.59 -52.33 64.83 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 118.01 -0.995 . . . . 0.0 113.26 171.406 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.6 t -56.59 -44.71 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 174.205 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.42 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -58.11 -51.9 67.79 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.353 2.661 . . . . 0.0 112.998 -178.118 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.77 -39.85 84.09 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.86 1.664 . . . . 0.0 113.909 177.456 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.8 t80 -67.17 -34.01 76.63 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.414 1.086 . . . . 0.0 111.155 177.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.86 -11.25 42.51 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.73 1.212 . . . . 0.0 111.291 178.357 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.49 17.57 77.91 Favored Glycine 0 N--CA 1.48 1.602 0 C-N-CA 126.511 2.005 . . . . 0.0 114.15 169.187 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -117.98 136.64 54.5 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 124.828 1.251 . . . . 0.0 110.07 -170.427 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -36.29 123.59 0.77 Allowed 'General case' 0 N--CA 1.52 3.029 0 C-N-CA 127.414 2.286 . . . . 0.0 108.872 -179.485 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -34.21 -46.75 0.26 Allowed 'General case' 0 N--CA 1.53 3.543 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 175.044 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.567 HE21 ' CZ ' ' A' ' 22' ' ' ARG 0.572 0.0 OUTLIER -59.6 -29.97 68.36 Favored 'General case' 0 C--N 1.322 -0.613 1 N-CA-C 124.455 4.983 . . . . 0.0 124.455 176.642 . . . . . . . . 5 4 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.572 ' O ' HG23 ' A' ' 23' ' ' VAL . 70.1 p -59.18 -46.14 89.19 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 114.416 -1.266 . . . . 0.0 112.763 165.047 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.524 ' O ' HG23 ' A' ' 24' ' ' VAL . 92.5 t -66.06 -47.5 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.686 0.794 . . . . 0.0 110.275 -175.757 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.292 2.7 m -61.55 -34.67 75.96 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -177.836 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.567 ' CZ ' HE21 ' A' ' 18' ' ' GLN . 17.3 mtt85 -60.81 -49.02 79.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 111.385 -2.643 . . . . 0.0 114.603 166.423 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 19' ' ' THR . 92.8 t -61.52 -45.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.113 -175.778 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 20' ' ' VAL . 30.1 t -57.97 -45.09 87.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 O-C-N 124.938 1.399 . . . . 0.0 111.477 -168.243 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -90.81 24.24 2.81 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 113.846 -1.525 . . . . 0.0 113.958 175.176 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.292 0.0 OUTLIER 62.98 1.85 0.92 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 129.953 3.301 . . . . 0.0 117.741 173.668 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 28.76 40.02 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 111.811 -2.45 . . . . 0.0 116.141 -170.921 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.25 98.4 p 61.23 -49.61 0.12 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -164.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -153.33 104.59 2.78 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -174.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 p -125.74 150.99 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 N-CA-C 116.495 2.035 . . . . 0.0 116.495 -179.595 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -59.65 137.48 58.02 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 116.977 2.214 . . . . 0.0 116.977 -176.009 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.24 -61.52 1.95 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.521 1.929 . . . . 0.0 114.868 177.102 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.72 -35.83 56.52 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.403 ' O ' HG23 ' A' ' 38' ' ' VAL . 24.7 m -69.27 -58.14 4.42 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.549 1.54 . . . . 0.0 107.346 174.661 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.458 ' HB3' ' OE2' ' A' ' 39' ' ' GLU . 7.9 mtm105 -53.5 -48.09 69.28 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -179.157 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -56.3 -36.84 69.1 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.735 2.014 . . . . 0.0 113.695 -174.108 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -77.62 -44.64 27.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 109.698 -3.41 . . . . 0.0 110.518 -176.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.539 HG21 HG21 ' A' ' 23' ' ' VAL . 42.0 t -65.34 -48.46 83.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.125 1.77 . . . . 0.0 108.234 179.082 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.458 ' OE2' ' HB3' ' A' ' 35' ' ' ARG . 41.4 mt-10 -59.15 -40.04 84.3 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 128.64 2.776 . . . . 0.0 115.645 179.123 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.9 58.12 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 111.98 -2.373 . . . . 0.0 110.029 172.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.54 -37.57 73.29 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 112.988 -1.914 . . . . 0.0 113.29 176.986 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.5 ' HG2' ' CD2' ' A' ' 47' ' ' TYR . 34.3 mtt -58.09 -55.98 27.96 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 -174.699 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.88 -42.32 99.72 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 112.574 -2.103 . . . . 0.0 112.613 179.024 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.86 -37.07 85.41 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 112.307 -2.224 . . . . 0.0 112.501 -176.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -94.0 16.84 13.49 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.966 1.306 . . . . 0.0 114.269 -178.165 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.343 1.5 p-10 54.73 48.9 19.17 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-O 123.948 1.832 . . . . 0.0 113.745 178.871 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.552 ' OH ' HD21 ' A' ' 6' ' ' LEU . 73.5 t80 -105.86 157.87 17.16 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.368 -1.287 . . . . 0.0 112.462 -173.166 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.2 91.97 9.74 Favored Pre-proline 0 N--CA 1.489 1.496 0 CA-C-N 114.008 -1.451 . . . . 0.0 111.601 -173.827 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.404 ' HG3' ' SD ' ' A' ' 42' ' ' MET . 90.4 Cg_exo -43.73 109.33 0.14 Allowed 'Trans proline' 0 N--CA 1.479 0.676 1 C-N-CA 125.463 4.108 . . . . 0.0 113.969 -169.215 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.406 ' C ' HD22 ' A' ' 50' ' ' ASN . 0.1 OUTLIER -173.05 -70.04 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 119.344 3.091 . . . . 0.0 119.344 164.009 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.786 ' HG3' HD11 ' A' ' 6' ' ' LEU . 11.4 mmp_? 67.45 112.9 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 125.78 1.632 . . . . 0.0 113.154 179.073 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.445 HG22 ' HA ' ' A' ' 1' ' ' MET . 3.5 m -77.59 165.04 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 119.504 -0.878 . . . . 0.0 110.399 151.962 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.01 83.3 0.96 Allowed 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.934 1.349 . . . . 0.0 112.974 -175.291 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -118.71 -30.91 4.99 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 112.938 -1.937 . . . . 0.0 115.914 178.024 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.547 HE22 ' HD3' ' A' ' 51' ' ' ARG . 1.6 pp0? -162.55 47.56 0.16 Allowed 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 123.859 1.79 . . . . 0.0 110.267 -172.324 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.6 mt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 119.847 3.277 . . . . 0.0 119.847 -154.285 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.539 ' O ' HG11 ' A' ' 52' ' ' VAL . 80.9 mmm . . . . . 0 N--CA 1.485 1.306 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HG3' HG13 ' A' ' 52' ' ' VAL . 3.4 mppt? -112.67 148.0 38.34 Favored Pre-proline 0 CA--C 1.553 1.072 0 CA-C-O 116.004 -1.95 . . . . 0.0 111.559 179.651 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -61.81 -30.6 84.65 Favored 'Trans proline' 0 N--CA 1.487 1.097 0 CA-C-N 121.892 1.712 . . . . 0.0 115.101 -162.586 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.414 0.4 OUTLIER -137.94 150.09 25.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 CA-C-N 110.222 -3.172 . . . . 0.0 103.354 162.034 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 p -85.41 150.56 24.64 Favored 'General case' 0 CA--C 1.552 1.033 0 N-CA-C 116.343 1.979 . . . . 0.0 116.343 175.891 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.488 HD11 ' HB3' ' A' ' 51' ' ' ARG . 35.0 mt -46.41 -25.11 0.6 Allowed 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 119.996 3.332 . . . . 0.0 119.996 -166.811 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -60.54 -40.17 90.6 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 119.665 1.12 . . . . 0.0 112.155 176.911 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.57 -31.04 71.86 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 117.867 -1.063 . . . . 0.0 110.72 179.328 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.69 -50.31 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 168.238 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.68 -53.78 35.3 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.544 1.938 . . . . 0.0 112.249 176.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.39 -39.03 88.8 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.559 1.543 . . . . 0.0 112.298 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.482 ' CB ' HD11 ' A' ' 45' ' ' LEU . 32.4 t80 -65.1 -34.4 78.32 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 121.755 0.788 . . . . 0.0 109.906 177.189 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.53 -11.91 44.35 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.094 178.616 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 31.29 66.83 Favored Glycine 0 N--CA 1.483 1.818 0 C-N-CA 126.891 2.186 . . . . 0.0 112.24 171.544 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.8 p -129.12 128.49 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-O 121.78 0.8 . . . . 0.0 111.354 -168.579 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.4 p -34.57 122.22 0.52 Allowed 'General case' 0 N--CA 1.516 2.826 0 C-N-CA 128.095 2.558 . . . . 0.0 107.462 174.294 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 42.8 t80 -42.18 -43.3 3.3 Favored 'General case' 0 N--CA 1.538 3.931 0 N-CA-C 117.849 2.537 . . . . 0.0 117.849 -166.509 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . 0.413 0.0 OUTLIER -57.43 -24.83 57.91 Favored 'General case' 0 C--N 1.318 -0.795 1 N-CA-C 123.437 4.606 . . . . 0.0 123.437 -178.214 . . . . . . . . 4 3 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.524 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.7 p -55.77 -54.71 41.09 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.801 0.688 . . . . 0.0 111.707 164.548 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.627 ' O ' HG23 ' A' ' 24' ' ' VAL . 82.1 t -59.74 -49.79 82.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 126.31 1.844 . . . . 0.0 108.623 -172.195 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 m -59.81 -37.53 79.4 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.239 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.525 ' HG3' HH11 ' A' ' 22' ' ' ARG . 11.0 mtt85 -67.29 -41.16 85.88 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 118.953 2.946 . . . . 0.0 118.953 170.27 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 38' ' ' VAL . 74.4 t -59.35 -41.44 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 126.379 1.872 . . . . 0.0 107.368 179.544 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 20' ' ' VAL . 58.4 t -59.28 -45.0 93.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 113.182 -1.826 . . . . 0.0 112.579 -169.852 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -83.84 4.4 29.44 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 170.3 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.412 HE22 ' HD3' ' A' ' 35' ' ' ARG . 20.9 mm100 66.31 14.18 9.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 127.016 2.127 . . . . 0.0 115.832 -177.047 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 24.02 40.46 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.834 2.454 . . . . 0.0 117.557 -171.41 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . 0.258 96.0 p 58.46 -53.7 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -162.576 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -140.34 79.56 1.71 Allowed 'General case' 0 CA--C 1.571 1.776 0 C-N-CA 124.101 0.961 . . . . 0.0 109.909 -175.124 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -102.24 140.2 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 O-C-N 119.836 -1.79 . . . . 0.0 114.699 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.1 t -58.2 150.55 21.29 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -176.604 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.77 -67.69 0.24 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.747 2.019 . . . . 0.0 113.491 -175.834 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -56.32 -30.93 63.21 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 120.401 3.482 . . . . 0.0 120.401 -178.807 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 36.6 m -62.73 -52.0 64.94 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 174.579 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.412 ' HD3' HE22 ' A' ' 26' ' ' GLN . 25.4 mtm105 -57.01 -44.3 82.68 Favored 'General case' 0 C--O 1.245 0.85 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 176.608 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -36.63 72.56 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.769 1.627 . . . . 0.0 115.157 -176.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.6 ttpt -76.07 -42.31 47.82 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 110.934 -2.848 . . . . 0.0 110.987 -178.453 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 23' ' ' VAL . 74.9 t -65.67 -51.25 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.861 179.595 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -53.57 -46.73 70.4 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 129.825 3.25 . . . . 0.0 110.999 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.85 -49.65 71.92 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.439 -2.164 . . . . 0.0 111.879 176.532 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.18 -49.64 77.07 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 113.578 -1.647 . . . . 0.0 113.178 176.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.6 mtt -54.2 -45.54 72.22 Favored 'General case' 0 N--CA 1.497 1.903 0 C-N-CA 127.0 2.12 . . . . 0.0 111.061 -179.437 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.61 -47.77 82.34 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 125.843 1.964 . . . . 0.0 111.507 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -64.41 -40.55 95.98 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 113.044 -1.889 . . . . 0.0 113.584 177.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.482 HD11 ' CB ' ' A' ' 12' ' ' TYR . 61.6 mt -84.89 9.24 14.88 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 127.632 2.373 . . . . 0.0 115.103 179.978 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.274 0.6 OUTLIER 49.1 34.66 6.04 Favored 'General case' 0 CA--C 1.572 1.801 0 C-N-CA 126.29 1.836 . . . . 0.0 114.048 178.225 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -80.34 161.29 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.461 -0.774 . . . . 0.0 111.077 -171.338 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . 0.31 0.0 OUTLIER -115.97 93.87 39.63 Favored Pre-proline 0 N--CA 1.481 1.123 0 CA-C-N 113.874 -1.512 . . . . 0.0 110.863 177.985 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' O ' HG13 ' A' ' 24' ' ' VAL 0.309 0.1 OUTLIER -15.76 -62.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.507 1 C-N-CA 126.487 4.791 . . . . 0.0 120.775 -169.606 . . . . . . . . 5 4 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -82.75 38.27 0.56 Allowed 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 118.11 2.633 . . . . 0.0 118.11 -173.362 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.488 ' HB3' HD11 ' A' ' 6' ' ' LEU . 0.0 OUTLIER 31.54 59.21 0.3 Allowed 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 117.33 2.344 . . . . 0.0 117.33 -175.574 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.539 HG11 ' O ' ' A' ' 1' ' ' MET 0.371 28.3 m 50.72 14.43 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 N-CA-C 120.502 3.519 . . . . 0.0 120.502 -172.411 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.35 -55.76 5.64 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -178.606 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -98.85 66.92 1.64 Allowed 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 123.945 1.831 . . . . 0.0 110.57 -177.0 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 173.56 -31.35 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-N 109.913 -3.312 . . . . 0.0 110.732 -176.679 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 tp . . . . . 0 N--CA 1.475 0.798 0 O-C-N 123.923 0.764 . . . . 0.0 112.788 165.626 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.485 1.284 0 N-CA-C 116.962 2.208 . . . . 0.0 116.962 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.506 ' HE3' HG22 ' A' ' 5' ' ' THR . 46.2 pttt 177.95 138.33 0.24 Allowed Pre-proline 0 CA--C 1.567 1.606 0 C-N-CA 126.304 1.841 . . . . 0.0 109.299 176.923 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.44 ' HD3' HG22 ' A' ' 48' ' ' ILE . 12.2 Cg_exo -77.61 -26.74 6.78 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 122.217 1.944 . . . . 0.0 115.473 -166.184 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.405 0.3 OUTLIER -151.13 134.81 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 126.589 1.955 . . . . 0.0 109.007 -175.013 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.506 HG22 ' HE3' ' A' ' 2' ' ' LYS . 3.5 p -71.96 144.44 48.89 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 -169.559 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.709 HD11 ' HG2' ' A' ' 51' ' ' ARG . 41.7 mt -55.5 -23.7 27.55 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -162.747 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -51.82 -39.87 59.51 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.766 1.626 . . . . 0.0 109.322 177.156 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -62.63 -45.23 93.79 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 117.588 -1.196 . . . . 0.0 112.706 174.644 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 50.4 t -57.88 -47.86 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 169.222 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.49 -51.02 66.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.316 1.846 . . . . 0.0 113.547 177.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.04 -40.43 90.98 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.24 1.816 . . . . 0.0 113.558 179.215 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.415 ' CB ' HD11 ' A' ' 45' ' ' LEU . 37.0 t80 -64.88 -31.82 73.24 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 121.909 0.862 . . . . 0.0 110.582 176.341 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.36 -20.62 25.09 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.295 178.998 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 28.2 55.32 Favored Glycine 0 CA--C 1.545 1.909 0 C-N-CA 126.339 1.923 . . . . 0.0 112.82 173.719 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.5 p -127.93 128.25 68.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -173.128 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 p -52.48 139.88 24.02 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 124.516 1.126 . . . . 0.0 111.407 -173.198 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.619 ' CE1' ' HB2' ' A' ' 6' ' ' LEU . 41.9 t80 -46.63 -43.56 17.58 Favored 'General case' 0 N--CA 1.509 2.482 0 N-CA-C 119.871 3.286 . . . . 0.0 119.871 -165.559 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.484 ' HB2' ' NH1' ' A' ' 22' ' ' ARG 0.403 0.0 OUTLIER -55.37 -25.07 33.13 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 121.748 3.981 . . . . 0.0 121.748 -179.362 . . . . . . . . 4 4 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.535 ' O ' HG23 ' A' ' 23' ' ' VAL . 55.8 p -60.74 -55.17 36.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 114.009 -1.451 . . . . 0.0 112.951 166.461 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.645 ' O ' HG23 ' A' ' 24' ' ' VAL . 97.1 t -60.08 -48.59 87.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.153 1.781 . . . . 0.0 109.469 -176.285 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.341 3.6 m -56.21 -36.8 68.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 115.551 1.685 . . . . 0.0 115.551 177.38 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.548 ' HG3' HH11 ' A' ' 22' ' ' ARG . 12.3 mtt85 -67.81 -45.95 73.27 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 111.727 -2.488 . . . . 0.0 115.98 171.745 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.57 HG21 HG21 ' A' ' 38' ' ' VAL . 66.0 t -60.4 -43.33 93.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 125.372 1.469 . . . . 0.0 109.673 -179.538 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.83 HG11 ' HG3' ' A' ' 51' ' ' ARG . 86.0 t -54.58 -50.74 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.382 0 CA-C-N 112.441 -2.163 . . . . 0.0 110.521 -173.434 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.21 18.12 14.34 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 113.655 -1.611 . . . . 0.0 113.952 177.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.492 ' C ' ' H ' ' A' ' 28' ' ' SER 0.3 17.4 mt-30 68.19 11.09 8.22 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 119.768 3.247 . . . . 0.0 119.768 173.657 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.451 ' HB2' ' HB3' ' A' ' 22' ' ' ARG . . . 40.41 -36.49 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 121.12 3.748 . . . . 0.0 121.12 176.89 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.492 ' H ' ' C ' ' A' ' 26' ' ' GLN . 51.0 p 125.38 -73.32 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.871 1 C-N-CA 133.571 4.748 . . . . 0.0 107.647 -166.425 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -141.08 128.2 20.8 Favored 'General case' 0 CA--C 1.556 1.183 0 CA-C-O 116.546 -1.693 . . . . 0.0 112.238 173.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.416 HG12 ' NE ' ' A' ' 35' ' ' ARG 0.258 0.3 OUTLIER -139.52 158.86 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 118.137 2.643 . . . . 0.0 118.137 167.72 . . . . . . . . 4 4 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -45.27 135.38 5.9 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -176.105 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.71 -63.35 1.2 Allowed 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -172.568 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' ' 33' ' ' LYS 0.265 13.4 tptp -49.08 -34.73 14.33 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 116.734 2.124 . . . . 0.0 116.734 179.018 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.499 ' O ' HG23 ' A' ' 38' ' ' VAL . 87.8 m -54.17 -56.26 19.91 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 174.215 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.416 ' NE ' HG12 ' A' ' 30' ' ' VAL . 19.2 mtt180 -58.64 -45.85 88.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.353 1.461 . . . . 0.0 113.72 -175.89 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -34.47 75.44 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 179.995 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.36 -45.77 37.26 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 111.969 -2.378 . . . . 0.0 109.889 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.57 HG21 HG21 ' A' ' 23' ' ' VAL . 39.8 t -58.48 -48.26 85.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.288 177.474 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 40.2 mt-10 -60.12 -44.79 94.61 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 127.561 2.344 . . . . 0.0 114.569 -178.641 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.88 65.43 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.617 176.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.25 -40.98 75.02 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 112.686 -2.052 . . . . 0.0 113.024 176.596 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 25.6 mtt -60.58 -51.47 69.26 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 125.818 1.647 . . . . 0.0 115.196 -176.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.85 98.54 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 113.189 -1.823 . . . . 0.0 111.835 179.585 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -65.03 -40.97 95.61 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 112.523 -2.126 . . . . 0.0 113.954 -176.83 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.415 HD11 ' CB ' ' A' ' 12' ' ' TYR . 43.5 mt -86.25 22.55 1.76 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.827 1.651 . . . . 0.0 115.251 -178.271 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 50.3 29.55 3.85 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 126.019 1.728 . . . . 0.0 113.376 177.528 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.422 ' CG ' ' N ' ' A' ' 48' ' ' ILE . 61.4 t80 -87.27 -176.22 5.57 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.859 -1.518 . . . . 0.0 110.228 -170.978 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.44 HG22 ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -138.05 96.93 10.02 Favored Pre-proline 0 CA--C 1.546 0.804 0 CA-C-O 117.941 -1.028 . . . . 0.0 109.388 -173.207 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.552 ' O ' HG13 ' A' ' 24' ' ' VAL 0.357 0.0 OUTLIER -11.07 -72.07 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.028 1 C-N-CA 126.067 4.512 . . . . 0.0 117.129 -176.125 . . . . . . . . 5 4 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.304 0.2 OUTLIER -88.25 115.17 25.55 Favored 'General case' 0 CA--C 1.558 1.27 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 168.964 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.83 ' HG3' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -60.98 99.1 0.08 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.612 1.165 . . . . 0.0 111.741 167.343 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.9 m -85.02 52.7 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 CA-C-O 122.999 1.381 . . . . 0.0 107.316 -179.748 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -131.99 159.3 39.13 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 113.014 -1.903 . . . . 0.0 113.681 -159.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.4 mp0 -111.59 6.85 20.29 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 113.674 -1.603 . . . . 0.0 113.598 172.237 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.8 56.56 3.71 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 123.672 1.701 . . . . 0.0 112.061 178.655 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 pp . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 117.801 2.519 . . . . 0.0 117.801 -174.95 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.454 ' HB2' HH21 ' A' ' 51' ' ' ARG . 58.8 mtt . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.09 151.86 26.88 Favored Pre-proline 0 CA--C 1.554 1.126 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -171.661 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.705 ' HG3' ' HB3' ' A' ' 53' ' ' ALA . 32.7 Cg_exo -68.43 -38.8 10.73 Favored 'Trans proline' 0 N--CA 1.487 1.097 0 C-N-CA 122.868 2.378 . . . . 0.0 115.412 -158.702 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.469 0.7 OUTLIER -159.13 151.04 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 O-C-N 125.384 1.678 . . . . 0.0 107.898 -162.217 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . 0.339 2.0 p -67.94 105.11 1.9 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.7 mt -43.56 -21.96 0.04 OUTLIER 'General case' 0 N--CA 1.517 2.9 0 N-CA-C 117.134 2.272 . . . . 0.0 117.134 -177.453 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -57.28 -31.43 65.6 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-O 120.851 0.358 . . . . 0.0 111.931 169.908 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.486 ' OD2' HD22 ' A' ' 45' ' ' LEU . 13.0 t0 -58.82 -51.09 71.49 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.873 0.869 . . . . 0.0 110.895 170.84 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 73.8 t -59.14 -43.35 89.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 176.218 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.47 ' HA ' HG21 ' A' ' 20' ' ' VAL . . . -55.22 -55.45 31.16 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.944 1.697 . . . . 0.0 112.707 175.619 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.44 -42.21 92.66 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.952 2.101 . . . . 0.0 114.229 -179.536 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.436 ' CB ' HD11 ' A' ' 45' ' ' LEU . 36.5 t80 -66.23 -34.27 77.63 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.119 0.887 . . . . 0.0 110.515 179.248 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.95 -15.21 34.84 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 113.822 -1.536 . . . . 0.0 110.571 179.374 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.63 29.0 60.24 Favored Glycine 0 CA--C 1.546 1.99 0 C-N-CA 127.192 2.329 . . . . 0.0 112.71 172.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -126.32 138.71 53.81 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 123.636 0.774 . . . . 0.0 110.483 -167.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.7 p -46.2 130.26 10.32 Favored 'General case' 0 N--CA 1.512 2.656 0 C-N-CA 127.101 2.161 . . . . 0.0 107.139 178.768 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -50.01 -31.63 13.29 Favored 'General case' 0 N--CA 1.503 2.208 0 N-CA-C 115.57 1.693 . . . . 0.0 115.57 -178.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 tp60 -50.81 -44.8 59.13 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 124.642 1.214 . . . . 0.0 112.377 177.231 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.621 ' O ' HG23 ' A' ' 23' ' ' VAL 0.756 0.6 OUTLIER -67.79 -40.45 83.92 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.868 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.612 ' O ' HG23 ' A' ' 24' ' ' VAL . 71.6 t -60.98 -50.47 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.221 0.608 . . . . 0.0 110.861 -176.09 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 56.2 p -58.73 -43.44 90.18 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -174.422 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.2 mtp85 -59.48 -46.13 89.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 110.621 -2.99 . . . . 0.0 115.861 168.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.628 HG11 HG21 ' A' ' 38' ' ' VAL . 63.0 t -59.0 -43.47 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 124.658 1.183 . . . . 0.0 108.869 -178.175 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 20' ' ' VAL . 90.9 t -50.54 -48.07 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 112.901 -1.954 . . . . 0.0 112.977 -171.228 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . 0.272 10.7 m120 -99.9 25.82 6.94 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 172.149 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 65.91 5.12 3.28 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 127.51 2.324 . . . . 0.0 116.964 173.837 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 37.94 37.05 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 128.489 2.716 . . . . 0.0 115.719 -176.049 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.5 p 60.29 -49.54 0.09 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 126.486 1.915 . . . . 0.0 115.774 -163.252 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.266 74.3 m80 -147.83 101.01 3.27 Favored 'General case' 0 CA--C 1.561 1.389 0 N-CA-C 104.96 -2.237 . . . . 0.0 104.96 -175.635 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.43 158.07 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 O-C-N 119.877 -1.764 . . . . 0.0 114.222 170.005 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -57.7 133.31 55.24 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.22 -54.88 42.04 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -177.155 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.98 -38.74 8.06 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 118.553 2.797 . . . . 0.0 118.553 175.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 49.5 m -62.57 -49.02 76.93 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 113.45 -1.704 . . . . 0.0 107.282 177.987 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.5 OUTLIER -57.57 -46.2 84.26 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 178.076 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.94 -37.09 71.04 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -178.44 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -77.24 -47.28 20.6 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 112.435 -2.166 . . . . 0.0 111.373 -179.365 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.628 HG21 HG11 ' A' ' 23' ' ' VAL . 47.9 t -62.79 -47.47 92.73 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 124.682 1.193 . . . . 0.0 108.009 178.308 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 49.2 mt-10 -54.58 -42.06 70.59 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 128.796 2.838 . . . . 0.0 111.73 -179.974 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.66 -50.53 66.68 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 112.005 -2.361 . . . . 0.0 110.815 176.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.61 -39.03 79.3 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 112.93 -1.941 . . . . 0.0 112.18 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 31.2 mtt -61.04 -49.07 78.89 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.638 -1.164 . . . . 0.0 114.031 -173.044 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.78 98.09 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 112.336 -2.211 . . . . 0.0 111.687 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.97 -37.78 88.46 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 112.292 -2.231 . . . . 0.0 112.785 -178.706 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.486 HD22 ' OD2' ' A' ' 8' ' ' ASP . 47.8 mt -102.03 22.84 12.44 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.605 1.962 . . . . 0.0 113.822 -174.29 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 55.16 28.46 11.07 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 174.393 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -99.44 167.49 10.59 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 113.594 -1.639 . . . . 0.0 110.159 -173.053 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.553 HG23 ' O ' ' A' ' 50' ' ' ASN . 0.0 OUTLIER -146.46 123.67 5.95 Favored Pre-proline 0 CA--C 1.555 1.146 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.421 -168.394 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -30.99 -46.34 0.16 Allowed 'Trans proline' 0 N--CA 1.485 0.994 1 C-N-CA 126.07 4.513 . . . . 0.0 116.33 179.855 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.553 ' O ' HG23 ' A' ' 48' ' ' ILE 0.356 7.7 t30 -103.16 126.15 50.19 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 156.871 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.454 HH21 ' HB2' ' A' ' 1' ' ' MET . 0.0 OUTLIER -74.79 66.68 1.53 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -176.643 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 3.1 p -123.84 64.07 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.489 177.117 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.705 ' HB3' ' HG3' ' A' ' 3' ' ' PRO . . . -127.28 -155.25 0.68 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.677 179.084 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 63.12 -39.98 0.18 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 178.237 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . 0.289 0.1 OUTLIER -106.84 66.17 0.68 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 124.552 2.12 . . . . 0.0 111.193 173.383 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.0 mt . . . . . 0 N--CA 1.487 1.395 0 CA-C-N 110.621 -2.991 . . . . 0.0 113.271 -165.998 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.6 mtt . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.565 ' HE2' ' HA ' ' A' ' 5' ' ' THR . 85.0 tttt 21.78 67.42 0.31 Allowed Pre-proline 0 N--CA 1.496 1.875 0 C-N-CA 128.854 2.861 . . . . 0.0 108.762 -169.828 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.422 ' HD2' HG22 ' A' ' 48' ' ' ILE 0.254 4.0 Cg_exo -53.57 -10.88 1.72 Allowed 'Trans proline' 0 C--N 1.358 1.069 1 N-CA-C 123.113 4.236 . . . . 0.0 123.113 -172.349 . . . . . . . . 4 3 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.386 0.4 OUTLIER -155.3 152.61 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 -178.926 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.565 ' HA ' ' HE2' ' A' ' 2' ' ' LYS . 11.9 p -90.31 120.77 31.73 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 -179.776 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.493 HD22 HG12 ' A' ' 20' ' ' VAL . 18.8 mt -35.64 -22.19 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.978 0 C-N-CA 129.444 3.098 . . . . 0.0 118.666 -174.529 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.447 ' HB3' ' OE2' ' A' ' 11' ' ' GLU . 56.8 m-85 -56.27 -36.17 68.27 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.026 0.53 . . . . 0.0 110.793 170.353 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.477 ' OD2' HD22 ' A' ' 45' ' ' LEU . 18.7 t70 -60.75 -49.88 75.7 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 117.946 -1.026 . . . . 0.0 113.194 173.619 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.6 t -56.96 -41.9 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.079 0.952 . . . . 0.0 113.335 172.168 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.02 -53.67 54.28 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 112.836 -1.984 . . . . 0.0 112.349 -179.244 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.447 ' OE2' ' HB3' ' A' ' 7' ' ' TYR . 0.6 OUTLIER -67.62 -38.64 84.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.718 2.007 . . . . 0.0 114.031 178.164 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.428 ' CB ' HD11 ' A' ' 45' ' ' LEU . 56.2 t80 -66.14 -35.56 80.8 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.192 0.997 . . . . 0.0 110.763 176.58 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.47 -10.62 51.35 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.262 178.292 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.73 25.94 74.98 Favored Glycine 0 N--CA 1.479 1.514 0 C-N-CA 126.795 2.14 . . . . 0.0 112.204 174.109 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.6 p -119.56 132.02 70.5 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 123.785 0.834 . . . . 0.0 109.909 -168.683 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 80.7 p -38.7 124.64 1.37 Allowed 'General case' 0 N--CA 1.513 2.686 0 C-N-CA 128.933 2.893 . . . . 0.0 107.204 177.626 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . 0.255 36.5 t80 -46.08 -37.45 6.83 Favored 'General case' 0 N--CA 1.522 3.157 0 N-CA-C 116.661 2.097 . . . . 0.0 116.661 -171.517 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -52.3 -40.0 61.25 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -178.142 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.488 ' O ' HG23 ' A' ' 23' ' ' VAL . 73.2 p -53.44 -50.15 65.85 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.436 1.094 . . . . 0.0 112.802 175.537 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.663 ' O ' HG23 ' A' ' 24' ' ' VAL . 86.5 t -64.17 -55.44 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.657 -170.588 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . 0.323 13.6 m -62.73 -33.3 74.85 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -43.44 98.81 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 117.225 2.306 . . . . 0.0 117.225 167.697 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.622 HG21 HG21 ' A' ' 38' ' ' VAL . 17.9 t -58.01 -49.01 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 127.157 2.183 . . . . 0.0 108.836 177.656 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 20' ' ' VAL . 69.8 t -56.65 -44.61 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.26 0 CA-C-N 110.849 -2.887 . . . . 0.0 111.528 -169.678 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -96.62 11.4 35.42 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 113.444 -1.707 . . . . 0.0 114.178 176.857 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.533 HE21 ' NH2' ' A' ' 35' ' ' ARG 0.279 24.5 tt0 60.11 20.74 9.97 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.272 2.629 . . . . 0.0 115.859 177.244 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 23.8 37.91 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 110.456 -3.065 . . . . 0.0 117.815 -176.639 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.4 t 65.78 -54.3 0.37 Allowed 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.667 1.587 . . . . 0.0 112.233 -163.751 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . 0.256 69.6 m80 -144.82 89.95 2.02 Favored 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 179.442 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.647 HG13 ' HD2' ' A' ' 35' ' ' ARG . 7.9 p -100.67 146.82 8.62 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 O-C-N 119.985 -1.697 . . . . 0.0 114.028 174.296 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -61.05 138.51 58.19 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 174.929 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.98 -55.69 29.91 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -172.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.625 ' HE3' ' H ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -49.01 -36.01 16.7 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 117.694 2.479 . . . . 0.0 117.694 178.525 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.5 m -60.76 -48.69 80.66 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.417 176.811 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.647 ' HD2' HG13 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -61.49 -39.82 92.35 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 177.797 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.81 -34.41 69.62 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -178.254 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -77.78 -47.68 18.4 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 111.783 -2.462 . . . . 0.0 110.824 -179.941 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.622 HG21 HG21 ' A' ' 23' ' ' VAL . 39.7 t -63.26 -35.87 73.81 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.03 179.958 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 47.8 mt-10 -61.5 -45.58 93.61 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 130.495 3.518 . . . . 0.0 113.394 -176.643 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.21 82.85 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 114.021 -1.445 . . . . 0.0 110.007 174.988 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 38' ' ' VAL . . . -55.45 -44.72 76.65 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 112.009 -2.36 . . . . 0.0 113.156 175.959 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 49' ' ' PRO . 27.9 mtt -59.36 -50.54 73.58 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.4 1.88 . . . . 0.0 114.892 -179.732 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.62 89.07 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 112.892 -1.958 . . . . 0.0 112.584 179.866 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -66.54 -36.81 83.59 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 113.021 -1.9 . . . . 0.0 113.058 -179.931 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.477 HD22 ' OD2' ' A' ' 8' ' ' ASP . 38.6 mt -92.15 7.09 44.09 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 114.257 177.265 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.337 2.4 p-10 62.42 -49.68 0.17 Allowed 'General case' 0 C--N 1.346 0.428 0 C-N-CA 130.656 3.582 . . . . 0.0 117.374 -173.822 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . 0.268 7.4 t80 29.93 -91.23 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 110.565 -3.016 . . . . 0.0 116.597 -179.271 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.422 HG22 ' HD2' ' A' ' 3' ' ' PRO 0.259 0.0 OUTLIER 123.8 94.08 0.0 OUTLIER Pre-proline 0 N--CA 1.509 2.517 0 C-N-CA 129.362 3.065 . . . . 0.0 111.779 -155.486 . . . . . . . . 4 4 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HA ' ' SD ' ' A' ' 42' ' ' MET 0.268 0.1 OUTLIER -22.19 -71.09 0.03 OUTLIER 'Trans proline' 0 CA--C 1.54 0.816 1 C-N-CA 127.357 5.371 . . . . 0.0 120.024 179.748 . . . . . . . . 5 4 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . 0.268 4.3 p-10 -92.19 31.5 1.28 Allowed 'General case' 0 N--CA 1.477 0.906 1 N-CA-C 122.811 4.374 . . . . 0.0 122.811 -170.846 . . . . . . . . 3 2 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.446 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.5 OUTLIER 52.05 107.78 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 127.302 2.241 . . . . 0.0 112.898 174.707 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 1.7 m -112.53 100.52 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 -179.211 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -24.81 106.63 0.03 OUTLIER 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 116.569 2.062 . . . . 0.0 116.569 -179.35 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -109.87 -70.08 0.83 Allowed 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 113.223 -1.808 . . . . 0.0 108.761 161.342 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.482 ' OE1' HG22 ' A' ' 5' ' ' THR . 0.0 OUTLIER -112.56 107.97 16.89 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.879 -1.509 . . . . 0.0 107.511 165.945 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 N--CA 1.481 1.104 0 CA-C-N 112.052 -2.34 . . . . 0.0 116.072 -163.897 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.6 ptm . . . . . 0 N--CA 1.487 1.395 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.482 ' HB2' ' NH2' ' A' ' 51' ' ' ARG 0.252 0.0 OUTLIER -134.46 162.84 55.28 Favored Pre-proline 0 CA--C 1.547 0.861 0 CA-C-O 116.651 -1.642 . . . . 0.0 115.116 168.733 . . . . . . . . 4 4 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -84.41 -52.5 0.03 OUTLIER 'Trans proline' 0 N--CA 1.48 0.716 0 CA-C-N 121.951 1.733 . . . . 0.0 111.887 172.99 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.512 1.2 t -164.51 144.54 2.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 103.875 -2.639 . . . . 0.0 103.875 -165.08 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 p -94.6 141.13 28.96 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-O 118.65 -0.69 . . . . 0.0 109.232 -173.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.454 HD21 ' CE2' ' A' ' 47' ' ' TYR . 10.8 mt -57.61 -13.48 3.96 Favored 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 120.499 3.518 . . . . 0.0 120.499 -158.023 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -57.85 -33.43 68.64 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 119.881 1.219 . . . . 0.0 111.622 175.561 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -65.9 -47.61 74.23 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.457 176.978 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 79.3 t -59.23 -43.84 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 C-N-CA 123.577 0.751 . . . . 0.0 112.207 175.17 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.38 -50.55 73.25 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.07 1.348 . . . . 0.0 113.213 179.101 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -37.68 81.24 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 127.558 2.343 . . . . 0.0 114.196 177.424 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -63.94 -36.21 83.21 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.237 1.015 . . . . 0.0 109.767 175.751 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -90.12 -15.81 30.86 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.541 -179.142 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.23 19.05 78.85 Favored Glycine 0 N--CA 1.485 1.926 0 C-N-CA 127.451 2.453 . . . . 0.0 113.711 173.899 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.1 p -127.43 121.27 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 C-N-CA 124.08 0.952 . . . . 0.0 109.717 -166.536 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -17.06 138.22 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.846 0 C-N-CA 129.533 3.133 . . . . 0.0 112.02 -178.861 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -55.74 -27.8 52.56 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 118.527 -2.608 . . . . 0.0 115.177 170.423 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -54.29 -51.28 65.09 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-O 116.994 -1.479 . . . . 0.0 111.822 171.646 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.546 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.0 -50.45 73.36 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 179.275 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.613 ' O ' HG23 ' A' ' 24' ' ' VAL 0.293 71.8 t -63.19 -47.39 92.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.493 -173.58 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.6 p -59.2 -42.77 91.72 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 -177.93 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 19' ' ' THR . 55.0 mtp85 -59.13 -50.77 72.78 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 110.007 -3.27 . . . . 0.0 115.004 168.647 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 19' ' ' THR . 88.6 t -59.28 -44.61 92.56 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 124.299 1.04 . . . . 0.0 109.281 -176.442 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 20' ' ' VAL . 47.2 t -54.13 -50.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.006 -165.271 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.485 HD22 ' HA ' ' A' ' 25' ' ' ASN 0.399 3.0 m120 -105.31 42.0 1.29 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.089 1.515 . . . . 0.0 115.089 172.34 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.52 ' HA ' HH22 ' A' ' 35' ' ' ARG 0.424 17.7 tt0 73.01 -3.28 2.47 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 121.346 3.832 . . . . 0.0 121.346 165.702 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 33.31 30.72 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 112.077 -2.329 . . . . 0.0 115.372 -176.546 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.8 p 60.96 -53.41 0.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 126.36 1.864 . . . . 0.0 114.322 -158.648 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -150.99 141.8 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 117.631 -1.175 . . . . 0.0 108.73 -178.964 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.442 HG11 HG22 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -150.33 159.79 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 121.08 1.764 . . . . 0.0 113.713 164.346 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -51.32 139.29 19.46 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 175.569 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.86 -57.56 11.56 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.568 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.0 tptp -41.94 -41.19 2.4 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 177.684 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.6 m -58.5 -48.89 79.3 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 114.256 -1.338 . . . . 0.0 108.676 179.006 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.52 HH22 ' HA ' ' A' ' 26' ' ' GLN . 40.2 mtt-85 -60.47 -46.4 90.22 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 125.539 1.536 . . . . 0.0 113.964 -179.956 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.09 -32.04 70.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -178.318 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ttpt -80.46 -41.62 24.08 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 111.338 -2.665 . . . . 0.0 112.516 -178.904 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.47 HG21 HG11 ' A' ' 23' ' ' VAL . 98.4 t -61.79 -51.32 74.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 C-N-CA 126.326 1.85 . . . . 0.0 107.611 172.315 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.08 -41.06 91.63 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.54 1.936 . . . . 0.0 115.133 -175.955 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.3 -51.1 62.91 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 112.329 -2.214 . . . . 0.0 110.751 174.063 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.19 -41.53 84.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.297 -1.774 . . . . 0.0 113.559 176.554 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 mtt -62.58 -44.59 95.94 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -179.894 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.62 98.31 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.875 178.411 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -64.57 -37.86 89.03 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 113.006 -1.906 . . . . 0.0 112.925 179.855 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 40.8 mt -95.91 16.21 18.35 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 128.082 2.553 . . . . 0.0 115.135 178.612 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . 0.328 0.1 OUTLIER 45.63 30.11 0.75 Allowed 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 118.588 2.811 . . . . 0.0 118.588 -178.199 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.454 ' CE2' HD21 ' A' ' 6' ' ' LEU . 84.1 t80 -93.7 88.26 5.76 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 112.25 -2.25 . . . . 0.0 111.422 -163.807 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.405 HG21 HG22 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -7.81 112.83 0.03 OUTLIER Pre-proline 0 N--CA 1.509 2.482 0 CA-C-N 111.378 -2.646 . . . . 0.0 113.278 153.614 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -62.07 67.78 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.74 2.294 . . . . 0.0 115.008 171.088 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 173.56 156.47 0.12 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.594 2.358 . . . . 0.0 110.995 169.414 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.482 ' NH2' ' HB2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -79.47 99.81 7.4 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 118.735 0.698 . . . . 0.0 109.211 166.006 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.446 HG23 ' HA ' ' A' ' 2' ' ' LYS . 6.7 m -83.87 140.11 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 165.21 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -108.34 116.57 32.21 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.179 1.548 . . . . 0.0 115.179 -165.348 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.402 ' HB2' ' N ' ' A' ' 2' ' ' LYS . 26.1 tt0 -103.08 -39.07 7.04 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 112.968 -1.924 . . . . 0.0 108.251 161.572 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.409 ' H ' ' CD ' ' A' ' 55' ' ' GLN . 0.6 OUTLIER -43.5 84.27 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 113.852 -1.522 . . . . 0.0 111.147 152.622 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.6 mt . . . . . 0 N--CA 1.482 1.128 0 CA-C-N 111.735 -2.484 . . . . 0.0 112.971 -179.3 . . . . . . . . 0 0 . 1 stop_ save_