data_2i8n_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 2i8n _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 120.74 0.305 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -65.87 -39.48 90.74 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.754 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.28 -46.83 87.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.199 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.3 -38.01 89.5 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.838 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.27 -46.37 89.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.994 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -60.92 -39.42 89.33 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.4 m -56.03 -38.53 70.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.09 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.43 -43.25 97.6 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.624 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.8 mt -65.81 -44.87 92.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 120.748 0.308 . . . . 0.0 110.384 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.3 mt -63.85 -35.91 82.18 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.63 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.79 -28.34 65.88 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.34 -36.6 73.67 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.519 0.2 . . . . 0.0 110.935 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.4 tpp -57.96 -37.16 73.66 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.567 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.76 16.53 23.52 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.415 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.46 12.13 36.95 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.563 0.221 . . . . 0.0 111.533 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 tptt 71.42 25.93 3.36 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.377 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -113.34 -33.43 5.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.304 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.427 ' CD2' ' HB2' ' A' ' 21' ' ' TYR . 2.4 t60 -143.55 29.61 1.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.38 -38.1 42.58 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.49 92.84 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.998 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.427 ' HB2' ' CD2' ' A' ' 18' ' ' HIS . 10.6 m-85 -72.61 -33.55 66.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.146 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.53 17.22 23.35 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.734 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -54.25 3.48 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.64 -5.52 16.12 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.3 2.0 . . . . 0.0 113.107 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.12 40.92 3.63 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.81 0.338 . . . . 0.0 111.047 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.42 -47.85 4.54 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.014 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -80.19 155.84 74.41 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.064 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.51 -173.7 0.73 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.716 2.278 . . . . 0.0 112.647 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.2 m -111.39 84.64 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 121.131 0.491 . . . . 0.0 111.37 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -63.34 105.05 0.68 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.081 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.9 -37.22 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.733 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -72.13 -45.75 59.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.574 0.226 . . . . 0.0 111.416 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.04 -47.84 48.8 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -80.84 -21.57 40.66 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.62 60.28 5.12 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.66 66.85 1.32 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 111.325 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -63.59 -18.09 63.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.489 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -76.21 -19.08 58.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.588 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -57.63 -41.41 81.29 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.466 0.174 . . . . 0.0 111.058 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -63.55 -34.71 78.41 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.635 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -42.93 71.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.834 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 22.0 mt -73.77 -45.42 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.28 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.3 mm -121.2 119.84 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 120.674 0.274 . . . . 0.0 111.341 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -70.89 -34.3 71.43 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.49 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -129.77 77.91 76.09 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-O 120.75 0.309 . . . . 0.0 111.066 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.49 129.14 16.34 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.753 2.302 . . . . 0.0 112.5 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 73.9 mtp -132.54 155.6 48.34 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.499 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -140.1 167.32 22.41 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.303 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.0 tpp -56.38 -41.89 76.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -39.24 92.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.665 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.0 -45.08 87.05 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.811 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 27.3 mt -69.62 -45.02 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.153 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -64.64 -34.48 78.38 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.982 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.5 t -57.54 -40.25 78.42 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.082 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.408 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -61.38 -48.95 78.89 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -62.85 -36.01 81.86 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.474 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.15 -39.85 87.78 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.228 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.01 15.2 8.98 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.74 27.54 17.3 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -76.58 -35.47 58.15 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.595 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -73.68 105.07 4.83 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.75 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -79.56 -28.34 41.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.327 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -149.59 163.61 37.39 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 111.598 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.44 -18.08 63.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.778 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -62.79 -43.03 99.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.624 0.25 . . . . 0.0 110.533 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -69.95 -37.09 75.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.83 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -65.69 -53.04 46.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.11 -37.59 80.83 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.617 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.54 -42.81 93.18 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.671 0.272 . . . . 0.0 111.006 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.3 -38.99 71.75 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.222 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.2 t -62.54 -48.6 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.016 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -64.09 -37.87 89.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.646 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.41 -48.49 72.64 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.638 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -64.44 -42.83 95.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.083 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -57.14 -42.8 81.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.032 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t -63.38 -43.66 96.98 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.738 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -69.96 -41.53 74.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.949 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.38 -39.71 84.22 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.216 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.55 -34.43 72.65 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.141 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -65.69 -46.88 77.36 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -74.85 -40.9 60.74 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.142 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 m-20 -61.08 110.78 3.3 Favored Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.107 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.9 123.82 10.07 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.64 2.226 . . . . 0.0 112.223 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.64 161.37 1.32 Allowed 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.952 2.435 . . . . 0.0 113.005 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 61.06 42.21 12.82 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.74 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -134.09 147.88 50.94 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.271 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -58.35 -41.78 85.46 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.131 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -60.55 -36.66 71.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.634 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 17.5 t -65.3 -47.47 87.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.68 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.61 91.53 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.967 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.8 mtp -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.01 -50.43 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.9 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -40.44 89.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.748 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -41.81 97.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.791 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.76 -34.65 77.67 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.008 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.98 -43.37 71.61 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -61.53 -46.8 88.4 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.281 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -64.87 -42.87 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.861 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.19 -50.59 67.49 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.849 179.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.26 -45.52 83.93 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.058 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -47.88 84.33 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.042 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -67.49 -44.14 79.23 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.133 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -63.2 -42.74 99.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.836 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.57 74.34 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.066 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -71.65 -44.57 64.08 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.139 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 9.8 ptm -69.38 -35.78 76.16 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.76 -41.34 19.3 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.574 0.226 . . . . 0.0 111.35 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.979 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.643 0.259 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -64.92 -37.04 86.32 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.139 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.02 -40.65 98.38 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.925 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -35.23 66.41 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.821 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.54 -49.81 56.72 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.345 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.2 p -61.64 -37.1 82.76 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.781 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -56.57 -37.34 70.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.945 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.8 89.1 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.116 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 mt -64.14 -39.04 84.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 CA-C-O 120.917 0.389 . . . . 0.0 110.077 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -35.81 80.43 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.248 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -29.96 65.91 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.401 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.51 -36.69 74.2 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.47 0.176 . . . . 0.0 111.075 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -36.87 71.68 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.76 11.63 19.43 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -101.16 21.86 13.28 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.684 0.278 . . . . 0.0 111.525 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.8 mttm 65.77 21.63 11.52 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.453 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -111.36 -30.11 7.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.948 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.404 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -145.33 30.16 1.14 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.683 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.03 -41.27 17.41 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.36 85.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.933 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -73.79 -31.6 63.35 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.202 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -109.83 24.64 12.77 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.517 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 28.2 t-105 -69.5 -51.49 16.44 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.964 -0.107 . . . . 0.0 111.211 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -80.21 -19.3 9.36 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.423 2.082 . . . . 0.0 113.095 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -105.55 37.41 2.23 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.833 0.349 . . . . 0.0 111.131 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -107.57 -46.25 3.87 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.901 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -81.67 152.43 69.52 Favored Pre-proline 0 CA--C 1.531 0.235 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.101 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -63.43 179.3 0.94 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.926 2.418 . . . . 0.0 112.917 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.5 m -94.64 66.19 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.974 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.15 100.08 0.05 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.967 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.2 p -62.7 -35.12 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.708 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -71.71 -47.49 53.63 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.588 0.232 . . . . 0.0 111.22 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.46 -47.01 52.25 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -81.19 -21.44 39.64 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.23 60.54 6.26 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.474 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.06 71.43 1.26 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.908 0.385 . . . . 0.0 111.422 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -65.39 -22.26 66.77 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.17 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.09 -19.92 58.14 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.447 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -57.62 -42.63 83.68 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.675 0.274 . . . . 0.0 110.912 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.1 t -60.2 -37.14 79.35 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.14 -39.61 78.74 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.99 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.8 mt -72.57 -51.7 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.174 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.8 mt -129.05 118.18 45.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.058 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.0 pttt -77.68 -30.38 51.93 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -112.45 77.43 2.29 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-O 120.807 0.337 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.27 153.57 61.72 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.755 2.303 . . . . 0.0 112.656 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.27 142.95 16.21 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -139.43 167.25 22.5 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 tpp -57.55 -42.19 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.928 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.2 t -64.24 -38.25 90.39 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.544 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -65.66 -43.99 87.69 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.73 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 22.9 mt -70.17 -45.15 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.076 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -34.8 78.29 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.928 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.6 t -57.47 -40.86 79.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.934 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -60.39 -46.91 88.31 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.795 0.331 . . . . 0.0 110.251 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.04 -34.39 77.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.548 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.69 -38.18 90.15 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.311 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.69 15.19 10.03 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.089 0.404 . . . . 0.0 112.089 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 58.07 27.26 14.65 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.595 0.236 . . . . 0.0 111.543 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -32.58 60.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.648 0.261 . . . . 0.0 110.556 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -71.41 104.85 3.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.967 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -65.68 -30.77 71.51 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.062 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.87 172.36 18.79 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.738 0.304 . . . . 0.0 111.24 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.11 -16.7 63.15 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.615 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.87 -43.52 98.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.653 0.263 . . . . 0.0 110.417 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -69.69 -40.65 76.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.967 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -59.36 -53.45 58.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.778 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -58.75 -31.51 67.81 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.737 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.69 91.1 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.636 0.218 . . . . 0.0 111.387 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.11 -31.76 72.81 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.192 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.7 t -60.72 -48.32 89.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.684 0.278 . . . . 0.0 110.577 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.0 mtt-85 -64.33 -38.27 90.46 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.701 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.46 -46.35 76.67 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.668 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 5.7 tmm? -59.19 -46.35 88.65 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.85 -35.26 80.54 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.918 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -60.16 -47.32 86.42 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.15 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -75.36 -30.5 60.23 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.896 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.73 -41.44 95.31 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.75 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.26 -33.87 75.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.946 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -66.56 -47.13 73.77 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.918 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.75 -38.83 76.94 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 51.4 m-20 -72.2 127.29 90.55 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.768 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -65.95 161.01 41.46 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.678 2.252 . . . . 0.0 112.417 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.79 127.58 13.96 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.54 2.16 . . . . 0.0 112.559 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.1 t70 60.13 67.91 0.82 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.917 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -133.89 165.11 25.77 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.314 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.66 -44.15 96.99 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.309 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -62.42 -31.35 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 39.1 t -64.89 -42.32 94.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.883 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.69 -35.2 75.69 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.005 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -45.97 90.52 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.951 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.44 -46.32 89.08 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.935 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -44.99 95.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.744 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.11 -37.42 87.38 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.404 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -68.35 -38.46 81.5 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.983 179.745 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.22 -42.47 75.67 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.088 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.6 -46.81 88.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.2 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.97 -42.99 89.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.235 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -64.83 -51.46 62.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.931 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.67 -43.6 93.91 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.91 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mtt -60.24 -47.11 87.35 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.975 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.16 77.65 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.99 -44.46 95.98 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.999 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.81 -32.5 73.83 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.089 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -44.18 66.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.081 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.3 ptm -69.3 -34.24 74.4 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.259 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.8 mt -84.08 -42.29 16.26 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.992 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.809 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 120.729 0.3 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -64.73 -42.72 95.0 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mt -59.96 -41.7 92.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.918 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -35.68 81.4 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.046 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.8 t -62.42 -37.62 86.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.131 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.39 -39.09 78.73 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.842 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -60.06 -38.72 83.67 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.091 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.65 -43.18 97.95 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.501 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.6 mt -64.4 -46.88 91.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-O 120.656 0.265 . . . . 0.0 110.536 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.7 -35.87 81.09 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.876 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.7 mtpp -58.49 -29.78 66.5 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.231 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.58 -36.43 73.96 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.348 0.118 . . . . 0.0 110.87 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.85 -37.34 73.72 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.468 179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.97 8.68 30.62 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 179.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.28 15.02 18.49 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.68 29.05 2.64 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.174 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -123.74 -31.24 3.47 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.745 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -140.69 28.63 1.96 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 111.244 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.74 -37.94 64.9 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.777 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.87 -36.39 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -73.65 -34.51 64.98 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.576 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -100.81 14.42 31.77 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -52.88 4.01 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -64.06 -12.06 30.46 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 122.612 2.208 . . . . 0.0 113.567 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -141.7 52.46 1.52 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 111.203 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -99.02 -45.41 5.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.77 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.69 160.86 25.29 Favored Pre-proline 0 N--CA 1.464 0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.218 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.79 177.06 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.28 2.653 . . . . 0.0 113.158 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.0 m -93.5 83.85 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.139 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -61.16 93.13 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.524 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -61.1 -39.26 81.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.818 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -72.3 -46.62 54.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.6 0.238 . . . . 0.0 111.578 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.96 -48.79 42.54 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 mt -80.86 -21.33 40.81 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.14 58.13 6.37 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.431 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.7 60.09 1.53 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.964 0.411 . . . . 0.0 111.442 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -61.84 -20.99 64.27 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.525 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.24 -20.26 57.58 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.344 0.116 . . . . 0.0 111.27 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.432 ' CE2' HG13 ' A' ' 43' ' ' ILE . 10.3 t80 -56.71 -42.42 79.13 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.253 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 44.5 t -66.18 -32.33 73.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.943 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.24 -34.35 61.41 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.06 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.1 mt -82.99 -41.84 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.478 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.432 HG13 ' CE2' ' A' ' 39' ' ' TYR . 36.2 mm -96.41 127.58 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.747 0.308 . . . . 0.0 111.523 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.8 -36.88 25.21 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.259 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.56 88.47 53.36 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.07 116.08 4.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.736 2.29 . . . . 0.0 112.386 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.9 mtp -140.54 149.6 42.64 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.294 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -147.73 171.52 15.53 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.227 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 6.4 mtt -56.04 -42.32 76.36 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.054 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t -61.93 -40.01 94.02 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.643 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.7 m -66.31 -42.53 88.15 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.951 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.4 HG21 ' CE2' ' A' ' 67' ' ' PHE . 11.6 mt -65.21 -45.08 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.703 0.287 . . . . 0.0 110.78 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -36.69 84.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.04 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.8 p -57.35 -38.49 74.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.208 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -62.92 -48.67 77.93 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.5 tp -62.6 -34.48 77.11 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.529 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.61 -38.91 92.93 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.298 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.45 15.2 8.21 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 59.79 27.49 16.8 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.661 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.45 -34.36 58.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.725 0.297 . . . . 0.0 110.467 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.447 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 8.3 m-85 -79.2 92.72 5.12 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.587 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.5 mtm-85 -60.37 -34.96 74.61 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -145.28 165.64 27.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.931 0.396 . . . . 0.0 111.375 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.05 -22.28 65.87 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.836 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -41.32 99.41 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.599 0.238 . . . . 0.0 110.515 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.49 -35.34 78.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.935 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.447 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 24.5 t80 -59.91 -47.51 85.49 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.429 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.46 -32.29 82.55 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.796 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.05 -36.87 78.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.6 0.238 . . . . 0.0 111.414 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.59 -33.21 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.177 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.82 -48.71 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.919 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -36.07 82.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.658 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.29 -47.33 77.02 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.3 ttp -60.38 -46.87 88.41 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.343 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -63.81 -35.2 79.84 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.707 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 m -59.7 -47.24 86.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.23 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -75.39 -36.75 60.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.682 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -59.3 -40.87 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.814 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -57.66 -35.64 70.83 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.358 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -66.41 -39.57 89.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.941 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.41 ' HB2' HD12 ' A' ' 43' ' ' ILE . 3.0 t80 -81.07 -38.75 26.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.248 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 27.0 m-20 -57.51 110.6 2.6 Favored Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.113 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -68.59 143.66 57.65 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.666 2.244 . . . . 0.0 112.432 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.09 132.55 50.78 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 122.69 2.26 . . . . 0.0 112.438 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.27 68.03 0.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.013 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -134.82 154.66 51.53 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.111 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -44.75 81.63 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.248 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 m -65.46 -31.49 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.493 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.2 t -67.42 -47.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.74 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.43 91.05 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.857 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 7.7 mtt -64.99 -36.77 85.46 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.25 -48.22 79.4 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.44 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -48.0 83.61 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.744 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.07 -38.94 90.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.842 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -37.13 85.62 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.172 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -69.54 -46.79 65.67 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.847 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.78 -47.01 88.25 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.271 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.22 -43.3 97.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.316 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.25 -51.03 63.46 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.425 0.155 . . . . 0.0 110.948 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -43.89 88.05 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.793 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.9 mtp -61.99 -46.92 87.11 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.054 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.65 -44.41 77.96 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.134 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.25 -41.85 96.78 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.877 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -36.15 83.07 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.038 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -67.91 -44.84 76.01 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.173 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 13.7 ptm -69.4 -35.36 75.7 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.401 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.62 -42.37 20.13 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.225 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.008 179.911 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.65 0.262 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -63.26 -44.98 93.6 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.783 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.86 -44.51 94.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.945 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -63.83 -38.09 89.8 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.88 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -46.04 80.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.004 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.6 m -60.44 -39.0 85.93 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.972 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.8 m -58.59 -34.51 71.18 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.079 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -47.29 91.57 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.427 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.6 mt -64.06 -44.58 97.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.788 0.327 . . . . 0.0 110.259 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.16 -35.79 79.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.73 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.4 -27.66 64.48 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' HG2' ' HB2' ' A' ' 17' ' ' LYS . 0.6 OUTLIER -58.44 -36.39 73.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.922 -0.126 . . . . 0.0 111.089 179.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -56.94 -40.41 76.35 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.9 11.94 33.05 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.8 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.54 11.42 28.75 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.02 26.34 3.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.202 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.402 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 79.4 mttt -116.1 -33.51 5.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.994 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.413 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.6 OUTLIER -130.65 23.15 5.05 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.187 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.31 -30.29 60.31 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.227 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.72 -39.51 91.26 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.737 0.304 . . . . 0.0 111.02 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 91' ' ' MET . 8.7 m-85 -81.61 -33.55 31.43 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -97.02 15.58 22.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.408 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.76 -54.79 26.7 Favored Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.408 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.9 Cg_endo -76.84 -20.5 13.28 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.337 2.024 . . . . 0.0 112.984 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -98.28 22.45 9.59 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.391 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.53 -43.48 39.06 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 28' ' ' PRO . 26.3 mmtt -102.42 158.28 32.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.126 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 27' ' ' LYS . 74.0 Cg_endo -75.01 -176.34 2.83 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.805 2.337 . . . . 0.0 112.754 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.7 m -93.87 80.27 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.133 0.492 . . . . 0.0 111.241 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.31 103.86 0.27 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.142 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.5 p -61.52 -37.32 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.682 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.13 -46.42 56.63 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.488 0.185 . . . . 0.0 111.442 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.69 -46.91 57.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -80.85 -21.45 40.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.62 47.88 73.08 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.425 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.83 69.41 0.88 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.044 0.45 . . . . 0.0 111.222 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -65.23 -18.21 65.12 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.445 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -76.3 -19.95 57.77 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.872 -0.149 . . . . 0.0 111.314 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -40.31 82.49 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.615 0.245 . . . . 0.0 110.843 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.6 t -65.58 -40.13 92.39 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.788 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -65.09 -36.14 83.36 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.861 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.4 mt -77.59 -47.83 25.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.86 103.47 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.306 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -59.66 -33.31 71.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.398 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.76 89.41 52.45 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.603 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.46 124.32 11.89 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.749 2.299 . . . . 0.0 112.72 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.9 tpt -153.47 131.26 11.61 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -129.62 167.94 17.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.948 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.3 -42.65 77.91 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.091 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.8 t -62.06 -39.94 94.11 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.838 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.5 m -64.12 -44.43 92.24 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.864 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.7 mt -69.86 -44.92 78.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.136 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.688 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.52 -35.23 78.76 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.076 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 t -57.56 -40.42 78.87 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.974 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.3 -49.41 77.7 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.04 -33.26 75.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.503 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.14 -41.36 99.27 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.388 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.36 15.16 12.7 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.35 27.21 16.77 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -76.29 -33.67 59.09 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.706 0.289 . . . . 0.0 110.516 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 5.0 m-85 -70.48 110.28 5.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.76 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -81.27 -25.88 36.21 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.192 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -147.12 157.83 43.74 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.815 0.34 . . . . 0.0 111.599 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -23.17 64.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.276 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -62.6 -39.05 92.52 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.521 0.201 . . . . 0.0 110.485 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.47 -35.32 75.5 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.72 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 5.1 t80 -67.53 -53.63 26.89 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.844 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.79 -36.94 81.96 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.156 -0.545 . . . . 0.0 112.806 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.424 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -58.94 -37.83 77.62 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.507 0.194 . . . . 0.0 111.219 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -76.72 -33.48 58.16 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.47 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.7 t -64.9 -48.31 84.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.645 0.259 . . . . 0.0 110.715 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -64.62 -34.54 78.52 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.786 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.3 -44.56 71.51 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.508 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.3 -46.25 89.07 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.782 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -63.58 -35.93 82.13 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.2 p -61.25 -45.82 92.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.049 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.92 -38.05 58.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.874 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 t -61.24 -41.23 96.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.374 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.55 -29.14 69.82 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -72.73 -36.47 67.76 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.696 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -78.84 -40.78 31.75 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.226 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -70.23 112.15 11.71 Favored Pre-proline 0 N--CA 1.466 0.33 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.131 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.4 156.9 60.88 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.765 2.31 . . . . 0.0 112.219 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.15 149.48 70.85 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.42 2.08 . . . . 0.0 112.373 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 t0 60.93 43.31 11.81 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.317 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -116.63 146.92 42.37 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.001 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -56.38 -43.52 79.32 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.257 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.6 m -62.13 -33.44 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 29.9 t -61.65 -42.44 94.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.764 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.38 81.37 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.78 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' MET . . . . . 0.431 ' HA ' ' CE2' ' A' ' 21' ' ' TYR . 0.7 OUTLIER -69.53 -37.26 77.04 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.48 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.45 -50.74 57.91 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.394 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -62.63 -38.78 91.59 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.54 0.209 . . . . 0.0 110.689 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.425 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 2.9 tttp -64.42 -41.74 96.43 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.756 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.413 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -68.42 -37.94 80.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.952 179.456 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.29 -41.47 80.93 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.974 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -60.75 -46.75 89.26 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.27 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 p -67.02 -42.83 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -50.54 68.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.959 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -46.98 86.0 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.601 0.239 . . . . 0.0 110.887 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -45.75 91.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.02 -43.94 77.63 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.957 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.28 -52.46 65.56 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.982 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.27 -40.02 84.76 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.309 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.38 -42.29 75.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.679 0.276 . . . . 0.0 110.787 179.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -44.67 71.95 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.966 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -42.13 66.12 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.535 -0.745 . . . . 0.0 110.703 179.69 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.747 0.308 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.95 -42.8 94.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.213 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.5 mt -62.81 -42.45 99.72 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.719 0.295 . . . . 0.0 110.853 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -69.26 -36.67 77.36 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.965 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -50.23 64.41 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 24.0 p -64.25 -39.37 93.81 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.167 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.17 -40.51 85.84 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.927 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.47 -44.2 96.89 Favored Glycine 0 C--N 1.336 0.537 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.303 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.2 mt -64.32 -44.41 97.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-O 120.817 0.341 . . . . 0.0 110.235 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.0 mp -62.44 -35.83 80.5 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.554 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -58.45 -29.28 66.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.416 ' CG ' ' HB2' ' A' ' 17' ' ' LYS . 43.1 tt0 -58.62 -36.54 74.22 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.562 0.22 . . . . 0.0 110.645 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 6.6 ttm -57.66 -37.12 72.84 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.528 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 7.07 31.51 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.705 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.09 15.36 17.27 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.592 0.234 . . . . 0.0 111.559 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? 69.05 25.61 5.83 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HB2' ' CG ' ' A' ' 12' ' ' GLU . 32.3 mttm -115.37 -29.58 6.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.228 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.401 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 1.4 t60 -144.45 33.4 1.18 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.798 0.332 . . . . 0.0 110.796 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.21 -38.96 13.87 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.184 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.92 -42.66 97.34 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -76.8 -29.28 55.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.326 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.9 16.46 25.88 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.487 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -71.21 -55.83 5.92 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-O 120.346 0.117 . . . . 0.0 110.987 179.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.487 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 12.3 Cg_exo -69.74 -25.1 29.02 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.565 2.177 . . . . 0.0 112.636 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -102.23 34.57 2.68 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.287 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.1 -45.99 4.19 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.89 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -88.97 156.94 49.11 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.325 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -62.38 -171.71 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.154 2.569 . . . . 0.0 112.842 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -116.5 87.35 1.03 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.92 102.49 0.1 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.267 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.8 p -63.75 -36.68 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.643 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.93 -47.31 53.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.614 0.245 . . . . 0.0 111.498 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.43 -47.16 51.25 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.15 -21.51 39.71 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.17 59.99 5.92 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.615 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.93 72.23 1.22 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.962 0.41 . . . . 0.0 111.342 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -69.88 -12.73 61.84 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.458 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -19.41 58.5 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.4 0.143 . . . . 0.0 111.25 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -34.8 69.59 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.534 0.207 . . . . 0.0 111.019 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -66.44 -39.97 89.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.72 0.295 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.23 -37.55 69.14 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.229 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.9 mt -79.15 -52.97 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.321 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.3 mm -106.99 126.96 62.98 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.245 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 43.0 pttt -79.43 -39.13 33.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.278 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -116.37 94.25 42.14 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.725 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.79 105.13 0.89 Allowed 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.665 2.244 . . . . 0.0 112.598 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 39.3 mtp -139.12 140.63 38.0 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.967 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.53 170.66 12.93 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.128 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -32.29 69.23 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.475 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -42.33 99.05 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.727 0.299 . . . . 0.0 110.936 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.6 m -64.4 -39.93 94.8 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.861 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 22.1 mt -70.49 -44.74 76.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.862 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -39.61 92.99 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.113 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.3 p -57.48 -39.07 75.61 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.177 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -49.81 75.73 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.9 tp -63.23 -34.1 76.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.458 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.97 -38.25 90.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.147 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.18 15.26 10.63 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 63.84 26.92 14.45 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -79.54 -35.84 39.31 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.764 0.316 . . . . 0.0 110.732 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 2.4 m-85 -76.21 101.3 5.35 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.685 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -62.19 -30.19 70.9 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.38 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.23 164.86 38.23 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.866 0.365 . . . . 0.0 111.427 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.2 -15.41 63.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.458 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.77 -44.29 96.56 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.662 0.268 . . . . 0.0 110.323 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -71.08 -35.38 71.84 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.821 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.446 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 34.1 t80 -61.4 -48.1 82.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.412 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.53 -32.14 80.17 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.832 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.3 96.1 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.739 0.27 . . . . 0.0 111.055 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.59 -37.48 76.95 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.033 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.86 -47.74 90.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.908 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -63.01 -35.64 80.89 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.706 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.6 tt -72.2 -43.03 65.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.734 0.302 . . . . 0.0 110.808 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ttp -66.87 -45.09 79.21 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.473 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.81 -41.43 97.88 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.8 p -61.93 -44.04 97.6 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.533 0.206 . . . . 0.0 110.792 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -73.72 -39.58 64.19 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.383 179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.93 -37.82 83.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -59.81 -35.35 74.51 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.982 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -63.23 -42.78 99.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.66 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -70.19 -35.02 73.66 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.189 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.419 ' HB3' HG21 ' A' ' 89' ' ' VAL . 34.0 m-20 -59.42 110.94 3.13 Favored Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.975 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.59 160.38 24.51 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.924 2.416 . . . . 0.0 112.689 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.41 120.72 7.66 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.53 2.153 . . . . 0.0 112.244 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.2 t70 62.52 71.43 0.53 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.658 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -137.51 152.67 49.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.358 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -56.33 -44.31 79.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.291 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 19.0 m -60.3 -32.33 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.399 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.419 HG21 ' HB3' ' A' ' 82' ' ' ASN . 23.2 t -66.07 -43.22 92.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.784 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.06 -37.81 86.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.978 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -46.36 90.72 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.706 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.76 94.12 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.931 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -48.8 71.0 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.606 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.5 tttp -62.47 -41.51 98.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.087 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.401 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -67.83 -40.76 83.74 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.055 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.2 tm0? -70.04 -43.72 70.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.983 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -60.74 -46.76 89.21 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.314 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.95 -42.6 89.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.813 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.78 -49.77 71.65 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.84 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -46.18 88.72 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.562 0.22 . . . . 0.0 110.967 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 6.2 mtp -60.35 -45.98 91.53 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.983 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -67.98 -43.83 78.07 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.122 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -47.87 83.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.043 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.94 -34.08 77.18 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.114 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.92 -44.57 63.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.42 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.2 ptm -69.24 -33.47 73.32 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.04 -42.35 14.93 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 120.573 0.225 . . . . 0.0 110.846 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.13 -0.938 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 120.675 0.274 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -64.33 -39.36 93.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.92 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.97 -45.67 91.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.967 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -35.08 77.26 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.946 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 t -62.49 -35.84 80.62 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.231 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.7 m -58.05 -42.14 84.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.86 -34.98 78.49 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.017 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.93 -46.69 93.69 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.656 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mt -64.39 -47.37 89.77 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.772 0.32 . . . . 0.0 110.581 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mt -63.85 -35.75 81.64 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 ttpt -58.59 -30.3 67.1 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.616 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.404 ' CG ' ' HD3' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -58.5 -36.62 74.06 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.448 0.166 . . . . 0.0 110.983 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -38.68 76.32 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.653 0.263 . . . . 0.0 110.452 179.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.07 3.84 39.1 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.716 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.04 16.41 12.84 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.582 0.229 . . . . 0.0 111.538 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.3 mttp 70.77 25.8 3.93 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.404 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 6.9 mttm -114.28 -32.78 5.86 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.03 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.464 ' NE2' HG12 ' A' ' 98' ' ' VAL . 4.9 m-70 -131.42 18.78 4.82 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.075 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.81 78.84 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-O 120.593 0.235 . . . . 0.0 110.938 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.41 -34.77 74.97 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.298 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -86.67 -31.0 21.3 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.699 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.9 17.2 24.56 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -53.13 35.16 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.355 0.121 . . . . 0.0 110.72 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -88.68 18.72 1.43 Allowed 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.732 2.288 . . . . 0.0 113.088 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -144.13 62.78 1.34 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.934 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -127.89 -55.06 1.3 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.857 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.41 157.24 75.37 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.025 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.98 -177.22 1.23 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.754 2.303 . . . . 0.0 112.732 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.443 HG11 ' CZ ' ' A' ' 39' ' ' TYR . 15.9 m -90.23 78.55 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.113 0.482 . . . . 0.0 111.418 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.17 97.69 0.05 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.867 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 p -61.51 -39.66 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.766 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -72.25 -46.78 54.53 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.3 -48.2 44.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.5 -21.46 38.64 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.5 57.88 6.34 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.323 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.4 76.44 1.72 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.983 0.421 . . . . 0.0 111.406 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -75.88 -7.17 53.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.51 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.3 -19.87 57.86 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.369 0.128 . . . . 0.0 111.22 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.443 ' CZ ' HG11 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -57.8 -42.0 83.31 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.899 179.654 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.3 t -63.28 -35.69 81.19 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.908 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -73.24 -42.15 62.91 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.169 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 20.1 mt -80.79 -62.38 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.766 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 22.5 mm -97.23 125.54 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.822 0.344 . . . . 0.0 111.543 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -83.58 -34.95 25.05 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.442 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -136.81 72.88 54.77 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-O 120.808 0.337 . . . . 0.0 111.085 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.58 160.31 44.42 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.814 2.343 . . . . 0.0 112.423 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.7 mtp -150.18 163.22 38.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.319 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.43 172.24 14.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.032 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 ttm -54.48 -37.44 65.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.74 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.0 t -63.46 -44.25 95.02 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.82 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.2 m -64.32 -38.59 91.59 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.095 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 15.9 mt -69.74 -44.89 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-O 120.749 0.309 . . . . 0.0 110.908 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.18 -36.32 81.52 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.277 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.2 p -57.62 -43.11 84.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.8 -49.07 77.79 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.4 ' HB2' ' HD2' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -66.18 -33.18 75.18 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.688 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -60.27 -41.44 93.31 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.468 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.03 15.17 12.08 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.04 27.35 16.26 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.62 0.248 . . . . 0.0 111.362 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -76.6 -33.67 58.42 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.667 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.4 ' HD2' ' HB2' ' A' ' 56' ' ' LEU . 2.6 m-85 -66.11 103.17 0.92 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.943 0.402 . . . . 0.0 110.622 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -32.04 63.58 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.025 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -166.92 -178.98 4.47 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.251 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.52 -15.62 61.78 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.254 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -62.84 -46.0 89.96 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.669 0.271 . . . . 0.0 110.342 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.23 -36.03 74.26 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.775 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -59.93 -53.65 55.38 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.963 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.38 -32.15 81.91 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.615 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.38 99.41 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.199 0.2 . . . . 0.0 111.397 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.11 -35.24 73.98 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.447 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 46.0 t -63.44 -48.09 88.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 120.743 0.306 . . . . 0.0 110.259 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -64.76 -39.78 94.2 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.651 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.95 -48.67 79.35 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.759 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.0 ttp -61.65 -41.7 97.88 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.136 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -41.21 81.64 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.944 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.6 m -62.79 -43.71 98.07 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.833 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -71.29 -42.29 68.87 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.98 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t -59.73 -36.66 77.03 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.028 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -60.3 -37.47 80.65 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.144 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -70.56 -39.37 73.99 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.012 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -75.07 -33.21 61.65 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.424 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -88.07 111.6 43.89 Favored Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 116.754 -0.203 . . . . 0.0 111.122 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.42 142.41 97.83 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.852 2.368 . . . . 0.0 112.543 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.53 151.84 59.27 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.914 2.41 . . . . 0.0 112.618 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 59.29 51.39 6.86 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -128.92 145.91 51.09 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.6 -40.74 75.82 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.019 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.9 m -61.99 -36.1 72.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.313 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 28.2 t -65.87 -46.6 88.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.769 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.84 -36.91 82.58 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.015 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -61.26 -46.36 90.69 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.26 -46.58 82.93 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtp180 -59.89 -37.28 78.92 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.839 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -59.43 -42.2 91.35 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.725 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 20.1 mt -71.02 -32.12 68.81 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.81 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -44.23 71.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.888 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -60.69 -46.67 89.49 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.241 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.464 HG12 ' NE2' ' A' ' 18' ' ' HIS . 8.6 p -66.03 -42.95 92.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.946 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -64.14 -50.3 68.77 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.849 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.58 -46.97 83.34 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.001 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -46.1 90.81 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.867 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -43.99 78.14 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.002 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.404 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -57.48 -46.35 83.8 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.98 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.37 -36.35 83.4 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.052 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -69.14 -44.81 71.6 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.129 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 8.0 ptm -69.4 -33.31 72.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.746 -0.207 . . . . 0.0 111.408 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.81 -42.7 16.17 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.478 0.18 . . . . 0.0 111.347 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.804 -0.617 . . . . 0.0 110.737 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.69 0.281 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.52 -40.13 80.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.958 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 78.8 mt -58.97 -33.71 70.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.911 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -72.72 -34.72 67.28 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.88 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -49.71 53.8 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 24.0 p -60.31 -36.81 78.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.929 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -54.56 -34.08 61.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.251 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -46.7 93.48 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.425 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mt -64.53 -43.64 96.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.875 0.369 . . . . 0.0 110.303 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 mp -62.95 -35.52 80.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.452 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -58.18 -28.07 64.43 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.569 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.77 -36.83 75.03 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.527 0.203 . . . . 0.0 110.789 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -59.83 -37.58 79.6 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.46 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -98.71 0.71 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.626 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.09 10.75 23.1 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt 75.09 21.58 1.92 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.372 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -111.13 -35.09 6.0 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.04 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -124.61 18.16 8.79 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.29 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.63 -37.21 56.72 Favored 'General case' 0 N--CA 1.46 0.063 0 CA-C-O 120.652 0.263 . . . . 0.0 110.956 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.93 -38.19 76.14 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.028 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.406 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 6.6 m-85 -77.5 -32.36 54.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.248 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.39 8.08 43.23 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.416 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 1.9 t90 -69.92 -51.55 14.72 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 72.0 Cg_endo -76.39 2.13 7.63 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.308 2.005 . . . . 0.0 113.435 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -150.54 58.24 0.94 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.013 0.435 . . . . 0.0 111.011 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -112.25 -54.37 2.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.665 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -72.02 153.27 92.8 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.47 -179.56 0.2 Allowed 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.894 2.396 . . . . 0.0 112.723 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.7 m -107.7 73.99 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.132 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -61.66 102.13 0.23 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.874 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.52 -35.62 68.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.636 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -71.79 -47.4 53.68 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.605 0.24 . . . . 0.0 111.307 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -46.38 54.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.2 mt -80.75 -21.28 41.22 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.82 58.57 8.13 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.466 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.99 66.16 1.28 Allowed 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.934 0.397 . . . . 0.0 111.092 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -62.1 -21.17 64.77 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.354 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -76.46 -20.19 57.27 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.516 0.198 . . . . 0.0 111.29 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.43 ' CE1' HG13 ' A' ' 43' ' ' ILE . 1.1 t80 -59.05 -31.76 69.15 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 120.596 0.236 . . . . 0.0 110.786 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.4 t -60.15 -40.01 88.36 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.483 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -84.76 -37.95 20.22 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 121.262 -0.175 . . . . 0.0 111.2 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 12.2 mt -62.89 -33.42 60.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.43 HG13 ' CE1' ' A' ' 39' ' ' TYR . 40.0 mm -123.37 116.6 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.158 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -33.82 75.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.279 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -124.77 90.61 50.71 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.56 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.45 106.8 1.29 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.782 2.321 . . . . 0.0 112.452 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 27.0 mtp -146.46 144.7 29.84 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.298 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.74 172.09 13.45 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.51 -43.28 79.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.01 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -61.99 -34.78 76.8 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.749 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 86.6 m -70.32 -41.74 72.88 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.702 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.5 mt -66.64 -45.02 89.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.804 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -67.59 -34.63 77.41 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.037 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.3 t -57.55 -42.0 82.09 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.973 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -60.72 -49.6 76.84 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.814 0.34 . . . . 0.0 110.176 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.1 tp -60.99 -35.9 78.04 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.572 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -59.86 -39.58 85.7 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.119 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.4 15.18 11.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.925 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.36 28.54 16.95 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.59 0.234 . . . . 0.0 111.562 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -74.66 -37.35 62.73 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.722 0.296 . . . . 0.0 110.508 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.515 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 7.7 m-85 -73.91 100.67 3.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.819 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -69.91 -32.37 70.64 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.005 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -145.78 159.87 42.57 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.021 0.439 . . . . 0.0 111.473 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.66 -14.5 62.49 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.192 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -62.96 -45.52 92.04 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 120.69 0.281 . . . . 0.0 110.6 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -71.46 -32.46 68.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.794 179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.515 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -55.2 -53.49 55.3 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.969 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.2 -31.3 78.55 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.68 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.77 -41.36 95.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.668 0.271 . . . . 0.0 111.069 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.9 -38.96 64.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.361 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.8 t -64.31 -46.23 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.734 0.302 . . . . 0.0 110.83 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.1 mtt-85 -59.18 -33.39 70.88 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.103 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.1 -46.63 50.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.931 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.25 -42.26 90.71 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -63.8 -38.75 92.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.9 m -66.33 -38.99 88.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.019 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -70.9 -44.07 67.0 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.975 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -58.23 -34.12 70.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.101 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -56.66 -37.26 70.55 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.219 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -66.29 -47.77 72.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.205 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -72.46 -33.86 67.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.079 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.452 ' HB3' ' CG2' ' A' ' 89' ' ' VAL . 21.5 m-20 -65.39 114.01 13.83 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.132 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -58.43 167.59 4.76 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.902 2.401 . . . . 0.0 112.66 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.03 116.96 4.91 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.48 2.12 . . . . 0.0 112.334 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.4 t0 61.51 68.72 0.69 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.109 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -125.77 158.96 33.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.04 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.15 -43.91 78.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.271 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.6 m -65.36 -34.34 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.452 ' CG2' ' HB3' ' A' ' 82' ' ' ASN . 28.4 t -63.93 -43.32 97.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.907 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.19 -36.98 73.89 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.978 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 10.3 mtt -66.85 -36.99 83.59 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.1 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.66 65.56 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.69 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.51 78.0 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.213 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.406 ' HD2' ' CE2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.96 -40.48 93.51 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.89 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.0 mt -68.98 -31.66 70.67 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.003 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.39 -49.17 62.01 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.877 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.6 -46.45 90.2 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.414 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.6 p -64.45 -42.98 96.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.315 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.04 -50.47 66.1 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.536 0.208 . . . . 0.0 110.5 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -42.66 90.59 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.103 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -47.81 84.02 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.992 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -44.15 80.11 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.103 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.07 -42.25 94.35 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.861 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.13 76.61 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.03 -44.6 68.91 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.168 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.6 ptm -68.77 -33.33 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.324 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.0 -41.83 15.45 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.058 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.06 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.64 0.257 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -61.66 -36.15 80.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.766 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.48 -37.82 88.76 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.191 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -72.49 -42.0 65.37 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.81 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -49.18 76.11 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.209 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.3 p -62.35 -36.71 83.08 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.017 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.6 t -54.47 -34.79 62.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.958 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.64 -40.12 96.04 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 121.064 -0.588 . . . . 0.0 112.589 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.4 mt -64.14 -39.28 84.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.34 -35.48 80.54 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.643 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.2 -29.64 65.83 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.571 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.429 ' HG3' ' HD3' ' A' ' 17' ' ' LYS . 0.7 OUTLIER -58.63 -36.59 74.32 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.402 0.144 . . . . 0.0 111.049 179.459 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.2 mtt -58.89 -37.24 76.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.705 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -103.72 10.24 36.8 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.454 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -104.08 16.55 26.0 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.638 0.256 . . . . 0.0 111.534 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.61 28.54 9.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.26 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HD3' ' HG3' ' A' ' 12' ' ' GLU . 22.0 mttm -115.88 -35.78 4.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.129 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.42 ' CE1' HG12 ' A' ' 98' ' ' VAL . 4.8 t60 -134.44 27.17 3.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.885 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.77 -32.13 35.61 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.227 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.29 94.09 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.208 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -83.24 -32.09 26.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.48 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -95.95 12.42 30.43 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.451 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -74.3 -53.72 3.55 Favored Pre-proline 0 CA--C 1.532 0.279 0 O-C-N 122.505 -0.122 . . . . 0.0 111.112 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.451 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 3.0 Cg_exo -74.51 -1.94 11.73 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.773 2.315 . . . . 0.0 113.222 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.4 50.89 2.18 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.989 0.423 . . . . 0.0 111.06 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -109.15 -47.52 3.41 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.781 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.6 156.06 56.23 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.247 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.66 -172.76 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.882 2.388 . . . . 0.0 112.74 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -111.91 76.47 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 121.112 0.482 . . . . 0.0 111.211 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.58 107.2 1.09 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.017 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.5 p -62.31 -38.71 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.545 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.05 -45.58 60.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.587 0.232 . . . . 0.0 111.342 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.2 -48.24 52.72 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.065 0.395 . . . . 0.0 112.065 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -81.54 -21.66 38.38 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.55 58.62 5.31 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.479 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.61 74.27 1.59 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.227 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -70.9 -8.06 50.22 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.013 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.33 -20.02 57.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 121.344 -0.142 . . . . 0.0 111.193 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.87 -43.66 98.1 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.937 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.3 -38.84 90.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.717 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.36 -36.6 84.67 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.695 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.2 mt -78.39 -52.83 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.234 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.2 mt -128.91 141.47 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.806 0.336 . . . . 0.0 111.503 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.53 -31.88 12.55 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.489 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -120.7 65.34 12.37 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 120.671 0.272 . . . . 0.0 111.414 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.06 164.08 30.0 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.853 2.369 . . . . 0.0 112.718 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.1 ttm -148.37 158.89 44.38 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.5 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -138.16 164.52 28.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.21 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -40.41 78.84 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 t -62.66 -41.55 99.12 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.56 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 4.9 m -64.57 -42.32 95.71 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.972 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 15.5 mt -69.69 -45.08 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.967 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? -66.11 -34.21 77.54 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.22 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -57.5 -40.03 77.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.877 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -48.22 82.65 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.5 tp -63.96 -35.18 79.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.729 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.92 -40.99 97.76 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.503 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.86 15.37 11.43 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 60.58 28.08 17.77 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.663 0.268 . . . . 0.0 111.401 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -74.51 -33.94 62.91 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.766 0.317 . . . . 0.0 110.528 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.437 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 5.2 m-85 -70.11 105.99 3.1 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.888 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttm-85 -69.62 -29.0 66.4 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.245 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.37 164.42 38.3 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.44 -23.0 64.56 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.242 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.87 -38.32 90.38 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.742 0.306 . . . . 0.0 110.482 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -70.3 -35.22 73.56 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.437 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 16.4 t80 -59.42 -48.52 81.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.533 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.88 -33.0 81.65 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.464 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.61 -37.46 84.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.555 0.217 . . . . 0.0 111.435 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -76.43 -30.76 57.54 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.269 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.3 t -66.3 -48.57 80.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 111.027 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -64.5 -34.68 78.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.945 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.6 tp -69.06 -46.98 66.47 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.765 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 ttp -59.6 -46.43 88.96 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.198 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 96' ' ' GLN . 4.5 m-85 -60.88 -39.79 90.56 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.183 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 24.7 t -59.51 -46.32 89.18 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.846 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -74.99 -41.68 59.04 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.784 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.4 m -60.97 -34.94 75.55 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.287 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -60.28 -35.03 74.6 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.653 0.263 . . . . 0.0 111.215 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -71.63 -35.85 70.55 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.85 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -82.82 -40.94 19.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.347 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -69.45 116.59 44.27 Favored Pre-proline 0 N--CA 1.464 0.262 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.081 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.71 153.62 23.58 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.916 2.411 . . . . 0.0 112.576 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.03 136.83 28.01 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.565 2.177 . . . . 0.0 112.151 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 t70 58.19 61.24 2.37 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.03 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -126.97 150.16 49.52 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.911 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -56.52 -44.12 80.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.326 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.71 -35.89 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.198 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.5 t -64.98 -45.74 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.779 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.83 78.69 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.802 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.7 mtp -61.46 -46.59 89.44 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.01 -50.17 71.63 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.934 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -58.87 -41.11 86.31 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -61.99 -42.02 98.69 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.996 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.5 mt -60.51 -41.5 94.48 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.838 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.08 -41.88 73.51 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.916 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.55 -46.67 89.31 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.252 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.42 HG12 ' CE1' ' A' ' 18' ' ' HIS . 11.1 p -66.69 -42.64 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.014 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -47.04 79.57 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.825 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.62 -46.35 90.6 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.625 0.25 . . . . 0.0 110.976 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -47.7 84.65 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.95 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.0 mmt180 -67.66 -38.77 84.25 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.42 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -58.41 -50.71 72.72 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.009 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.13 -35.67 77.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.229 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.8 62.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.396 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.42 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 2.0 ptm -69.26 -34.01 74.11 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.93 -41.64 15.73 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.6 0.238 . . . . 0.0 110.911 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 117.947 -1.025 . . . . 0.0 111.044 -179.812 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 120.705 0.288 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -57.02 -37.11 71.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt -61.24 -46.61 89.7 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.822 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -67.73 -34.48 76.93 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.825 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.65 -39.61 70.24 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.831 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -65.59 -39.05 91.16 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.54 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -35.65 68.37 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.059 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.18 -47.58 90.38 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.109 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 32.4 mt -64.89 -44.25 96.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-O 120.788 0.328 . . . . 0.0 110.319 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 mp -62.42 -35.79 80.35 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.737 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mtmt -58.47 -28.19 65.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.375 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -58.48 -36.63 74.04 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.841 -0.163 . . . . 0.0 110.967 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -57.46 -37.11 72.33 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.487 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -107.67 9.96 29.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.63 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -92.04 12.06 23.21 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.8 tttm 73.03 26.97 2.12 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.528 0.331 . . . . 0.0 111.284 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -120.8 -35.39 3.37 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.346 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.77 25.7 4.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.172 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.52 -34.48 31.2 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.068 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.73 76.47 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.437 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -79.58 -32.57 42.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.381 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.14 15.29 28.75 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -61.83 4.8 Favored Pre-proline 0 CA--C 1.53 0.193 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.64 -19.76 64.94 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.258 1.972 . . . . 0.0 112.799 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.38 35.94 4.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.475 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 -40.95 10.21 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.011 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -89.87 163.44 32.38 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.288 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -81.16 -174.53 2.25 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.945 2.43 . . . . 0.0 112.758 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.0 m -113.83 75.14 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.091 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -58.6 103.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.055 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.4 ' HA ' HD11 ' A' ' 36' ' ' LEU . 10.4 p -61.55 -39.19 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.633 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -72.05 -45.51 60.53 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.52 0.2 . . . . 0.0 111.536 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.95 -48.36 45.75 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 mt -81.21 -21.5 39.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.87 57.68 6.22 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.411 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -129.81 73.83 1.55 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.98 0.419 . . . . 0.0 111.21 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -71.69 -8.92 57.09 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.715 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.6 -20.1 57.13 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.461 0.172 . . . . 0.0 111.388 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.57 -41.81 97.94 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.884 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.68 -39.18 90.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.736 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.05 -39.62 94.48 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.628 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.8 mt -74.81 -51.66 21.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.843 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.0 mt -130.35 112.24 22.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -11.79 60.63 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.822 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -126.93 71.79 75.38 Favored Pre-proline 0 CA--C 1.534 0.341 0 CA-C-O 120.71 0.291 . . . . 0.0 111.047 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.0 145.48 99.06 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 122.897 2.398 . . . . 0.0 112.539 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 mmt -147.89 139.45 23.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.232 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -145.39 165.54 28.2 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.835 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.4 ttm -57.01 -36.56 70.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.646 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.0 t -66.35 -39.34 89.11 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.812 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.2 m -67.2 -40.11 86.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.982 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.3 mt -68.46 -45.19 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.99 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -66.09 -35.22 79.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.127 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.6 t -57.64 -42.98 84.51 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.967 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.38 -47.75 84.72 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.59 -34.53 77.19 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.693 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.81 -41.31 99.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.295 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.81 15.29 11.51 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 59.91 28.45 17.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.689 0.28 . . . . 0.0 111.424 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -72.99 -34.1 66.23 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.517 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.511 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 5.8 m-85 -72.86 103.09 3.59 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.49 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -67.3 -29.76 69.43 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.226 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -155.65 178.1 10.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.812 0.339 . . . . 0.0 111.281 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.34 -25.25 62.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.62 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -42.07 99.62 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.774 0.321 . . . . 0.0 110.267 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.92 -37.67 88.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.802 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.511 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 27.2 t80 -59.41 -51.86 68.07 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.806 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.22 -31.53 77.34 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 121.049 -0.595 . . . . 0.0 112.696 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.8 -39.39 80.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.611 0.243 . . . . 0.0 111.32 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.68 -33.11 58.26 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.169 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 40.7 t -67.44 -46.75 82.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.604 0.24 . . . . 0.0 110.789 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -59.09 -36.99 76.07 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.85 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.15 -42.09 66.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.629 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -62.17 -46.77 87.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.129 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.39 -35.57 80.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.053 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.6 t -59.78 -47.63 84.91 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.117 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -75.82 -30.74 59.1 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.584 0.231 . . . . 0.0 110.868 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.91 -41.88 97.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.822 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -61.19 -33.59 73.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.409 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -71.16 -44.47 65.46 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.06 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -75.25 -37.28 61.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.311 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -58.28 115.11 10.26 Favored Pre-proline 0 N--CA 1.465 0.282 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.34 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -58.45 163.15 10.97 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.971 2.447 . . . . 0.0 112.629 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -73.91 126.44 10.66 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.638 2.226 . . . . 0.0 112.45 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t0 58.47 62.42 1.97 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.157 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -123.06 154.09 39.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -56.81 -43.8 81.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.245 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 22.1 m -59.7 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.324 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.5 t -62.77 -44.77 99.76 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.922 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.55 -41.83 95.31 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.823 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.9 mtt -65.05 -43.61 91.72 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.606 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.91 -48.18 83.02 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.021 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -46.98 77.4 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.0 tttp -63.02 -38.06 89.67 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.842 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.6 mt -66.91 -36.27 81.88 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.086 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 7.5 tm0? -70.06 -47.85 60.27 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.074 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -61.3 -46.84 88.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.496 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.1 p -63.36 -43.31 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.234 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.32 -51.01 63.46 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.591 0.234 . . . . 0.0 110.803 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -42.77 92.82 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.89 85.88 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.873 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -65.66 -44.18 87.11 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.982 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -43.47 95.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.757 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.8 -44.22 90.64 Favored 'General case' 0 N--CA 1.46 0.065 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -64.72 -40.91 96.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.603 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -44.4 72.04 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.827 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -72.23 -42.34 65.82 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.206 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.492 -0.766 . . . . 0.0 110.839 179.848 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.628 0.251 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -61.42 -40.88 96.03 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.797 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -38.61 89.0 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.994 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -71.67 -36.1 70.53 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.806 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -50.19 61.61 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 p -62.25 -37.79 86.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.046 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.8 m -62.69 -36.42 82.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.915 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.11 -41.93 98.27 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.35 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.2 mt -63.97 -46.34 94.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-O 120.663 0.268 . . . . 0.0 110.657 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.9 mt -62.17 -36.25 81.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.86 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.6 mttp -58.84 -31.7 68.74 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.33 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 3.3 tt0 -58.1 -36.59 73.1 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.365 0.126 . . . . 0.0 111.016 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.0 mtt -56.87 -37.1 70.87 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.185 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.33 16.61 19.91 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.575 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.422 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . . . -95.97 15.48 20.45 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.689 0.28 . . . . 0.0 111.53 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.31 24.03 1.13 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.595 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.406 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 48.8 mttp -116.91 -32.78 4.97 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.838 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.86 18.51 3.51 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.01 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.48 -35.71 81.37 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.494 0.183 . . . . 0.0 111.494 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.54 70.42 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.114 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.42 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 10.2 m-85 -99.71 -24.84 14.58 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.594 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.55 -16.17 35.37 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.599 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 12.2 t90 -53.45 -51.83 72.2 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.298 0.094 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 90.3 Cg_endo -82.74 -19.4 6.11 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.476 2.117 . . . . 0.0 113.189 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -97.42 36.16 1.52 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.622 0.249 . . . . 0.0 111.59 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.51 -58.15 0.99 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.858 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -66.35 138.46 95.86 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.966 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.01 160.72 32.62 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.787 2.325 . . . . 0.0 112.507 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.7 m -88.91 87.49 2.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 121.024 0.44 . . . . 0.0 110.745 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.69 104.34 0.22 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.111 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.9 p -59.73 -36.6 66.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.72 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.06 -47.03 54.57 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.29 49.95 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.77 -21.51 40.96 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.87 57.19 8.1 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.387 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.58 65.28 1.26 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 111.179 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -64.94 -19.71 66.09 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -76.15 -19.46 58.45 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.195 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.429 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -59.48 -41.83 90.71 Favored 'General case' 0 CA--C 1.526 0.056 0 CA-C-O 120.496 0.189 . . . . 0.0 110.786 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.51 -32.72 74.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.653 0.263 . . . . 0.0 110.948 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 m-20 -75.81 -45.77 34.19 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.03 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 49.3 mt -74.56 -34.45 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.461 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.429 HG13 ' CE2' ' A' ' 39' ' ' TYR . 33.0 mm -103.64 107.99 23.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.631 0.253 . . . . 0.0 111.16 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -68.52 -34.05 75.2 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.468 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -130.41 88.7 46.6 Favored Pre-proline 0 CA--C 1.532 0.253 0 CA-C-O 120.704 0.287 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.72 140.72 39.68 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.738 2.292 . . . . 0.0 112.632 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttm -160.61 153.62 21.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.018 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -147.56 162.0 39.98 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.5 tpp -54.54 -38.94 67.18 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 t -62.51 -39.71 94.39 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.449 0.166 . . . . 0.0 111.108 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.7 m -70.97 -40.62 71.82 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.982 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 15.4 mt -69.7 -44.83 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.546 0.213 . . . . 0.0 110.785 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.14 -35.1 79.18 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.671 -0.241 . . . . 0.0 111.1 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -44.01 84.26 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.082 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.63 -49.76 76.24 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.844 0.354 . . . . 0.0 110.109 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.6 tp -63.09 -34.29 77.28 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.716 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.37 -39.74 88.3 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.193 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.0 15.41 10.11 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 62.77 27.18 15.97 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.303 0.241 . . . . 0.0 111.585 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -75.95 -34.43 59.83 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.84 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -78.21 99.35 6.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.938 0.399 . . . . 0.0 110.588 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -58.0 -32.58 68.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -146.55 168.21 21.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 111.057 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.18 -16.9 61.42 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.363 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -45.92 90.19 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.634 0.254 . . . . 0.0 110.334 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.41 -38.93 85.38 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -63.42 -52.65 60.65 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.603 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -64.14 -31.34 80.5 Favored Glycine 0 C--N 1.335 0.51 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.151 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.92 91.22 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.829 0.315 . . . . 0.0 111.182 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -72.2 -30.33 64.85 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.43 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.4 t -65.46 -47.99 84.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.759 0.314 . . . . 0.0 110.498 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 56.9 mtp85 -59.63 -39.68 85.1 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.25 -46.05 74.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.815 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -59.28 -46.8 87.57 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.249 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -66.09 -35.52 80.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.773 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.0 m -59.65 -46.77 88.03 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.503 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.21 -36.43 61.39 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.507 0.194 . . . . 0.0 110.977 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -39.09 83.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.231 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -57.3 -34.65 68.91 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.15 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.7 tttt -66.37 -44.02 84.32 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.598 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.39 -37.74 74.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.24 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.461 ' HB3' HG22 ' A' ' 89' ' ' VAL . 17.3 m120 -65.61 111.62 6.67 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.431 ' HG2' ' CD2' ' A' ' 86' ' ' HIS . 42.8 Cg_endo -67.18 147.14 78.41 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.629 2.219 . . . . 0.0 112.356 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.55 131.74 45.29 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.671 2.247 . . . . 0.0 112.723 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t70 63.0 64.31 0.87 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.514 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.431 ' CD2' ' HG2' ' A' ' 83' ' ' PRO . 5.5 t-80 -136.8 155.94 49.15 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.034 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -55.8 -44.46 77.82 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.403 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.6 m -63.52 -35.24 71.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.637 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.461 HG22 ' HB3' ' A' ' 82' ' ' ASN . 26.2 t -60.8 -46.27 96.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.88 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.33 -33.7 76.45 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.027 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 6.0 mtm -64.42 -46.56 82.69 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.861 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.45 -44.29 96.77 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.839 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -65.84 -43.09 89.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.731 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.42 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 22.3 tttp -63.37 -42.94 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.103 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -66.65 -39.07 88.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -69.11 -43.79 73.73 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.703 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -61.48 -46.88 88.16 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.33 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p -66.33 -42.95 91.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.808 -0.178 . . . . 0.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -63.85 -51.59 63.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.862 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.39 -41.31 98.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -47.56 85.21 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.658 0.266 . . . . 0.0 110.839 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -43.9 78.32 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.798 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -42.89 97.08 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.027 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.04 -32.62 73.11 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.007 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -70.9 -44.43 66.27 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.987 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 9.2 ptm -69.06 -33.38 73.47 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.195 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.8 mt -83.89 -42.24 16.57 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.041 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.842 179.758 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 . . . . . 0 N--CA 1.488 1.438 0 CA-C-O 120.683 0.278 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -69.07 -34.75 75.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.948 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.06 -46.8 76.48 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.553 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -32.29 71.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.15 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.62 -40.91 84.65 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.563 0.22 . . . . 0.0 110.799 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.3 m -63.48 -38.95 93.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.856 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.9 m -56.93 -35.7 69.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.68 97.73 Favored Glycine 0 C--N 1.337 0.612 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.628 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 16.1 mt -65.47 -47.67 85.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.705 0.288 . . . . 0.0 110.66 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.45 -35.79 81.61 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.776 179.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -30.75 66.69 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.333 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.424 ' HG3' ' CD ' ' A' ' 17' ' ' LYS . 52.7 tt0 -58.55 -36.66 74.25 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.004 0.19 . . . . 0.0 110.829 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -58.53 -37.17 75.09 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.679 0.276 . . . . 0.0 110.397 178.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.82 5.29 33.0 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.81 17.84 11.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.629 0.252 . . . . 0.0 111.349 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.6 mmtt 68.02 37.37 3.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.125 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.424 ' CD ' ' HG3' ' A' ' 12' ' ' GLU . 55.0 mttt -128.09 -39.28 1.75 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.07 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -123.73 19.09 9.47 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.374 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.01 62.76 Favored 'General case' 0 C--N 1.335 -0.052 0 CA-C-O 120.643 0.259 . . . . 0.0 111.106 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.69 -36.16 62.75 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.275 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -81.42 -33.08 32.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.217 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.17 20.0 16.51 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.403 ' N ' ' CD ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.68 -50.88 62.16 Favored Pre-proline 0 CA--C 1.529 0.154 0 CA-C-N 116.94 -0.118 . . . . 0.0 111.049 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 23' ' ' TRP . 50.5 Cg_exo -53.88 -25.43 35.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.548 2.165 . . . . 0.0 112.934 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -118.84 37.11 4.2 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.132 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.16 -35.36 64.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.17 162.57 47.3 Favored Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.18 -177.4 0.12 Allowed 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.155 2.57 . . . . 0.0 112.768 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 m -120.91 83.78 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.252 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.03 101.85 0.31 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.7 p -61.83 -36.63 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.737 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -71.83 -47.65 51.69 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.563 0.22 . . . . 0.0 111.391 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -47.29 49.72 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.4 mt -80.91 -21.49 40.5 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.88 57.61 9.48 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.05 74.5 1.44 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.051 0.453 . . . . 0.0 111.296 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.92 -3.85 34.56 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.777 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -76.25 -20.0 57.8 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.37 0.129 . . . . 0.0 111.304 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -57.42 -34.06 68.53 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 116.671 -0.241 . . . . 0.0 110.969 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.48 -40.46 96.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.751 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.91 -41.02 75.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.476 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 12.8 mt -68.74 -51.44 45.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.305 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.96 150.5 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-O 120.941 0.401 . . . . 0.0 111.644 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.1 pttm -96.04 -32.77 12.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.677 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -110.96 83.39 3.63 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-O 120.705 0.288 . . . . 0.0 111.057 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -73.01 125.76 10.65 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.833 2.355 . . . . 0.0 112.65 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.1 mtp -148.63 141.36 24.56 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.148 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.66 168.99 13.6 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 26.9 mtt -56.31 -38.74 71.69 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.102 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.5 t -62.45 -35.72 80.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.833 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.3 m -73.18 -38.78 66.03 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.017 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.7 mt -66.89 -45.13 88.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.917 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.31 -34.24 74.37 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.959 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -57.32 -42.91 82.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.729 -0.214 . . . . 0.0 110.901 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -62.02 -49.38 76.24 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.879 0.371 . . . . 0.0 110.112 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.76 -32.66 74.24 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.002 179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.77 -40.6 88.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.651 0.262 . . . . 0.0 111.056 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.34 15.19 12.59 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.861 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.52 27.75 17.41 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.629 0.252 . . . . 0.0 111.599 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -70.68 -34.29 71.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.68 0.276 . . . . 0.0 110.689 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -73.63 106.55 5.44 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.608 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -80.58 -28.8 37.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.068 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -146.38 165.25 29.9 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.944 0.402 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.11 -15.67 61.48 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.55 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -63.1 -44.94 94.27 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.48 -37.98 77.49 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.848 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -66.53 -53.62 32.84 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.917 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.45 -38.0 84.87 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.665 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.92 -35.27 76.25 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.591 0.234 . . . . 0.0 111.22 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -76.17 -34.2 59.35 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.329 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.2 t -67.09 -48.24 79.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 120.621 0.248 . . . . 0.0 110.622 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.48 -34.03 76.88 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.082 179.656 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.25 -48.38 65.23 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -59.33 -42.72 92.12 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.3 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.11 -44.0 95.17 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.795 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -37.26 86.56 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.777 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -69.66 -47.85 61.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.832 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.24 -33.91 69.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.206 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -56.54 -39.45 73.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.149 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -75.01 -38.92 61.45 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.791 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -59.89 -31.86 70.2 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.674 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -92.89 148.57 36.13 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-O 120.811 0.338 . . . . 0.0 111.104 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -80.17 169.63 17.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.999 2.466 . . . . 0.0 112.653 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.22 128.67 11.49 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.513 2.142 . . . . 0.0 112.525 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 t70 62.51 69.26 0.61 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.283 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -136.31 158.05 45.35 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.229 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.18 -44.68 96.06 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.326 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.3 m -64.7 -30.65 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.373 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 12.5 t -69.37 -40.73 80.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.893 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.58 -35.36 68.11 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.024 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 6.1 mtt -65.6 -44.29 87.05 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.744 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.27 -47.59 85.36 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.238 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -59.57 -43.41 93.63 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.745 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -68.62 -40.45 80.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.868 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -34.4 78.23 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.086 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -69.3 -44.0 72.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.698 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -63.54 -46.86 84.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.15 -43.09 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.198 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.0 -50.63 67.76 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.787 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -45.98 85.39 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.762 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.2 mtp -62.44 -46.29 89.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -64.73 -42.5 95.17 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.02 -45.26 95.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.815 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.68 73.18 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.9 -43.36 65.49 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.065 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.7 ptm -69.27 -33.32 73.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.214 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.46 -42.82 14.13 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.047 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.729 0.299 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -57.97 -36.94 73.3 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 mt -62.54 -34.82 77.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.024 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 -32.62 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.076 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.31 -48.22 57.58 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.068 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.1 p -66.11 -36.99 84.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.385 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 82.9 p -57.57 -34.42 69.18 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.96 -43.46 98.1 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.454 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mt -63.99 -45.74 95.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.849 0.357 . . . . 0.0 110.058 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.491 HD13 ' CZ ' ' A' ' 67' ' ' PHE . 9.3 tp -61.27 -35.46 77.36 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -36.38 73.01 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.142 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -37.82 82.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.822 -0.172 . . . . 0.0 111.18 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -37.39 75.76 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 110.273 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -108.45 17.65 21.85 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.299 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.73 0.14 57.17 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt 78.43 16.78 1.17 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.288 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.57 -36.22 6.25 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.63 179.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -113.55 -3.26 13.68 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.786 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.75 -29.47 68.18 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.447 0.165 . . . . 0.0 111.409 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.67 -46.1 83.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.649 0.262 . . . . 0.0 110.85 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.6 -34.21 71.89 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.865 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -98.15 19.55 13.93 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.572 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.489 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 42.6 t90 -59.58 -51.63 79.76 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 116.77 -0.196 . . . . 0.0 111.47 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 57.0 Cg_endo -70.35 -9.66 26.38 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.251 1.967 . . . . 0.0 113.01 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -120.13 43.16 2.77 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.044 0.45 . . . . 0.0 110.903 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.43 -37.95 11.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.683 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -107.86 160.93 25.0 Favored Pre-proline 0 N--CA 1.465 0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.055 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.35 -176.07 0.13 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.969 2.446 . . . . 0.0 112.761 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.31 79.43 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.11 0.481 . . . . 0.0 111.308 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -63.76 101.44 0.36 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.68 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.66 -39.53 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.715 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -71.92 -46.86 56.15 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.271 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.5 -48.75 54.16 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.51 -21.49 38.6 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.66 54.23 13.29 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.476 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HB2' ' HB2' ' A' ' 39' ' ' TYR . 0.5 OUTLIER -126.34 67.88 1.22 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.016 0.436 . . . . 0.0 111.148 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -65.41 -22.2 66.75 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.312 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.3 -19.89 57.83 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.318 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.453 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.4 t80 -60.79 -45.61 93.72 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-O 120.536 0.207 . . . . 0.0 110.964 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 26.8 t -63.48 -30.88 71.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.56 -34.39 62.93 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.882 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 mt -83.73 -34.81 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.517 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.453 HG13 ' CE2' ' A' ' 39' ' ' TYR . 30.8 mm -102.28 124.55 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -87.45 -33.27 19.1 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.392 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 75.26 68.79 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.738 0.304 . . . . 0.0 110.945 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.32 128.94 32.58 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.885 2.39 . . . . 0.0 112.692 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -152.18 141.32 21.32 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.036 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.35 162.7 31.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.789 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.52 -39.89 65.01 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.716 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.7 t -64.14 -37.71 88.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.4 m -74.05 -36.49 64.37 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.297 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.43 HG23 ' CE1' ' A' ' 67' ' ' PHE . 9.6 mt -71.58 -44.3 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.859 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.9 mtpm? -64.21 -37.77 88.65 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 p -57.9 -38.76 76.41 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.372 0.13 . . . . 0.0 111.122 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -60.36 -48.25 82.55 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.5 tp -62.91 -34.98 78.57 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.468 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.17 -38.58 91.75 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.271 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.46 15.15 9.75 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 59.56 27.28 16.44 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.653 0.263 . . . . 0.0 111.504 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.67 -32.38 57.9 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.665 0.269 . . . . 0.0 110.594 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 4.7 m-85 -71.11 104.93 3.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.872 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -62.64 -30.77 71.61 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.96 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.99 172.48 11.43 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.764 0.316 . . . . 0.0 111.32 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.32 -17.58 64.29 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.589 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -62.82 -43.23 99.36 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.659 0.266 . . . . 0.0 110.507 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.89 -34.67 71.82 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.831 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.491 ' CZ ' HD13 ' A' ' 10' ' ' LEU . 1.8 t80 -62.81 -53.38 55.12 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.073 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.21 -33.19 64.5 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.705 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.41 -44.88 86.03 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.529 0.204 . . . . 0.0 111.286 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -66.7 -30.76 71.08 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.343 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.6 t -67.09 -47.33 82.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-O 120.692 0.282 . . . . 0.0 110.374 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -62.57 -41.29 98.83 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -47.63 83.53 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.724 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 12.8 tmm? -61.88 -45.98 91.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.893 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -61.92 -42.49 99.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.171 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.4 m -62.67 -42.8 99.81 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.147 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -73.86 -47.12 40.53 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.154 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.0 t -60.19 -37.39 80.06 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.243 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -60.72 -33.12 72.42 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.019 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -61.52 -35.69 78.44 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.728 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -85.53 -34.02 21.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.356 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -56.76 111.67 3.59 Favored Pre-proline 0 N--CA 1.466 0.365 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.107 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.46 154.17 31.35 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.803 2.335 . . . . 0.0 112.654 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.0 136.22 24.49 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.569 2.179 . . . . 0.0 112.516 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.63 55.45 4.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.419 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -121.79 148.62 44.44 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.7 -44.09 81.17 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.308 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.7 m -61.57 -33.17 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.384 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -65.5 -44.47 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.781 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.76 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.2 mtp -65.79 -42.37 90.81 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.73 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.5 -47.69 84.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -59.71 -44.14 93.83 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.809 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -41.97 91.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.721 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 80.3 mt -65.15 -34.43 78.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.184 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -69.12 -43.92 73.42 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.631 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.41 -47.08 83.48 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.162 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.69 -42.96 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.012 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -63.57 -50.91 67.62 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.817 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -44.29 93.57 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.019 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -48.11 83.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.023 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -42.67 86.28 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -46.95 85.88 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.017 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.79 81.93 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.25 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -43.58 65.44 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.368 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -69.7 -34.12 73.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.01 -42.08 15.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.615 0.245 . . . . 0.0 111.069 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 . . . . . 0 C--O 1.252 1.189 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.586 179.94 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.631 0.253 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -59.82 -36.33 76.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.931 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 13.8 mt -58.74 -46.74 86.72 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.9 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.07 -37.46 75.5 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.086 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -40.29 96.72 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.031 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.76 -37.76 79.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.914 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.6 t -58.07 -38.53 76.52 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.998 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -45.31 95.77 Favored Glycine 0 C--N 1.336 0.535 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.379 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -64.14 -42.97 97.23 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.77 0.319 . . . . 0.0 110.357 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.2 mt -62.37 -35.61 79.7 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.706 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -28.77 64.78 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.806 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 39.6 mt-10 -58.48 -37.12 74.87 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.587 0.232 . . . . 0.0 111.006 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -37.02 78.12 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.609 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.25 21.63 15.59 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.421 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -113.47 18.8 17.41 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.717 0.294 . . . . 0.0 111.506 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.47 28.59 4.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.246 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -117.21 -31.93 5.16 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.394 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.48 ' CE1' HG13 ' A' ' 98' ' ' VAL . 1.7 t60 -148.58 30.49 0.82 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 110.832 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.81 -40.93 54.09 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.121 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.27 -37.13 74.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.119 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.419 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 25.4 m-85 -77.82 -34.17 52.13 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.435 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -103.34 20.91 16.9 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -53.3 43.45 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-N 116.933 -0.121 . . . . 0.0 111.14 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -78.36 -5.78 15.17 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.349 2.032 . . . . 0.0 112.907 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -106.36 37.79 2.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.645 0.26 . . . . 0.0 110.93 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -121.39 -58.09 1.8 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.954 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.65 145.62 92.67 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.888 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.42 ' HA ' ' CB ' ' A' ' 48' ' ' ASP . 72.2 Cg_endo -76.96 -177.12 3.57 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.607 2.205 . . . . 0.0 112.679 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.5 m -112.6 79.76 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.041 0.448 . . . . 0.0 111.172 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.94 104.35 0.23 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.968 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.4 p -62.43 -39.8 85.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.548 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.26 -45.9 58.21 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.702 -0.227 . . . . 0.0 111.606 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.99 -48.48 44.56 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.0 mt -81.31 -21.48 39.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.59 58.41 5.42 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.458 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.92 75.93 1.69 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.898 0.38 . . . . 0.0 111.442 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -6.16 45.15 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.741 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.28 -20.01 57.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.385 0.136 . . . . 0.0 111.291 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.18 -41.42 83.85 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.751 -0.204 . . . . 0.0 111.012 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -64.04 -40.35 96.11 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.652 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.62 -44.31 90.94 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.818 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.4 mt -71.82 -51.68 30.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.076 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 mt -128.11 104.12 11.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.915 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -59.36 -29.89 68.01 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.512 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -110.27 81.51 2.28 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 120.817 0.341 . . . . 0.0 110.615 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.21 139.03 37.73 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.668 2.246 . . . . 0.0 112.603 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.7 tpp -149.56 138.56 21.18 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.245 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.42 ' CB ' ' HA ' ' A' ' 28' ' ' PRO . 26.0 m-20 -136.75 164.42 28.31 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.722 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -52.43 -41.43 63.24 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.719 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.5 t -65.41 -38.85 91.17 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.781 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -71.43 -43.31 66.97 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.114 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.404 HG21 ' OH ' ' A' ' 61' ' ' TYR . 8.4 mt -65.14 -45.12 95.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.175 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.24 -34.68 78.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -57.56 -40.25 78.53 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.983 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -60.25 -47.65 85.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.851 0.358 . . . . 0.0 110.121 179.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.5 tp -66.97 -33.42 75.54 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.595 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -64.11 -41.52 97.22 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.402 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.23 15.15 9.39 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? 58.96 27.85 16.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.588 0.233 . . . . 0.0 111.394 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.9 -32.83 45.9 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.63 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.419 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 1.8 m-85 -65.4 105.7 1.22 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.933 0.397 . . . . 0.0 110.844 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -32.16 70.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -162.97 165.28 25.15 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.87 0.367 . . . . 0.0 111.596 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -20.11 64.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.267 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 110.27 -0.271 . . . . 0.0 110.27 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -69.68 -34.18 73.6 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.887 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.419 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 3.1 t80 -59.2 -53.64 55.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.96 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.73 -35.94 90.77 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.373 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.67 -36.65 79.27 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -76.64 -38.99 53.72 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.167 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.6 t -67.04 -47.75 81.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.948 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -59.28 -33.73 71.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.591 0.234 . . . . 0.0 110.789 179.49 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 tt -71.87 -42.1 67.26 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.473 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 9.8 tpp -60.29 -46.6 89.27 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.197 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -55.71 -40.67 72.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.147 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.2 t -67.78 -41.81 82.65 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.014 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.41 -37.64 65.85 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.393 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -35.96 73.14 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.643 0.259 . . . . 0.0 111.073 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.85 -31.78 68.83 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.193 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.12 -36.03 80.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.748 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -35.94 22.27 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.06 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.404 ' HB3' HG23 ' A' ' 89' ' ' VAL . 15.8 m-20 -67.52 125.66 91.49 Favored Pre-proline 0 N--CA 1.466 0.325 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.071 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.92 158.5 11.04 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.981 2.454 . . . . 0.0 112.86 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -74.57 118.69 5.43 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.596 2.197 . . . . 0.0 112.478 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t0 62.57 70.58 0.56 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.071 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -132.53 156.69 46.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.302 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -57.09 -44.28 83.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.186 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.9 m -64.39 -31.88 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.753 0.311 . . . . 0.0 111.141 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.404 HG23 ' HB3' ' A' ' 82' ' ' ASN . 25.8 t -65.73 -40.32 87.46 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 93' ' ' ARG . . . -57.43 -34.42 68.92 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.918 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -33.04 73.81 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.73 66.01 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -68.1 -38.52 82.39 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.856 179.742 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -61.28 -44.98 96.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.78 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.14 -34.83 78.93 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.746 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -69.96 -41.65 74.22 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.593 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.38 -46.82 88.56 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.063 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.48 HG13 ' CE1' ' A' ' 18' ' ' HIS . 8.2 p -66.17 -42.92 92.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.898 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.88 -49.82 71.2 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.7 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.51 -40.97 98.43 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.85 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -47.75 84.54 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.68 0.276 . . . . 0.0 110.663 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -43.68 80.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.633 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -45.47 92.37 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.858 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.27 -42.56 95.65 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -70.24 -36.19 74.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.755 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -40.53 76.32 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.029 179.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.67 -42.55 17.99 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -178.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.45 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 . . . . . 0 N--CA 1.488 1.434 0 CA-C-O 120.706 0.289 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.8 -36.87 85.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.866 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.65 -44.14 96.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.845 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -67.86 -39.39 83.76 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.936 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.64 95.56 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.013 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.5 m -59.42 -37.24 77.55 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.786 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 m -55.05 -34.13 63.3 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.266 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.78 -47.4 91.15 Favored Glycine 0 C--N 1.337 0.614 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.399 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mt -64.02 -46.64 93.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.791 0.329 . . . . 0.0 110.317 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 tp -63.02 -35.67 81.0 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.634 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.47 -27.49 64.45 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.485 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HG3' ' HB2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -58.46 -36.54 73.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.359 0.123 . . . . 0.0 111.014 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.0 mtm -57.85 -37.23 73.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.721 0.295 . . . . 0.0 110.371 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.84 8.16 32.61 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.695 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.32 14.48 18.24 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.561 0.22 . . . . 0.0 111.48 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 68.53 32.24 4.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.984 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.2 mttm -123.17 -37.79 2.66 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -119.34 18.23 12.95 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.321 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.27 -29.98 48.28 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.278 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.61 -37.64 76.96 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.863 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.407 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 2.8 m-85 -80.16 -33.93 38.0 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -98.07 19.38 14.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.881 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.48 -51.34 68.05 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 121.405 -0.118 . . . . 0.0 111.055 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.23 -23.2 75.2 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.614 2.209 . . . . 0.0 112.806 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -123.87 34.64 5.02 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.927 0.394 . . . . 0.0 110.542 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -76.95 -46.84 22.73 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.776 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 166.6 11.59 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.842 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.22 -171.41 0.7 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.63 2.22 . . . . 0.0 112.436 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.7 m -113.18 76.35 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.045 0.45 . . . . 0.0 111.275 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -60.1 98.56 0.06 Allowed 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.1 p -60.54 -38.65 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.833 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -72.12 -46.88 54.9 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.52 -48.34 41.18 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.5 mt -80.81 -21.5 40.83 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.15 52.13 47.04 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.35 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.47 71.66 0.85 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.05 0.452 . . . . 0.0 111.288 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -67.17 -14.85 63.3 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.477 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.17 -19.76 58.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.401 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -61.28 -39.07 89.04 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 116.74 -0.209 . . . . 0.0 111.056 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -37.9 86.44 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.773 0.32 . . . . 0.0 110.561 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -67.48 -41.73 84.12 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.917 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 18.0 mt -77.71 -54.77 11.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.239 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.3 mm -100.95 104.74 16.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.082 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -66.95 -27.3 67.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.486 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.67 72.38 78.14 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.698 0.285 . . . . 0.0 110.802 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -58.0 132.17 47.94 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.359 . . . . 0.0 112.489 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -158.42 127.63 5.66 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.31 170.81 9.92 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.931 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.2 ttm -55.73 -36.56 67.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.895 0.379 . . . . 0.0 110.182 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.0 t -62.13 -38.93 90.81 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.677 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 m -73.29 -36.29 66.28 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.105 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.4 mt -66.51 -44.78 90.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.627 0.251 . . . . 0.0 110.981 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -35.33 80.15 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.154 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.6 p -57.47 -41.14 80.03 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.472 0.177 . . . . 0.0 111.13 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -46.55 88.78 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.74 -34.73 78.49 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.775 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.38 -41.41 93.73 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.4 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.66 15.28 11.3 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.31 27.55 16.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.649 0.261 . . . . 0.0 111.498 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -73.32 -32.74 64.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.743 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.462 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 4.6 m-85 -69.04 103.93 1.99 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.781 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -63.21 -29.39 70.74 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.476 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -166.41 179.68 5.44 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.904 0.383 . . . . 0.0 111.567 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.77 -20.94 61.08 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.409 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.86 -45.99 89.98 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.674 0.273 . . . . 0.0 110.327 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.76 -30.14 69.52 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.797 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.462 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -59.85 -49.74 76.53 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.595 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.92 -33.11 77.22 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.513 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.73 -35.87 75.44 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.567 0.222 . . . . 0.0 111.17 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.3 61.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.811 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.7 t -64.82 -48.32 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.081 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -33.75 74.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.031 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.3 tp -70.69 -47.06 61.79 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.62 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.7 ttp -60.49 -43.83 96.58 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.414 ' CE2' ' HB2' ' A' ' 96' ' ' GLN . 3.2 m-85 -58.43 -43.51 88.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 t -59.27 -45.54 90.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.735 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -70.48 -39.92 73.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.724 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -42.5 91.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.106 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -58.12 -39.77 79.55 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.132 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.85 -45.65 73.99 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.978 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -72.17 -39.84 68.39 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.197 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -67.9 125.25 91.15 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.187 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.32 164.46 34.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.714 2.276 . . . . 0.0 112.428 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.38 128.91 11.55 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.562 2.175 . . . . 0.0 112.585 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.8 t0 60.2 68.07 0.8 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.0 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -131.63 157.8 42.73 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.28 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.33 -44.31 84.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.039 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.8 m -64.17 -32.87 59.13 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.163 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 23.9 t -68.74 -44.62 82.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.31 73.2 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.884 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 42.1 mtt -66.07 -40.27 90.75 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.87 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.36 90.21 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -49.12 79.05 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.407 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.1 tttm -66.57 -39.21 88.36 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.891 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -35.16 76.47 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.414 ' HB2' ' CE2' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -68.98 -44.58 72.6 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.739 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.51 -46.71 84.83 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.28 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.3 p -62.22 -43.13 97.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.14 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -49.65 70.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.669 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -42.92 99.75 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -48.01 83.36 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.996 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 106' ' ' MET . 0.0 OUTLIER -67.23 -44.27 79.9 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.912 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -59.83 -48.67 80.76 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.856 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.87 -37.59 84.72 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.521 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -72.1 -44.21 63.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 1.3 tmm? -67.03 -45.09 78.54 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.382 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -40.14 35.63 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.891 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.411 -179.666 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 120.744 0.307 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -59.58 -42.56 92.77 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.769 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.78 -46.11 83.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.813 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -33.6 74.01 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.954 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.57 -43.38 85.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.674 0.273 . . . . 0.0 110.724 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 93.9 m -62.55 -40.77 97.88 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.464 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -36.08 75.21 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.057 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.29 91.89 Favored Glycine 0 C--N 1.335 0.52 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.359 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.52 -47.51 86.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.705 0.288 . . . . 0.0 110.502 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.26 -35.61 80.92 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.16 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mttp -57.96 -31.14 66.58 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.229 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.42 ' CG ' ' HD3' ' A' ' 17' ' ' LYS . 4.3 tt0 -59.65 -38.07 80.42 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.502 0.192 . . . . 0.0 110.985 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -61.67 -38.12 86.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.727 0.299 . . . . 0.0 110.484 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -96.35 -1.74 47.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.609 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.6 9.83 22.64 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 75.65 20.85 1.79 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.612 0.365 . . . . 0.0 111.335 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.42 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 9.8 mtpt -108.73 -38.94 5.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.32 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.448 ' NE2' HG13 ' A' ' 98' ' ' VAL . 6.6 m-70 -121.44 16.35 11.3 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.289 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.08 -32.42 59.25 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.336 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.75 96.03 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.738 0.304 . . . . 0.0 111.039 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -72.84 -36.32 67.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.906 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.29 24.89 10.82 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.498 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.458 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.41 -57.73 16.34 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.388 -179.647 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 24.5 Cg_endo -62.01 -17.15 54.41 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.372 2.048 . . . . 0.0 113.002 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.37 35.51 3.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 111.08 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.99 -35.61 37.2 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.633 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.417 ' HB2' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -119.63 156.64 53.44 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.369 -179.759 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.417 ' HD2' ' HB2' ' A' ' 27' ' ' LYS . 29.6 Cg_endo -63.19 -178.55 0.46 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.902 2.402 . . . . 0.0 112.714 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.7 m -114.89 86.69 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.13 0.491 . . . . 0.0 111.156 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.44 103.56 0.25 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.713 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.2 p -59.71 -40.94 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.14 -46.05 58.05 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.01 48.77 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 mt -81.91 -21.57 37.27 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.29 64.27 2.94 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.566 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.53 79.46 1.8 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.313 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -10.26 59.29 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.662 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -76.23 -19.64 58.18 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.418 0.151 . . . . 0.0 111.34 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -57.75 -34.71 69.82 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.508 0.194 . . . . 0.0 111.141 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 35.2 t -65.21 -37.45 87.34 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.83 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -75.83 -43.41 46.08 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.213 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.404 HD13 ' CE2' ' A' ' 81' ' ' TYR . 45.7 mt -74.12 -61.6 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.279 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.8 mm -90.96 106.62 17.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.28 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 pttp -66.14 -33.69 76.36 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -124.71 94.38 44.5 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.708 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.22 110.97 2.13 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.679 2.253 . . . . 0.0 112.364 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.7 tpp -144.21 133.32 22.88 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.68 163.57 27.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.184 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 67.6 mtt -54.72 -38.25 66.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.928 -179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 t -62.36 -38.15 88.42 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.604 0.24 . . . . 0.0 110.824 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 91.3 m -74.17 -39.84 62.95 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.993 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 9.2 mt -65.35 -45.08 94.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 120.574 0.226 . . . . 0.0 111.07 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -36.51 83.28 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.9 t -57.72 -39.43 77.26 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.917 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -49.57 77.07 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.8 tp -61.16 -34.08 74.46 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.468 179.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -65.29 -37.34 86.86 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.118 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.77 15.27 8.56 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 60.83 27.25 17.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.624 0.25 . . . . 0.0 111.546 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -34.21 53.85 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.803 0.335 . . . . 0.0 110.583 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.445 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 6.0 m-85 -78.78 107.29 11.38 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.797 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -92.16 -27.38 17.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.222 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -139.15 164.06 30.78 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.894 0.378 . . . . 0.0 111.64 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.73 -18.63 60.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.509 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -45.2 93.73 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.593 0.235 . . . . 0.0 110.457 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -70.49 -36.81 74.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.705 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.445 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 5.6 t80 -63.98 -53.81 44.31 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.901 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.12 -31.51 77.04 Favored Glycine 0 C--N 1.334 0.461 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.661 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.77 94.65 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 111.446 0.165 . . . . 0.0 111.446 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.91 -39.12 83.63 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.2 -48.22 84.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.972 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -64.83 -34.07 77.49 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.145 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -47.81 84.35 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.876 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -60.54 -41.02 93.63 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.949 179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -58.23 -46.36 86.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.93 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.7 m -63.33 -42.03 98.93 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.765 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.3 m-20 -69.27 -34.17 74.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.885 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.07 -33.77 73.86 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.262 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -60.65 -34.21 73.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.095 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.35 -41.25 73.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.853 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.404 ' CE2' HD13 ' A' ' 42' ' ' ILE . 1.1 t80 -78.55 -34.98 46.73 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.306 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 -92.28 111.83 52.29 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.267 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.406 ' HG2' ' CD2' ' A' ' 86' ' ' HIS . 41.7 Cg_endo -66.64 156.44 65.69 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.753 2.302 . . . . 0.0 112.312 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -66.95 154.66 73.89 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.58 2.187 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.67 37.75 15.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.187 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.406 ' CD2' ' HG2' ' A' ' 83' ' ' PRO . 2.5 t-80 -120.04 150.34 40.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.156 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -44.02 85.33 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.7 p -56.76 -36.33 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.554 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 15.6 t -61.04 -44.48 98.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.659 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.65 -36.63 72.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.048 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.4 mtp -62.54 -44.14 97.07 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.898 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -40.66 96.9 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.319 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -47.96 82.76 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.716 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -62.83 -41.59 99.39 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.98 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -37.47 82.91 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.899 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -70.05 -41.83 73.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.656 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.67 -46.95 88.4 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.171 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.448 HG13 ' NE2' ' A' ' 18' ' ' HIS . 9.2 p -68.0 -42.92 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.195 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -64.4 -51.54 62.72 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.569 0.223 . . . . 0.0 110.777 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -60.62 -44.09 96.74 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.075 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 4.7 mtp -60.09 -46.73 88.6 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.987 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.08 77.81 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.147 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -42.92 95.97 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.614 -0.267 . . . . 0.0 110.887 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.98 -32.77 73.41 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.91 -44.22 70.11 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.795 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.0 ptm -69.38 -34.67 74.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.359 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.09 -42.38 17.48 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.074 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.731 0.3 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -62.08 -43.84 97.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.901 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.87 -36.83 75.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.092 179.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -61.47 -34.79 76.05 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.956 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 47.7 t -62.38 -39.21 92.45 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.881 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.4 m -59.68 -38.57 81.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.881 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.2 t -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.75 -38.09 93.37 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.37 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.2 mt -66.68 -45.86 87.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-O 120.748 0.308 . . . . 0.0 110.38 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.52 80.32 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.802 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mtpp -58.38 -28.2 64.94 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.712 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 89.7 mt-10 -58.71 -36.45 74.27 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.585 0.231 . . . . 0.0 110.68 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 6.6 mtt -59.56 -37.23 77.89 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.556 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.67 1.9 38.1 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.423 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . . . -97.22 19.5 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.647 0.26 . . . . 0.0 111.637 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 mmtt 68.62 28.59 5.72 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.304 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.2 mttt -116.1 -31.25 5.75 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.967 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 29.95 1.3 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.801 0.334 . . . . 0.0 110.805 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.15 -36.63 47.42 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.35 -31.36 69.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.264 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.41 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 23.8 m-85 -86.23 -29.81 22.86 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.584 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -113.24 23.25 13.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.554 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.5 t90 -62.77 -53.91 52.05 Favored Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 122.481 -0.137 . . . . 0.0 110.913 179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.554 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 92.4 Cg_endo -83.94 -16.77 6.2 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.634 2.223 . . . . 0.0 113.539 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -101.8 33.54 2.97 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.634 0.254 . . . . 0.0 111.61 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -107.27 -46.07 3.96 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.054 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -85.62 161.21 51.61 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.235 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -68.73 166.47 26.03 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.837 2.358 . . . . 0.0 112.743 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.8 m -90.43 82.41 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.152 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -59.74 105.1 0.34 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.053 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.37 -40.34 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.744 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -72.22 -45.06 61.82 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.27 -48.43 51.02 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.1 mt -80.75 -21.74 40.81 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.26 52.19 18.81 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.476 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.17 75.74 1.64 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.97 0.414 . . . . 0.0 111.346 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.26 -11.47 60.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.409 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -17.42 59.45 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.458 0.169 . . . . 0.0 111.458 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -55.79 -39.53 71.4 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.501 0.191 . . . . 0.0 111.129 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.37 -36.51 83.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.678 0.275 . . . . 0.0 110.65 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.78 -45.02 46.45 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.407 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.9 mt -75.4 -52.97 17.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.706 0.288 . . . . 0.0 111.427 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.1 mm -92.2 104.85 16.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.154 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -72.1 -34.15 68.4 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.365 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -114.37 92.37 27.55 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.83 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.34 128.4 18.29 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.677 2.252 . . . . 0.0 112.563 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.86 139.98 14.25 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.384 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.1 164.03 32.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.283 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.7 mtt -58.05 -36.48 72.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.909 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.0 t -61.8 -34.69 76.37 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.63 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.45 -36.47 63.35 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.175 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 mt -68.65 -44.62 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-O 120.676 0.274 . . . . 0.0 110.828 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -62.59 -45.37 93.23 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.203 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 p -57.59 -39.12 76.08 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.806 -0.179 . . . . 0.0 110.875 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.42 ' HD3' ' CZ ' ' A' ' 61' ' ' TYR . 20.2 tttp -60.35 -48.66 80.77 Favored 'General case' 0 N--CA 1.462 0.137 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -35.5 81.34 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.318 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.32 -37.34 86.88 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.279 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.04 15.23 7.62 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.79 27.42 17.2 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.281 0.232 . . . . 0.0 111.597 -179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -80.84 -34.53 33.76 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.725 0.297 . . . . 0.0 110.674 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.42 ' CZ ' ' HD3' ' A' ' 55' ' ' LYS . 3.3 m-85 -77.4 93.37 4.06 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.489 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.0 mtt85 -65.42 -28.87 69.55 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.808 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -159.27 174.08 15.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.861 0.362 . . . . 0.0 111.366 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -10.39 59.68 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.888 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -62.99 -47.65 82.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.569 0.223 . . . . 0.0 110.614 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -72.97 -39.22 66.31 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.579 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -58.41 -53.7 55.31 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.88 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.27 -36.21 90.24 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.446 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.31 96.43 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.606 0.241 . . . . 0.0 110.986 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.98 -37.21 69.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.226 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.7 t -64.11 -48.46 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.384 0.135 . . . . 0.0 111.272 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -64.7 -32.87 74.73 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.734 -0.212 . . . . 0.0 111.2 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -47.13 74.73 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.806 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttm -59.3 -44.34 92.53 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.228 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -58.01 -42.26 84.86 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.046 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.06 -45.47 90.7 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.93 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.5 m-20 -74.73 -33.09 62.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.121 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -39.29 79.69 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.985 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -64.56 -32.18 73.72 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -67.88 -36.46 80.29 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.801 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -82.39 -38.15 24.53 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.333 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -63.56 111.12 4.55 Favored Pre-proline 0 N--CA 1.466 0.357 0 CA-C-N 116.64 -0.254 . . . . 0.0 111.21 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.62 145.91 87.94 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.941 2.427 . . . . 0.0 112.513 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -56.14 135.96 72.65 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.662 2.241 . . . . 0.0 112.384 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 t70 60.27 60.04 2.15 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -130.66 151.93 50.57 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.94 -43.97 86.65 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.158 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -62.51 -32.15 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.599 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.5 t -62.77 -45.36 99.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.695 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -41.2 86.69 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.603 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.2 mtt -65.74 -43.39 89.13 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.745 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.58 -47.74 78.9 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.212 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -63.01 -48.92 76.71 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.829 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.41 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 36.0 tttp -62.48 -41.52 98.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.822 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.47 -36.09 82.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.695 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -70.06 -44.28 69.47 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.765 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.17 -46.81 88.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.239 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.6 p -64.73 -42.77 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.922 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -51.32 62.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.436 0.16 . . . . 0.0 110.787 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -46.25 87.83 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.998 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -46.28 90.26 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.839 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -67.07 -43.98 81.24 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.822 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.14 -42.47 94.89 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.82 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.58 -32.84 74.65 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -71.52 -44.17 65.14 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.084 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 4.7 ptm -69.28 -36.06 76.68 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.322 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.5 -41.56 21.53 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.747 -0.206 . . . . 0.0 110.863 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.987 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.744 0.307 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -61.38 -43.44 98.86 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.856 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.99 -40.54 95.1 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.725 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.04 -34.6 78.44 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.144 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.62 -38.15 86.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.737 0.303 . . . . 0.0 110.775 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.0 m -64.52 -37.37 87.31 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.314 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.0 p -58.5 -40.99 84.36 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.7 -0.227 . . . . 0.0 111.147 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -63.07 -45.87 94.58 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.073 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.2 mt -64.28 -45.56 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 120.718 0.294 . . . . 0.0 110.29 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.34 -35.53 80.69 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.641 179.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -58.15 -27.88 64.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.443 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.31 -36.33 73.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.406 0.146 . . . . 0.0 110.859 179.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.9 mmt -57.46 -37.54 73.03 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.499 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.92 10.78 28.39 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.65 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.46 11.21 24.71 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 75.2 26.9 1.16 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 122.578 0.351 . . . . 0.0 111.196 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -121.51 -34.89 3.35 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.402 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.8 OUTLIER -132.83 22.82 4.23 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.622 0.249 . . . . 0.0 111.016 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.97 -36.2 72.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.992 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.34 -36.41 66.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.215 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -75.84 -35.36 59.98 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.39 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -106.57 23.49 14.15 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -54.59 5.35 Favored Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 116.923 -0.126 . . . . 0.0 111.244 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -85.59 12.6 3.0 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.621 2.214 . . . . 0.0 113.23 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -130.53 56.13 1.78 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.03 0.443 . . . . 0.0 110.785 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.19 -48.82 1.0 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.051 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -64.77 154.08 86.38 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-O 120.599 0.238 . . . . 0.0 111.07 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.72 179.12 6.81 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.851 2.368 . . . . 0.0 112.737 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.7 m -92.57 68.9 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.018 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -59.49 98.97 0.05 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.067 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.11 -37.1 77.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.749 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.11 -45.83 59.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.584 0.216 . . . . 0.0 111.584 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.61 -47.71 45.58 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -80.94 -21.56 40.35 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.65 50.35 49.26 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.385 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -121.33 63.2 0.89 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.438 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -62.25 -18.2 60.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.448 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -76.06 -19.72 58.36 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.58 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -54.81 -39.11 68.14 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.617 0.246 . . . . 0.0 110.939 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -65.04 -40.44 94.81 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.8 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.46 -43.13 91.32 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.31 -45.4 75.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.965 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.7 mt -127.45 111.7 25.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.951 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -72.25 -29.86 64.32 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.358 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -118.68 66.96 7.36 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 110.784 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.82 156.42 39.39 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.769 2.313 . . . . 0.0 112.546 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.8 tpp -158.89 160.34 36.01 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.17 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -148.21 166.06 29.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.51 -37.3 70.25 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -65.67 -41.33 92.59 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.401 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -65.04 -41.03 95.59 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.047 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 18.0 mt -67.57 -44.9 86.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.9 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.45 -34.85 77.62 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.979 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.5 t -57.55 -42.23 82.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.041 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.75 -48.02 83.66 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.797 0.332 . . . . 0.0 110.177 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.3 tp -64.7 -33.69 76.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.844 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.23 -41.49 98.46 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.415 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.84 15.24 10.17 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 59.11 27.39 16.35 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.651 0.263 . . . . 0.0 111.551 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.42 -32.22 58.36 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.706 0.289 . . . . 0.0 110.687 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.403 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 1.8 m-85 -71.02 100.19 1.95 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.3 ttp85 -63.42 -31.54 72.72 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.141 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -162.65 174.56 12.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.826 0.346 . . . . 0.0 111.42 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.83 -14.55 62.81 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.885 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -46.61 87.51 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.663 0.268 . . . . 0.0 110.394 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.68 -35.48 72.83 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.013 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.403 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 3.3 t80 -61.88 -52.07 65.61 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -56.41 -33.36 61.85 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.631 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.51 96.01 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.562 0.22 . . . . 0.0 111.165 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.55 -36.68 84.58 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.423 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -63.06 -48.39 88.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 120.713 0.292 . . . . 0.0 110.789 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.1 mmp_? -64.96 -40.15 94.56 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.621 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -41.88 95.32 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.753 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.1 ttp -62.71 -46.61 87.3 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.556 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -36.21 74.15 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 38.5 m -60.57 -47.48 86.01 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.044 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -75.99 -31.55 59.02 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 121.096 -0.242 . . . . 0.0 111.07 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.28 -33.58 76.15 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.219 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.53 -37.29 75.35 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.534 0.207 . . . . 0.0 111.28 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -72.61 -39.71 67.07 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -78.24 -38.48 42.86 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.721 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.41 ' HB3' HG21 ' A' ' 89' ' ' VAL . 30.8 m-20 -62.53 128.13 91.08 Favored Pre-proline 0 N--CA 1.465 0.295 0 CA-C-O 120.554 0.216 . . . . 0.0 111.073 -179.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.68 135.5 16.14 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.602 2.201 . . . . 0.0 112.392 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -57.39 128.16 28.4 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.741 2.294 . . . . 0.0 112.406 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.0 t0 65.53 71.7 0.43 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.154 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -141.65 148.21 38.78 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.077 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -56.6 -43.08 79.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.364 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.06 -35.74 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.13 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 82' ' ' ASN . 30.0 t -66.4 -45.15 90.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.836 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.94 -39.04 80.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.814 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 24.8 mtt -63.05 -43.29 99.04 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.728 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.52 -48.61 80.25 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.5 mpp_? -54.62 -44.07 72.82 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.679 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -37.95 89.28 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.737 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.402 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -61.7 -37.26 83.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.972 179.571 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.03 -43.98 73.64 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.034 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.64 -46.59 89.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.34 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.53 -42.77 93.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.079 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.17 -50.32 66.39 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.913 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.55 -43.53 93.5 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.986 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -47.47 85.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.777 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? -67.86 -39.29 83.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.913 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -41.61 93.92 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.103 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.28 -32.91 74.81 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.284 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.4 tttp -69.72 -44.54 70.12 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.064 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 8.5 ptm -69.13 -33.38 73.36 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.089 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 12.9 mt -83.75 -41.55 17.5 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.273 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.052 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.684 0.278 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -61.67 -37.57 84.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.846 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mt -63.58 -46.91 83.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.065 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.19 -42.16 96.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.91 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.54 -44.35 96.57 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.5 m -58.96 -39.51 81.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.745 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 33.1 t -57.54 -41.13 80.33 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.055 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.12 94.46 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.578 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mt -64.12 -46.25 94.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.719 0.295 . . . . 0.0 110.459 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 mt -62.75 -35.83 81.08 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.714 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -33.45 69.31 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.333 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.419 ' HA ' ' HB1' ' A' ' 15' ' ' ALA . 1.4 tt0 -58.55 -36.65 74.24 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.212 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.45 -36.98 72.11 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.431 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.67 12.62 22.6 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB1' ' HA ' ' A' ' 12' ' ' GLU . . . -96.71 17.86 15.6 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.724 0.297 . . . . 0.0 111.307 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 72.21 25.25 2.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.372 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.405 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 15.4 mtmt -118.69 -34.33 4.01 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.09 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.441 ' NE2' HG12 ' A' ' 98' ' ' VAL . 1.3 m-70 -132.42 21.72 4.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.001 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.8 -34.69 67.06 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.448 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.05 -40.28 68.45 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.744 0.306 . . . . 0.0 111.09 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -73.51 -34.21 65.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -111.62 28.69 8.51 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.456 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -68.33 -52.16 22.28 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.19 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.456 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.4 Cg_endo -85.5 11.15 3.44 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.554 2.17 . . . . 0.0 113.02 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -129.93 55.34 1.79 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.03 0.443 . . . . 0.0 110.825 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.86 -63.95 0.56 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.004 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.74 143.41 98.55 Favored Pre-proline 0 CA--C 1.531 0.241 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.834 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -57.31 156.66 24.65 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.91 2.407 . . . . 0.0 112.864 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.1 m -95.32 84.09 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.037 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.5 106.56 0.79 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.028 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.7 p -61.46 -38.42 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.621 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.3 -44.44 62.73 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.611 0.243 . . . . 0.0 111.483 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.73 43.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.3 mt -81.12 -21.54 39.79 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 57.19 7.37 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.424 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.34 64.04 1.25 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.04 0.448 . . . . 0.0 111.303 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -67.63 -13.06 61.76 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.67 179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.23 -20.08 57.77 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.404 0.145 . . . . 0.0 111.237 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -59.66 -35.65 74.85 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.557 0.218 . . . . 0.0 110.764 179.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.8 t -64.51 -38.68 91.85 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.947 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -67.18 -39.57 86.42 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.571 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.8 mt -74.13 -44.58 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.991 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.438 HG12 ' HB3' ' A' ' 77' ' ' ASN . 3.5 mp -137.82 137.01 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.656 0.265 . . . . 0.0 111.457 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -93.04 -25.45 17.94 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.804 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.91 79.82 2.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.71 153.77 38.74 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.707 2.271 . . . . 0.0 112.697 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.435 ' HB3' ' HG2' ' A' ' 74' ' ' MET . 5.6 ttm -165.64 158.87 15.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.362 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -144.28 163.95 32.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.565 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.6 ttm -54.98 -35.44 64.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.849 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 t -66.88 -40.94 87.93 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.747 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.7 m -66.83 -40.77 88.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 60.5 mt -66.81 -44.06 89.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 CA-C-O 120.78 0.324 . . . . 0.0 110.395 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.76 -36.61 82.84 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.326 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -42.31 82.25 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.432 0.16 . . . . 0.0 111.432 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -62.72 -49.55 74.6 Favored 'General case' 0 N--CA 1.461 0.102 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.8 -34.75 76.46 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.585 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -59.44 -40.58 87.24 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.05 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.67 15.34 11.2 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.19 28.37 14.01 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.303 0.241 . . . . 0.0 111.636 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -75.45 -37.35 60.39 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.678 0.275 . . . . 0.0 110.84 179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -75.88 97.46 3.95 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.542 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -78.12 -31.85 50.11 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -126.55 142.59 51.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.816 0.341 . . . . 0.0 111.105 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.03 -19.36 64.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.844 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -47.98 80.85 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.677 0.275 . . . . 0.0 110.543 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -62.31 -38.26 88.75 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.777 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -59.43 -53.85 53.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.88 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.78 87.74 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.711 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.2 74.72 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.571 0.224 . . . . 0.0 111.197 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.61 -39.93 64.2 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.312 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.7 t -63.67 -48.41 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.683 0.278 . . . . 0.0 110.646 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -64.95 -39.1 92.98 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.755 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.81 -46.07 83.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.671 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.435 ' HG2' ' HB3' ' A' ' 47' ' ' MET . 4.8 tpp -65.49 -41.73 92.93 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.353 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -55.9 -44.96 78.73 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 110.752 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.6 t -62.2 -40.69 96.9 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.733 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.438 ' HB3' HG12 ' A' ' 43' ' ' ILE . 80.6 m-20 -68.03 -46.04 72.29 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.059 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.23 -35.48 79.03 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.465 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.38 -33.46 67.85 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.883 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -64.87 -36.74 85.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.584 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.93 -37.41 29.59 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.162 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -61.14 111.16 3.78 Favored Pre-proline 0 N--CA 1.469 0.486 0 CA-C-O 120.488 0.185 . . . . 0.0 111.076 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -61.46 163.81 16.95 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.859 2.373 . . . . 0.0 112.505 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.37 151.14 65.43 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.644 2.229 . . . . 0.0 112.401 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 53.22 49.29 20.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.408 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -116.25 141.31 48.32 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.828 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -41.18 75.71 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.977 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 14.1 m -59.68 -32.79 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.578 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 32.9 t -65.71 -44.45 93.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.702 0.287 . . . . 0.0 110.574 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.32 93.87 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.876 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 11.8 mtt -61.28 -42.95 99.51 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.959 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.64 -44.66 81.5 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.269 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.68 -47.04 87.13 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -65.85 -40.22 91.5 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.2 mt -63.69 -38.79 92.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.962 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -70.16 -41.51 73.71 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.782 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -61.36 -46.86 88.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.143 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.441 HG12 ' NE2' ' A' ' 18' ' ' HIS . 9.3 p -66.06 -43.05 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.012 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -63.68 -50.14 70.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.722 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.9 -43.21 94.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.981 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -47.86 84.15 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.635 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -43.02 87.07 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.682 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.64 -41.92 91.58 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.064 179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.03 -37.08 80.95 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.907 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -67.07 -44.78 79.23 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.4 ptm -69.53 -33.46 72.83 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.256 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 19.1 mt -81.37 -42.1 20.97 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.356 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.406 179.834 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.762 0.315 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -66.62 -35.14 79.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.877 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.1 mt -61.03 -44.48 97.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.78 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -35.21 70.85 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.116 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -39.3 84.33 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.653 0.264 . . . . 0.0 110.83 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.3 m -63.1 -37.74 88.41 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.34 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.1 p -57.39 -33.72 68.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.642 -0.253 . . . . 0.0 111.129 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.44 -43.05 97.77 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.325 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 48.9 mt -64.03 -42.45 95.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.915 0.388 . . . . 0.0 110.498 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.2 mt -63.74 -35.65 81.28 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.698 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -30.8 67.19 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.748 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.61 -36.72 74.48 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.296 0.093 . . . . 0.0 111.173 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -37.63 76.29 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.651 0.262 . . . . 0.0 110.492 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.08 6.45 35.93 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.47 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.04 13.67 16.14 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.566 0.222 . . . . 0.0 111.515 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 72.64 23.44 3.01 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.474 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.9 mtmm -115.33 -33.69 5.22 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.945 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -126.27 20.07 7.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.131 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.14 -33.98 61.6 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.62 67.52 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.333 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.404 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 6.8 m-85 -83.5 -32.66 25.82 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.381 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.45 24.06 12.25 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -56.79 13.08 Favored Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.788 -0.187 . . . . 0.0 110.87 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -78.17 -4.17 14.08 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.536 2.158 . . . . 0.0 113.167 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -113.76 45.12 1.5 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.734 0.302 . . . . 0.0 110.998 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.79 -56.84 1.19 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.947 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 3.0 pttp -77.37 130.85 73.29 Favored Pre-proline 0 C--O 1.232 0.175 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.905 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 36.7 Cg_exo -60.52 -177.56 0.17 Allowed 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.858 2.372 . . . . 0.0 112.637 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.4 m -123.93 77.09 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.062 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.21 106.29 0.26 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.728 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.4 p -59.28 -40.11 80.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.672 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -72.36 -46.8 53.8 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.25 -47.66 55.8 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.4 mt -81.59 -21.33 38.45 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.74 63.82 2.76 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.373 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.18 70.07 0.72 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.76 0.314 . . . . 0.0 111.132 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 16.9 m170 -65.62 -12.83 56.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.417 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.87 -19.96 21.16 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.534 0.207 . . . . 0.0 111.186 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -38.34 87.0 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.102 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -31.59 72.83 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.001 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -78.43 -47.2 18.02 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.753 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.2 mt -69.88 -38.76 76.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.321 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 32.2 mm -124.85 128.28 73.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.496 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -34.96 19.78 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.289 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -128.14 77.28 77.0 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-O 120.796 0.331 . . . . 0.0 111.004 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.83 128.45 15.06 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.779 2.319 . . . . 0.0 112.562 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 44.5 mtp -145.66 139.5 26.63 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.251 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -123.71 171.05 9.89 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.189 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 mtm -57.77 -43.11 85.27 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.198 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.0 -39.65 92.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.788 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.2 m -64.36 -44.46 91.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.646 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 15.2 mt -65.32 -44.31 94.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.433 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.87 73.58 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.2 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.5 p -57.48 -41.4 80.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.124 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -60.59 -49.63 76.75 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.02 -34.57 76.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.361 178.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.26 -37.18 86.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.997 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.55 15.29 9.65 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 62.45 28.44 16.8 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -76.99 -36.95 56.05 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.647 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -79.42 100.62 7.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.893 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 ttt-85 -64.91 -31.62 72.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -159.54 -177.44 6.4 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.931 0.396 . . . . 0.0 111.357 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.29 -12.67 61.57 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.788 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -47.37 83.64 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.671 0.272 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -73.5 -37.64 65.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.717 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -61.35 -53.04 61.8 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.031 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.94 -33.29 78.15 Favored Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.663 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.61 91.26 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.623 0.249 . . . . 0.0 111.108 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.34 -33.9 70.03 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.364 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.38 -48.47 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.623 0.249 . . . . 0.0 110.906 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.3 mtt180 -61.12 -36.81 80.71 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.847 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.67 -44.68 96.49 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.764 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.2 ttm -63.68 -46.75 84.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -58.38 -43.9 88.69 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.153 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.2 t -60.55 -43.25 97.42 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.041 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -73.47 -46.72 46.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -34.0 72.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.238 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -57.12 -35.87 69.99 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.014 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -66.5 -41.97 88.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.846 179.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -76.06 -31.26 58.7 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.297 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -91.9 102.59 6.38 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.257 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.12 133.4 26.64 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.617 2.211 . . . . 0.0 112.24 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -57.52 165.38 6.05 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.725 2.283 . . . . 0.0 112.674 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.36 31.22 8.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.02 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -127.5 142.6 51.35 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.943 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -56.73 -37.55 71.14 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.101 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.2 p -61.8 -40.22 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.389 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.0 t -67.49 -39.95 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.82 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.28 -34.34 66.35 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.81 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -47.43 83.66 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.406 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.83 -44.73 96.26 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -42.83 87.88 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.509 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.404 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 2.8 tttp -66.36 -41.91 88.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.585 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.54 -36.46 84.3 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -46.95 64.18 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.883 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -46.68 89.31 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.9 p -62.61 -43.0 98.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.51 0.195 . . . . 0.0 110.775 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -49.22 70.86 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.401 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -41.29 94.12 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.957 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.0 mtm -61.23 -47.76 84.61 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -43.82 81.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.631 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.27 -50.98 71.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.805 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.01 -37.99 89.4 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.1 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.9 mtpt -69.48 -41.35 76.27 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.738 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.93 75.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.211 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.51 -41.69 60.23 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.725 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.108 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.789 0.328 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -60.9 -36.86 80.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.848 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.91 -43.72 91.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.93 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -67.7 -40.66 84.3 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -38.16 88.55 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.085 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.9 m -60.21 -38.93 84.84 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.935 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -60.87 -37.0 80.65 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.019 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.3 -36.92 90.92 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.54 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.4 mt -64.13 -45.91 95.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.67 -35.35 79.39 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.839 179.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -57.62 -32.55 67.34 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.496 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.45 ' CG ' ' HD2' ' A' ' 17' ' ' LYS . 5.6 tt0 -60.32 -36.66 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.386 0.136 . . . . 0.0 110.954 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.8 mtt -59.27 -37.0 76.54 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.93 4.79 37.94 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.01 12.92 16.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 77.96 24.09 0.72 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.858 0.463 . . . . 0.0 111.43 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.45 ' HD2' ' CG ' ' A' ' 12' ' ' GLU . 54.0 mttp -113.79 -32.7 6.04 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.827 179.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.406 ' NE2' HG13 ' A' ' 98' ' ' VAL . 0.4 OUTLIER -137.76 25.81 2.8 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.878 179.226 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.68 -40.26 23.08 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.204 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.21 81.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.237 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -77.71 -33.38 53.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.394 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -112.06 25.99 11.03 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.438 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -69.37 -56.6 8.15 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 116.929 -0.123 . . . . 0.0 110.938 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.438 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 86.4 Cg_endo -81.82 -22.96 4.98 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.473 2.115 . . . . 0.0 112.987 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.12 35.52 1.73 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.639 0.257 . . . . 0.0 111.567 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.53 -38.42 6.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.829 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.5 mmtt -74.86 156.14 86.5 Favored Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.359 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.8 -172.32 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.921 2.414 . . . . 0.0 112.682 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.57 68.82 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 121.12 0.486 . . . . 0.0 111.612 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.85 108.4 1.18 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.977 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -60.84 -40.75 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.534 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.19 -44.97 62.18 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.51 -48.87 46.09 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.4 mt -81.09 -21.67 39.78 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.52 61.78 3.73 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.447 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.45 78.65 1.79 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.935 0.398 . . . . 0.0 111.244 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -7.66 46.1 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.867 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.22 -19.92 57.93 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.439 0.161 . . . . 0.0 111.284 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -44.72 94.08 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.853 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 22.4 t -61.21 -39.46 90.32 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.933 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.94 -35.29 80.18 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.729 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.4 mt -80.71 -49.65 18.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.168 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 26.5 mt -147.75 132.89 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.1 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.7 pttt -86.18 -20.08 29.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.753 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -107.46 86.03 2.54 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.044 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.2 143.35 39.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.769 2.313 . . . . 0.0 112.691 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -151.69 122.9 7.71 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.114 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -130.99 162.75 29.08 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.146 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.5 mtm -55.78 -40.85 73.24 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.37 -41.76 98.82 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -64.08 -40.94 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.986 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.41 HG22 ' OH ' ' A' ' 61' ' ' TYR . 12.4 mt -70.58 -45.15 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -38.39 87.41 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.026 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.6 t -57.32 -41.34 79.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.844 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -60.49 -48.36 82.09 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 16.3 tp -64.26 -34.46 78.16 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.48 -39.56 94.79 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.311 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.22 15.21 9.28 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.5 27.14 16.78 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -75.5 -34.09 60.81 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.724 0.297 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.475 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 5.2 m-85 -71.06 104.65 3.08 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.581 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -28.69 66.63 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.34 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -159.71 167.94 27.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.769 0.319 . . . . 0.0 111.286 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.4 63.36 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.515 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -62.78 -42.68 99.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.657 0.265 . . . . 0.0 110.558 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -70.85 -33.18 70.39 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.817 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.475 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 15.3 t80 -62.48 -48.34 80.03 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.89 -32.91 81.37 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.622 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.66 -44.2 96.71 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.613 0.244 . . . . 0.0 111.152 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.76 -33.46 75.72 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.2 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.27 -46.64 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.723 0.297 . . . . 0.0 110.575 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -63.35 -39.51 94.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.714 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.1 tt -70.67 -43.33 69.33 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.794 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 9.0 tmm? -60.42 -44.69 95.5 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.012 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -59.15 -40.66 86.24 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.984 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.4 m -62.33 -44.6 96.12 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -71.43 -40.34 70.49 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.903 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -38.0 84.97 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.035 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.84 -40.11 95.82 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.054 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.5 ttpt -75.14 -36.11 61.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.865 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -69.07 -35.3 76.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -82.01 136.84 46.86 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-O 120.63 0.253 . . . . 0.0 110.909 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.22 131.21 12.71 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.711 2.274 . . . . 0.0 112.368 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -57.27 147.43 76.79 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.604 2.202 . . . . 0.0 112.545 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 63.22 46.43 4.56 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.375 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -128.02 148.28 50.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.713 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -44.01 80.54 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.469 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.7 p -58.85 -35.19 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.49 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.7 t -61.0 -43.67 96.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.902 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.35 76.0 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.916 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.23 88.83 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.773 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.8 -42.0 97.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.131 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 -59.6 -43.96 93.56 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.687 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -61.51 -42.07 98.25 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.882 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 87.3 mt -63.6 -30.92 71.97 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.082 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -42.39 73.03 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.938 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -60.71 -46.83 88.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.065 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.406 HG13 ' NE2' ' A' ' 18' ' ' HIS . 10.1 p -66.79 -43.0 90.09 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.002 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -50.98 66.81 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.881 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -41.96 79.11 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.81 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -48.16 76.85 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.029 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -44.13 81.88 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.259 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.44 -49.34 69.55 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.802 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.36 -42.48 91.67 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -66.5 -42.22 87.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.919 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.87 -44.44 77.08 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.064 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.57 -40.1 61.85 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.647 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.008 -179.725 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 120.74 0.305 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -65.87 -39.48 90.74 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.754 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.28 -46.83 87.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.199 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.3 -38.01 89.5 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.838 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.27 -46.37 89.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.994 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -60.92 -39.42 89.33 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.4 m -56.03 -38.53 70.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.09 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.43 -43.25 97.6 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.624 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.8 mt -65.81 -44.87 92.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 120.748 0.308 . . . . 0.0 110.384 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.3 mt -63.85 -35.91 82.18 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.63 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.79 -28.34 65.88 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -58.34 -36.6 73.67 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.519 0.2 . . . . 0.0 110.935 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.4 tpp -57.96 -37.16 73.66 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.567 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.76 16.53 23.52 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.415 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.46 12.13 36.95 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.563 0.221 . . . . 0.0 111.533 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 tptt 71.42 25.93 3.36 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.377 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -113.34 -33.43 5.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.304 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.427 ' CD2' ' HB2' ' A' ' 21' ' ' TYR . 2.4 t60 -143.55 29.61 1.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.38 -38.1 42.58 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.49 92.84 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.998 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.427 ' HB2' ' CD2' ' A' ' 18' ' ' HIS . 10.6 m-85 -72.61 -33.55 66.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.146 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.53 17.22 23.35 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.734 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -54.25 3.48 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.64 -5.52 16.12 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.3 2.0 . . . . 0.0 113.107 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.12 40.92 3.63 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.81 0.338 . . . . 0.0 111.047 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.42 -47.85 4.54 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.014 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -80.19 155.84 74.41 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.064 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.51 -173.7 0.73 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.716 2.278 . . . . 0.0 112.647 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.2 m -111.39 84.64 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 121.131 0.491 . . . . 0.0 111.37 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -63.34 105.05 0.68 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.081 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.9 -37.22 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.733 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -72.13 -45.75 59.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.574 0.226 . . . . 0.0 111.416 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.04 -47.84 48.8 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -80.84 -21.57 40.66 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.62 60.28 5.12 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -127.66 66.85 1.32 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 111.325 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -63.59 -18.09 63.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.489 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -76.21 -19.08 58.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.588 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -57.63 -41.41 81.29 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.466 0.174 . . . . 0.0 111.058 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -63.55 -34.71 78.41 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.635 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -42.93 71.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.834 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 22.0 mt -73.77 -45.42 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.28 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.3 mm -121.2 119.84 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 120.674 0.274 . . . . 0.0 111.341 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -70.89 -34.3 71.43 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.49 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -129.77 77.91 76.09 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-O 120.75 0.309 . . . . 0.0 111.066 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.49 129.14 16.34 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.753 2.302 . . . . 0.0 112.5 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 73.9 mtp -132.54 155.6 48.34 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.499 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -140.1 167.32 22.41 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.303 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.0 tpp -56.38 -41.89 76.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -39.24 92.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.665 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.0 -45.08 87.05 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.811 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 27.3 mt -69.62 -45.02 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.153 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -64.64 -34.48 78.38 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.982 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.5 t -57.54 -40.25 78.42 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.082 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.408 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -61.38 -48.95 78.89 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -62.85 -36.01 81.86 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.474 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.15 -39.85 87.78 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.228 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.01 15.2 8.98 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.74 27.54 17.3 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -76.58 -35.47 58.15 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.595 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -73.68 105.07 4.83 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.75 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -79.56 -28.34 41.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.327 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -149.59 163.61 37.39 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 111.598 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.44 -18.08 63.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.778 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -62.79 -43.03 99.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.624 0.25 . . . . 0.0 110.533 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -69.95 -37.09 75.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.83 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -65.69 -53.04 46.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.11 -37.59 80.83 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.617 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.54 -42.81 93.18 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.671 0.272 . . . . 0.0 111.006 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.3 -38.99 71.75 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.222 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.2 t -62.54 -48.6 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.016 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -64.09 -37.87 89.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.646 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.41 -48.49 72.64 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.638 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -64.44 -42.83 95.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.083 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -57.14 -42.8 81.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.032 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t -63.38 -43.66 96.98 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.738 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -69.96 -41.53 74.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.949 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.38 -39.71 84.22 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.216 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.55 -34.43 72.65 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.141 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -65.69 -46.88 77.36 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -74.85 -40.9 60.74 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.142 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 m-20 -61.08 110.78 3.3 Favored Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.107 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.9 123.82 10.07 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.64 2.226 . . . . 0.0 112.223 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.64 161.37 1.32 Allowed 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.952 2.435 . . . . 0.0 113.005 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 61.06 42.21 12.82 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.74 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -134.09 147.88 50.94 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.271 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -58.35 -41.78 85.46 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.131 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -60.55 -36.66 71.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.634 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 17.5 t -65.3 -47.47 87.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.68 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.61 91.53 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.967 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.8 mtp -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.01 -50.43 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.9 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -40.44 89.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.748 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -41.81 97.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.791 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.76 -34.65 77.67 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.008 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.98 -43.37 71.61 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -61.53 -46.8 88.4 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.281 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -64.87 -42.87 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.861 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.19 -50.59 67.49 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.849 179.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.26 -45.52 83.93 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.058 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -47.88 84.33 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.042 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -67.49 -44.14 79.23 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.133 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -63.2 -42.74 99.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.836 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.57 74.34 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.066 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -71.65 -44.57 64.08 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.139 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 9.8 ptm -69.38 -35.78 76.16 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.76 -41.34 19.3 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.574 0.226 . . . . 0.0 111.35 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.979 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.643 0.259 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -64.92 -37.04 86.32 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.139 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.02 -40.65 98.38 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.925 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -35.23 66.41 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.821 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.54 -49.81 56.72 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.345 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 27.2 p -61.64 -37.1 82.76 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.781 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -56.57 -37.34 70.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.945 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.8 89.1 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.116 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.7 mt -64.14 -39.04 84.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 CA-C-O 120.917 0.389 . . . . 0.0 110.077 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -35.81 80.43 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.248 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -29.96 65.91 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.401 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.51 -36.69 74.2 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.47 0.176 . . . . 0.0 111.075 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -36.87 71.68 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.76 11.63 19.43 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -101.16 21.86 13.28 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.684 0.278 . . . . 0.0 111.525 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.8 mttm 65.77 21.63 11.52 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.453 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -111.36 -30.11 7.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.948 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.404 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -145.33 30.16 1.14 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.683 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.03 -41.27 17.41 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.36 85.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.933 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -73.79 -31.6 63.35 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.202 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -109.83 24.64 12.77 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.517 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 28.2 t-105 -69.5 -51.49 16.44 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.964 -0.107 . . . . 0.0 111.211 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -80.21 -19.3 9.36 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.423 2.082 . . . . 0.0 113.095 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -105.55 37.41 2.23 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.833 0.349 . . . . 0.0 111.131 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -107.57 -46.25 3.87 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.901 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -81.67 152.43 69.52 Favored Pre-proline 0 CA--C 1.531 0.235 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.101 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -63.43 179.3 0.94 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.926 2.418 . . . . 0.0 112.917 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.5 m -94.64 66.19 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.974 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.15 100.08 0.05 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.967 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.2 p -62.7 -35.12 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.708 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -71.71 -47.49 53.63 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.588 0.232 . . . . 0.0 111.22 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.46 -47.01 52.25 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -81.19 -21.44 39.64 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.23 60.54 6.26 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.474 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.06 71.43 1.26 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.908 0.385 . . . . 0.0 111.422 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -65.39 -22.26 66.77 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.17 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.09 -19.92 58.14 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.447 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -57.62 -42.63 83.68 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.675 0.274 . . . . 0.0 110.912 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.1 t -60.2 -37.14 79.35 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.14 -39.61 78.74 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.99 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.8 mt -72.57 -51.7 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.174 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.8 mt -129.05 118.18 45.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.058 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.0 pttt -77.68 -30.38 51.93 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -112.45 77.43 2.29 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-O 120.807 0.337 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.27 153.57 61.72 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.755 2.303 . . . . 0.0 112.656 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.27 142.95 16.21 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -139.43 167.25 22.5 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 tpp -57.55 -42.19 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.928 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.2 t -64.24 -38.25 90.39 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.544 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -65.66 -43.99 87.69 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.73 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 22.9 mt -70.17 -45.15 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.076 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -34.8 78.29 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.928 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.6 t -57.47 -40.86 79.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.934 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -60.39 -46.91 88.31 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.795 0.331 . . . . 0.0 110.251 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.04 -34.39 77.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.548 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.69 -38.18 90.15 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.311 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.69 15.19 10.03 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.089 0.404 . . . . 0.0 112.089 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 58.07 27.26 14.65 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.595 0.236 . . . . 0.0 111.543 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -32.58 60.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.648 0.261 . . . . 0.0 110.556 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -71.41 104.85 3.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.967 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -65.68 -30.77 71.51 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.062 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.87 172.36 18.79 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.738 0.304 . . . . 0.0 111.24 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.11 -16.7 63.15 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.615 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.87 -43.52 98.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.653 0.263 . . . . 0.0 110.417 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -69.69 -40.65 76.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.967 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -59.36 -53.45 58.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.778 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -58.75 -31.51 67.81 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.737 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.69 91.1 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.636 0.218 . . . . 0.0 111.387 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.11 -31.76 72.81 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.192 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.7 t -60.72 -48.32 89.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.684 0.278 . . . . 0.0 110.577 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.0 mtt-85 -64.33 -38.27 90.46 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.701 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.46 -46.35 76.67 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.668 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 5.7 tmm? -59.19 -46.35 88.65 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.85 -35.26 80.54 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.918 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -60.16 -47.32 86.42 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.15 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -75.36 -30.5 60.23 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.896 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.73 -41.44 95.31 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.75 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.26 -33.87 75.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.946 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -66.56 -47.13 73.77 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.918 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.75 -38.83 76.94 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 51.4 m-20 -72.2 127.29 90.55 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.768 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -65.95 161.01 41.46 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.678 2.252 . . . . 0.0 112.417 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.79 127.58 13.96 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.54 2.16 . . . . 0.0 112.559 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.1 t70 60.13 67.91 0.82 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.917 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -133.89 165.11 25.77 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.314 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.66 -44.15 96.99 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.309 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -62.42 -31.35 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 39.1 t -64.89 -42.32 94.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.883 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.69 -35.2 75.69 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.005 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -45.97 90.52 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.951 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.44 -46.32 89.08 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.935 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -44.99 95.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.744 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.11 -37.42 87.38 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.404 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -68.35 -38.46 81.5 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.983 179.745 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.22 -42.47 75.67 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.088 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.6 -46.81 88.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.2 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.97 -42.99 89.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.235 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -64.83 -51.46 62.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.931 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.67 -43.6 93.91 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.91 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mtt -60.24 -47.11 87.35 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.975 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.16 77.65 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.99 -44.46 95.98 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.999 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.81 -32.5 73.83 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.089 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -44.18 66.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.081 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.3 ptm -69.3 -34.24 74.4 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.259 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.8 mt -84.08 -42.29 16.26 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.992 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.809 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 120.729 0.3 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -64.73 -42.72 95.0 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mt -59.96 -41.7 92.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.918 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -35.68 81.4 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.046 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.8 t -62.42 -37.62 86.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.131 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.39 -39.09 78.73 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.842 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -60.06 -38.72 83.67 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.091 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.65 -43.18 97.95 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.501 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.6 mt -64.4 -46.88 91.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-O 120.656 0.265 . . . . 0.0 110.536 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.7 -35.87 81.09 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.876 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.7 mtpp -58.49 -29.78 66.5 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.231 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.58 -36.43 73.96 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.348 0.118 . . . . 0.0 110.87 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.85 -37.34 73.72 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.468 179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.97 8.68 30.62 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 179.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.28 15.02 18.49 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.68 29.05 2.64 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.174 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -123.74 -31.24 3.47 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.745 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -140.69 28.63 1.96 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 111.244 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.74 -37.94 64.9 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.777 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.87 -36.39 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -73.65 -34.51 64.98 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.576 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -100.81 14.42 31.77 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -52.88 4.01 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -64.06 -12.06 30.46 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 122.612 2.208 . . . . 0.0 113.567 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -141.7 52.46 1.52 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 111.203 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -99.02 -45.41 5.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.77 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.69 160.86 25.29 Favored Pre-proline 0 N--CA 1.464 0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.218 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.79 177.06 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.28 2.653 . . . . 0.0 113.158 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.0 m -93.5 83.85 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.139 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -61.16 93.13 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.524 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -61.1 -39.26 81.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.818 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -72.3 -46.62 54.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.6 0.238 . . . . 0.0 111.578 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.96 -48.79 42.54 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 mt -80.86 -21.33 40.81 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.14 58.13 6.37 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.431 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -128.7 60.09 1.53 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.964 0.411 . . . . 0.0 111.442 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -61.84 -20.99 64.27 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.525 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.24 -20.26 57.58 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.344 0.116 . . . . 0.0 111.27 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.432 ' CE2' HG13 ' A' ' 43' ' ' ILE . 10.3 t80 -56.71 -42.42 79.13 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.253 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 44.5 t -66.18 -32.33 73.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.943 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.24 -34.35 61.41 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.06 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.1 mt -82.99 -41.84 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.478 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.432 HG13 ' CE2' ' A' ' 39' ' ' TYR . 36.2 mm -96.41 127.58 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.747 0.308 . . . . 0.0 111.523 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.8 -36.88 25.21 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.259 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.56 88.47 53.36 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.07 116.08 4.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.736 2.29 . . . . 0.0 112.386 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.9 mtp -140.54 149.6 42.64 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.294 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -147.73 171.52 15.53 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.227 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 6.4 mtt -56.04 -42.32 76.36 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.054 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t -61.93 -40.01 94.02 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.643 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.7 m -66.31 -42.53 88.15 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.951 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.4 HG21 ' CE2' ' A' ' 67' ' ' PHE . 11.6 mt -65.21 -45.08 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.703 0.287 . . . . 0.0 110.78 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -36.69 84.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.04 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.8 p -57.35 -38.49 74.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.208 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -62.92 -48.67 77.93 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.5 tp -62.6 -34.48 77.11 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.529 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.61 -38.91 92.93 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.298 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.45 15.2 8.21 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 59.79 27.49 16.8 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.661 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.45 -34.36 58.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.725 0.297 . . . . 0.0 110.467 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.447 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 8.3 m-85 -79.2 92.72 5.12 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.587 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.5 mtm-85 -60.37 -34.96 74.61 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -145.28 165.64 27.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.931 0.396 . . . . 0.0 111.375 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.05 -22.28 65.87 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.836 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -41.32 99.41 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.599 0.238 . . . . 0.0 110.515 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.49 -35.34 78.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.935 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.447 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 24.5 t80 -59.91 -47.51 85.49 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.429 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.46 -32.29 82.55 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.796 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.05 -36.87 78.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.6 0.238 . . . . 0.0 111.414 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.59 -33.21 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.177 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.82 -48.71 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.919 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -36.07 82.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.658 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.29 -47.33 77.02 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.3 ttp -60.38 -46.87 88.41 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.343 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -63.81 -35.2 79.84 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.707 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 m -59.7 -47.24 86.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.23 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -75.39 -36.75 60.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.682 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -59.3 -40.87 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.814 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -57.66 -35.64 70.83 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.358 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -66.41 -39.57 89.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.941 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.41 ' HB2' HD12 ' A' ' 43' ' ' ILE . 3.0 t80 -81.07 -38.75 26.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.248 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 27.0 m-20 -57.51 110.6 2.6 Favored Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.113 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -68.59 143.66 57.65 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.666 2.244 . . . . 0.0 112.432 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.09 132.55 50.78 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 122.69 2.26 . . . . 0.0 112.438 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.27 68.03 0.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.013 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -134.82 154.66 51.53 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.111 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -44.75 81.63 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.248 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 m -65.46 -31.49 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.493 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.2 t -67.42 -47.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.74 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.43 91.05 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.857 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 7.7 mtt -64.99 -36.77 85.46 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.25 -48.22 79.4 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.44 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -48.0 83.61 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.744 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.07 -38.94 90.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.842 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -37.13 85.62 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.172 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -69.54 -46.79 65.67 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.847 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.78 -47.01 88.25 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.271 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.22 -43.3 97.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.316 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.25 -51.03 63.46 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.425 0.155 . . . . 0.0 110.948 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -43.89 88.05 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.793 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.9 mtp -61.99 -46.92 87.11 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.054 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.65 -44.41 77.96 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.134 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.25 -41.85 96.78 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.877 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -36.15 83.07 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.038 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -67.91 -44.84 76.01 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.173 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 13.7 ptm -69.4 -35.36 75.7 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.401 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.62 -42.37 20.13 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.225 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.008 179.911 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.65 0.262 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -63.26 -44.98 93.6 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.783 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.86 -44.51 94.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.945 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -63.83 -38.09 89.8 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.88 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -46.04 80.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.004 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.6 m -60.44 -39.0 85.93 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.972 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.8 m -58.59 -34.51 71.18 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.079 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -47.29 91.57 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.427 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.6 mt -64.06 -44.58 97.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.788 0.327 . . . . 0.0 110.259 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.16 -35.79 79.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.73 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.4 -27.66 64.48 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' HG2' ' HB2' ' A' ' 17' ' ' LYS . 0.6 OUTLIER -58.44 -36.39 73.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.922 -0.126 . . . . 0.0 111.089 179.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -56.94 -40.41 76.35 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.9 11.94 33.05 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.8 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.54 11.42 28.75 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.02 26.34 3.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.202 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.402 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 79.4 mttt -116.1 -33.51 5.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.994 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.413 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.6 OUTLIER -130.65 23.15 5.05 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.187 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.31 -30.29 60.31 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.227 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.72 -39.51 91.26 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.737 0.304 . . . . 0.0 111.02 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 91' ' ' MET . 8.7 m-85 -81.61 -33.55 31.43 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -97.02 15.58 22.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.408 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.76 -54.79 26.7 Favored Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.408 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.9 Cg_endo -76.84 -20.5 13.28 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.337 2.024 . . . . 0.0 112.984 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -98.28 22.45 9.59 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.391 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.53 -43.48 39.06 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HB3' ' HD2' ' A' ' 28' ' ' PRO . 26.3 mmtt -102.42 158.28 32.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.126 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 27' ' ' LYS . 74.0 Cg_endo -75.01 -176.34 2.83 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.805 2.337 . . . . 0.0 112.754 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.7 m -93.87 80.27 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.133 0.492 . . . . 0.0 111.241 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.31 103.86 0.27 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.142 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.5 p -61.52 -37.32 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.682 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.13 -46.42 56.63 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.488 0.185 . . . . 0.0 111.442 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.69 -46.91 57.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -80.85 -21.45 40.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.62 47.88 73.08 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.425 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.83 69.41 0.88 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.044 0.45 . . . . 0.0 111.222 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -65.23 -18.21 65.12 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.445 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -76.3 -19.95 57.77 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.872 -0.149 . . . . 0.0 111.314 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -40.31 82.49 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.615 0.245 . . . . 0.0 110.843 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.6 t -65.58 -40.13 92.39 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.788 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -65.09 -36.14 83.36 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.861 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.4 mt -77.59 -47.83 25.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.86 103.47 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.306 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -59.66 -33.31 71.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.398 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.76 89.41 52.45 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.603 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.46 124.32 11.89 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.749 2.299 . . . . 0.0 112.72 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.9 tpt -153.47 131.26 11.61 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -129.62 167.94 17.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.948 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.3 -42.65 77.91 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.091 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.8 t -62.06 -39.94 94.11 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.838 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.5 m -64.12 -44.43 92.24 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.864 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.7 mt -69.86 -44.92 78.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.136 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.688 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.52 -35.23 78.76 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.076 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 t -57.56 -40.42 78.87 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.974 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.3 -49.41 77.7 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.04 -33.26 75.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.503 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.14 -41.36 99.27 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.388 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.36 15.16 12.7 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.35 27.21 16.77 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -76.29 -33.67 59.09 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.706 0.289 . . . . 0.0 110.516 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 5.0 m-85 -70.48 110.28 5.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.76 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -81.27 -25.88 36.21 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.192 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -147.12 157.83 43.74 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.815 0.34 . . . . 0.0 111.599 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -23.17 64.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.276 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -62.6 -39.05 92.52 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.521 0.201 . . . . 0.0 110.485 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.47 -35.32 75.5 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.72 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 5.1 t80 -67.53 -53.63 26.89 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.844 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.79 -36.94 81.96 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.156 -0.545 . . . . 0.0 112.806 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.424 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -58.94 -37.83 77.62 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.507 0.194 . . . . 0.0 111.219 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -76.72 -33.48 58.16 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.47 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.7 t -64.9 -48.31 84.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.645 0.259 . . . . 0.0 110.715 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -64.62 -34.54 78.52 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.786 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.3 -44.56 71.51 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.508 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.3 -46.25 89.07 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.782 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -63.58 -35.93 82.13 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.2 p -61.25 -45.82 92.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.049 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.92 -38.05 58.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.874 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 t -61.24 -41.23 96.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.374 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.55 -29.14 69.82 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -72.73 -36.47 67.76 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.696 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -78.84 -40.78 31.75 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.226 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -70.23 112.15 11.71 Favored Pre-proline 0 N--CA 1.466 0.33 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.131 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.4 156.9 60.88 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.765 2.31 . . . . 0.0 112.219 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.15 149.48 70.85 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.42 2.08 . . . . 0.0 112.373 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 t0 60.93 43.31 11.81 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.317 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -116.63 146.92 42.37 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.001 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -56.38 -43.52 79.32 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.257 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.6 m -62.13 -33.44 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 29.9 t -61.65 -42.44 94.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.764 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.38 81.37 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.78 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' MET . . . . . 0.431 ' HA ' ' CE2' ' A' ' 21' ' ' TYR . 0.7 OUTLIER -69.53 -37.26 77.04 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.48 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.45 -50.74 57.91 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.394 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -62.63 -38.78 91.59 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.54 0.209 . . . . 0.0 110.689 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.425 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 2.9 tttp -64.42 -41.74 96.43 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.756 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.413 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -68.42 -37.94 80.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.952 179.456 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.29 -41.47 80.93 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.974 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -60.75 -46.75 89.26 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.27 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 p -67.02 -42.83 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -50.54 68.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.959 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -46.98 86.0 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.601 0.239 . . . . 0.0 110.887 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -45.75 91.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.02 -43.94 77.63 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.957 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.28 -52.46 65.56 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.982 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.27 -40.02 84.76 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.309 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.38 -42.29 75.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.679 0.276 . . . . 0.0 110.787 179.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.11 -44.67 71.95 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.966 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -42.13 66.12 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.535 -0.745 . . . . 0.0 110.703 179.69 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.747 0.308 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.95 -42.8 94.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.213 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.5 mt -62.81 -42.45 99.72 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.719 0.295 . . . . 0.0 110.853 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -69.26 -36.67 77.36 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.965 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -50.23 64.41 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 24.0 p -64.25 -39.37 93.81 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.167 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.17 -40.51 85.84 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.927 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.47 -44.2 96.89 Favored Glycine 0 C--N 1.336 0.537 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.303 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.2 mt -64.32 -44.41 97.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-O 120.817 0.341 . . . . 0.0 110.235 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.0 mp -62.44 -35.83 80.5 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.554 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -58.45 -29.28 66.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.416 ' CG ' ' HB2' ' A' ' 17' ' ' LYS . 43.1 tt0 -58.62 -36.54 74.22 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.562 0.22 . . . . 0.0 110.645 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 6.6 ttm -57.66 -37.12 72.84 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.528 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 7.07 31.51 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.705 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.09 15.36 17.27 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.592 0.234 . . . . 0.0 111.559 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? 69.05 25.61 5.83 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HB2' ' CG ' ' A' ' 12' ' ' GLU . 32.3 mttm -115.37 -29.58 6.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.228 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.401 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 1.4 t60 -144.45 33.4 1.18 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.798 0.332 . . . . 0.0 110.796 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.21 -38.96 13.87 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.184 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.92 -42.66 97.34 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -76.8 -29.28 55.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.326 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.9 16.46 25.88 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.487 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -71.21 -55.83 5.92 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-O 120.346 0.117 . . . . 0.0 110.987 179.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.487 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 12.3 Cg_exo -69.74 -25.1 29.02 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.565 2.177 . . . . 0.0 112.636 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -102.23 34.57 2.68 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.287 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.1 -45.99 4.19 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.89 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -88.97 156.94 49.11 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.325 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -62.38 -171.71 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.154 2.569 . . . . 0.0 112.842 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -116.5 87.35 1.03 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.92 102.49 0.1 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.267 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.8 p -63.75 -36.68 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.643 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.93 -47.31 53.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.614 0.245 . . . . 0.0 111.498 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.43 -47.16 51.25 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.15 -21.51 39.71 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.17 59.99 5.92 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.615 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.93 72.23 1.22 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.962 0.41 . . . . 0.0 111.342 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -69.88 -12.73 61.84 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.458 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -19.41 58.5 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.4 0.143 . . . . 0.0 111.25 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -34.8 69.59 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.534 0.207 . . . . 0.0 111.019 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -66.44 -39.97 89.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.72 0.295 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.23 -37.55 69.14 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.229 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.9 mt -79.15 -52.97 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.321 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.3 mm -106.99 126.96 62.98 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.245 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 43.0 pttt -79.43 -39.13 33.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.278 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -116.37 94.25 42.14 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.725 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.79 105.13 0.89 Allowed 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.665 2.244 . . . . 0.0 112.598 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 39.3 mtp -139.12 140.63 38.0 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.967 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.53 170.66 12.93 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.128 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -32.29 69.23 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.475 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -42.33 99.05 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.727 0.299 . . . . 0.0 110.936 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.6 m -64.4 -39.93 94.8 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.861 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 22.1 mt -70.49 -44.74 76.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.862 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -39.61 92.99 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.113 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.3 p -57.48 -39.07 75.61 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.177 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -49.81 75.73 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.9 tp -63.23 -34.1 76.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.458 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.97 -38.25 90.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.147 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.18 15.26 10.63 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 63.84 26.92 14.45 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -79.54 -35.84 39.31 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.764 0.316 . . . . 0.0 110.732 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.446 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 2.4 m-85 -76.21 101.3 5.35 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.685 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -62.19 -30.19 70.9 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.38 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.23 164.86 38.23 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.866 0.365 . . . . 0.0 111.427 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.2 -15.41 63.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.458 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.77 -44.29 96.56 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.662 0.268 . . . . 0.0 110.323 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -71.08 -35.38 71.84 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.821 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.446 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 34.1 t80 -61.4 -48.1 82.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.412 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.53 -32.14 80.17 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.832 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.3 96.1 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.739 0.27 . . . . 0.0 111.055 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.59 -37.48 76.95 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.033 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.86 -47.74 90.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.908 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -63.01 -35.64 80.89 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.706 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.6 tt -72.2 -43.03 65.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.734 0.302 . . . . 0.0 110.808 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ttp -66.87 -45.09 79.21 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.473 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.81 -41.43 97.88 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.8 p -61.93 -44.04 97.6 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.533 0.206 . . . . 0.0 110.792 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -73.72 -39.58 64.19 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.383 179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.93 -37.82 83.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -59.81 -35.35 74.51 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.982 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -63.23 -42.78 99.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.66 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -70.19 -35.02 73.66 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.189 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.419 ' HB3' HG21 ' A' ' 89' ' ' VAL . 34.0 m-20 -59.42 110.94 3.13 Favored Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.975 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.59 160.38 24.51 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.924 2.416 . . . . 0.0 112.689 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.41 120.72 7.66 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.53 2.153 . . . . 0.0 112.244 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.2 t70 62.52 71.43 0.53 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.658 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -137.51 152.67 49.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.358 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -56.33 -44.31 79.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.291 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 19.0 m -60.3 -32.33 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.399 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.419 HG21 ' HB3' ' A' ' 82' ' ' ASN . 23.2 t -66.07 -43.22 92.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.784 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.06 -37.81 86.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.978 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -46.36 90.72 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.706 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.76 94.12 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.931 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -48.8 71.0 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.606 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.5 tttp -62.47 -41.51 98.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.087 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.401 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -67.83 -40.76 83.74 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.055 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.2 tm0? -70.04 -43.72 70.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.983 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -60.74 -46.76 89.21 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.314 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.95 -42.6 89.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.813 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.78 -49.77 71.65 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.84 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -46.18 88.72 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.562 0.22 . . . . 0.0 110.967 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 6.2 mtp -60.35 -45.98 91.53 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.983 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -67.98 -43.83 78.07 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.122 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -47.87 83.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.043 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.94 -34.08 77.18 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.114 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.92 -44.57 63.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.42 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.2 ptm -69.24 -33.47 73.32 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.04 -42.35 14.93 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 120.573 0.225 . . . . 0.0 110.846 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.13 -0.938 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 120.675 0.274 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -64.33 -39.36 93.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.92 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.97 -45.67 91.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.967 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -35.08 77.26 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.946 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 t -62.49 -35.84 80.62 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.231 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.7 m -58.05 -42.14 84.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.86 -34.98 78.49 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.017 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.93 -46.69 93.69 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.656 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mt -64.39 -47.37 89.77 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.772 0.32 . . . . 0.0 110.581 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mt -63.85 -35.75 81.64 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 ttpt -58.59 -30.3 67.1 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.616 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.404 ' CG ' ' HD3' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -58.5 -36.62 74.06 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.448 0.166 . . . . 0.0 110.983 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -38.68 76.32 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.653 0.263 . . . . 0.0 110.452 179.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.07 3.84 39.1 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.716 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.04 16.41 12.84 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.582 0.229 . . . . 0.0 111.538 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.3 mttp 70.77 25.8 3.93 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.404 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 6.9 mttm -114.28 -32.78 5.86 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.03 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.464 ' NE2' HG12 ' A' ' 98' ' ' VAL . 4.9 m-70 -131.42 18.78 4.82 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.075 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.81 78.84 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-O 120.593 0.235 . . . . 0.0 110.938 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.41 -34.77 74.97 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.298 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -86.67 -31.0 21.3 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.699 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.9 17.2 24.56 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -53.13 35.16 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.355 0.121 . . . . 0.0 110.72 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -88.68 18.72 1.43 Allowed 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.732 2.288 . . . . 0.0 113.088 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -144.13 62.78 1.34 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.934 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -127.89 -55.06 1.3 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.857 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.41 157.24 75.37 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.025 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.98 -177.22 1.23 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.754 2.303 . . . . 0.0 112.732 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.443 HG11 ' CZ ' ' A' ' 39' ' ' TYR . 15.9 m -90.23 78.55 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.113 0.482 . . . . 0.0 111.418 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.17 97.69 0.05 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.867 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 p -61.51 -39.66 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.766 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -72.25 -46.78 54.53 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.3 -48.2 44.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.5 -21.46 38.64 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.5 57.88 6.34 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.323 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.4 76.44 1.72 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.983 0.421 . . . . 0.0 111.406 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -75.88 -7.17 53.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.51 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.3 -19.87 57.86 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.369 0.128 . . . . 0.0 111.22 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.443 ' CZ ' HG11 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -57.8 -42.0 83.31 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.899 179.654 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.3 t -63.28 -35.69 81.19 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.908 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -73.24 -42.15 62.91 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.169 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 20.1 mt -80.79 -62.38 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.766 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 22.5 mm -97.23 125.54 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.822 0.344 . . . . 0.0 111.543 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -83.58 -34.95 25.05 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.442 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -136.81 72.88 54.77 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-O 120.808 0.337 . . . . 0.0 111.085 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.58 160.31 44.42 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.814 2.343 . . . . 0.0 112.423 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.7 mtp -150.18 163.22 38.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.319 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.43 172.24 14.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.032 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 ttm -54.48 -37.44 65.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.74 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.0 t -63.46 -44.25 95.02 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.82 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.2 m -64.32 -38.59 91.59 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.095 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 15.9 mt -69.74 -44.89 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-O 120.749 0.309 . . . . 0.0 110.908 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.18 -36.32 81.52 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.277 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.2 p -57.62 -43.11 84.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.8 -49.07 77.79 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.4 ' HB2' ' HD2' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -66.18 -33.18 75.18 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.688 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -60.27 -41.44 93.31 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.468 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.03 15.17 12.08 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.04 27.35 16.26 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.62 0.248 . . . . 0.0 111.362 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -76.6 -33.67 58.42 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.667 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.4 ' HD2' ' HB2' ' A' ' 56' ' ' LEU . 2.6 m-85 -66.11 103.17 0.92 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.943 0.402 . . . . 0.0 110.622 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -32.04 63.58 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.025 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -166.92 -178.98 4.47 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.251 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.52 -15.62 61.78 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.254 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -62.84 -46.0 89.96 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.669 0.271 . . . . 0.0 110.342 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.23 -36.03 74.26 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.775 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -59.93 -53.65 55.38 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.963 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.38 -32.15 81.91 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.615 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.38 99.41 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.199 0.2 . . . . 0.0 111.397 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.11 -35.24 73.98 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.447 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 46.0 t -63.44 -48.09 88.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 120.743 0.306 . . . . 0.0 110.259 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -64.76 -39.78 94.2 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.651 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.95 -48.67 79.35 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.759 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.0 ttp -61.65 -41.7 97.88 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.136 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -41.21 81.64 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.944 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.6 m -62.79 -43.71 98.07 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.833 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -71.29 -42.29 68.87 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.98 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t -59.73 -36.66 77.03 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.028 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -60.3 -37.47 80.65 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.144 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -70.56 -39.37 73.99 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.012 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -75.07 -33.21 61.65 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.424 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -88.07 111.6 43.89 Favored Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 116.754 -0.203 . . . . 0.0 111.122 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.42 142.41 97.83 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.852 2.368 . . . . 0.0 112.543 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.53 151.84 59.27 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.914 2.41 . . . . 0.0 112.618 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 59.29 51.39 6.86 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -128.92 145.91 51.09 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.6 -40.74 75.82 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.019 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.9 m -61.99 -36.1 72.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.313 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 28.2 t -65.87 -46.6 88.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.769 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.84 -36.91 82.58 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.015 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -61.26 -46.36 90.69 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.26 -46.58 82.93 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtp180 -59.89 -37.28 78.92 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.839 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -59.43 -42.2 91.35 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.725 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 20.1 mt -71.02 -32.12 68.81 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.81 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -44.23 71.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.888 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -60.69 -46.67 89.49 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.241 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.464 HG12 ' NE2' ' A' ' 18' ' ' HIS . 8.6 p -66.03 -42.95 92.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.946 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -64.14 -50.3 68.77 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.849 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.58 -46.97 83.34 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.001 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -46.1 90.81 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.867 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -43.99 78.14 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.002 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.404 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -57.48 -46.35 83.8 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.98 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.37 -36.35 83.4 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.052 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -69.14 -44.81 71.6 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.129 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 8.0 ptm -69.4 -33.31 72.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.746 -0.207 . . . . 0.0 111.408 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.81 -42.7 16.17 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.478 0.18 . . . . 0.0 111.347 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.804 -0.617 . . . . 0.0 110.737 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.69 0.281 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.52 -40.13 80.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.958 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 78.8 mt -58.97 -33.71 70.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.911 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -72.72 -34.72 67.28 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.88 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -49.71 53.8 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 24.0 p -60.31 -36.81 78.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.929 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -54.56 -34.08 61.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.251 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -46.7 93.48 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.425 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mt -64.53 -43.64 96.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.875 0.369 . . . . 0.0 110.303 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 mp -62.95 -35.52 80.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.452 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -58.18 -28.07 64.43 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.569 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.77 -36.83 75.03 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.527 0.203 . . . . 0.0 110.789 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -59.83 -37.58 79.6 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.46 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -98.71 0.71 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.626 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.09 10.75 23.1 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt 75.09 21.58 1.92 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.372 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -111.13 -35.09 6.0 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.04 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.1 m-70 -124.61 18.16 8.79 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.29 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.63 -37.21 56.72 Favored 'General case' 0 N--CA 1.46 0.063 0 CA-C-O 120.652 0.263 . . . . 0.0 110.956 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.93 -38.19 76.14 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.028 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.406 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 6.6 m-85 -77.5 -32.36 54.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.248 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.39 8.08 43.23 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.416 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 1.9 t90 -69.92 -51.55 14.72 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 72.0 Cg_endo -76.39 2.13 7.63 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.308 2.005 . . . . 0.0 113.435 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -150.54 58.24 0.94 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.013 0.435 . . . . 0.0 111.011 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -112.25 -54.37 2.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.665 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -72.02 153.27 92.8 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.47 -179.56 0.2 Allowed 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.894 2.396 . . . . 0.0 112.723 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.7 m -107.7 73.99 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.132 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -61.66 102.13 0.23 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.874 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.52 -35.62 68.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.636 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -71.79 -47.4 53.68 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.605 0.24 . . . . 0.0 111.307 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -46.38 54.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.2 mt -80.75 -21.28 41.22 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.82 58.57 8.13 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.466 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.99 66.16 1.28 Allowed 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.934 0.397 . . . . 0.0 111.092 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -62.1 -21.17 64.77 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.354 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -76.46 -20.19 57.27 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.516 0.198 . . . . 0.0 111.29 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.43 ' CE1' HG13 ' A' ' 43' ' ' ILE . 1.1 t80 -59.05 -31.76 69.15 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 120.596 0.236 . . . . 0.0 110.786 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.4 t -60.15 -40.01 88.36 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.483 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -84.76 -37.95 20.22 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 121.262 -0.175 . . . . 0.0 111.2 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 12.2 mt -62.89 -33.42 60.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.43 HG13 ' CE1' ' A' ' 39' ' ' TYR . 40.0 mm -123.37 116.6 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.158 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -33.82 75.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.279 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -124.77 90.61 50.71 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.56 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.45 106.8 1.29 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.782 2.321 . . . . 0.0 112.452 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 27.0 mtp -146.46 144.7 29.84 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.298 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.74 172.09 13.45 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.51 -43.28 79.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.01 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -61.99 -34.78 76.8 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.749 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 86.6 m -70.32 -41.74 72.88 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.702 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.5 mt -66.64 -45.02 89.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.804 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -67.59 -34.63 77.41 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.037 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.3 t -57.55 -42.0 82.09 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.973 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -60.72 -49.6 76.84 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.814 0.34 . . . . 0.0 110.176 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.1 tp -60.99 -35.9 78.04 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.572 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -59.86 -39.58 85.7 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.119 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.4 15.18 11.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.925 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.36 28.54 16.95 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.59 0.234 . . . . 0.0 111.562 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -74.66 -37.35 62.73 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.722 0.296 . . . . 0.0 110.508 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.515 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 7.7 m-85 -73.91 100.67 3.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.819 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -69.91 -32.37 70.64 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.005 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -145.78 159.87 42.57 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.021 0.439 . . . . 0.0 111.473 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.66 -14.5 62.49 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.192 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -62.96 -45.52 92.04 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 120.69 0.281 . . . . 0.0 110.6 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -71.46 -32.46 68.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.794 179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.515 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -55.2 -53.49 55.3 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.969 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.2 -31.3 78.55 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.68 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.77 -41.36 95.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.668 0.271 . . . . 0.0 111.069 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.9 -38.96 64.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.361 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.8 t -64.31 -46.23 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.734 0.302 . . . . 0.0 110.83 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.1 mtt-85 -59.18 -33.39 70.88 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.103 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.1 -46.63 50.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.931 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.25 -42.26 90.71 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -63.8 -38.75 92.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.9 m -66.33 -38.99 88.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.019 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -70.9 -44.07 67.0 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.975 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -58.23 -34.12 70.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.101 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -56.66 -37.26 70.55 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.219 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -66.29 -47.77 72.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.205 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -72.46 -33.86 67.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.079 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.452 ' HB3' ' CG2' ' A' ' 89' ' ' VAL . 21.5 m-20 -65.39 114.01 13.83 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.132 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -58.43 167.59 4.76 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.902 2.401 . . . . 0.0 112.66 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.03 116.96 4.91 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.48 2.12 . . . . 0.0 112.334 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.4 t0 61.51 68.72 0.69 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.109 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -125.77 158.96 33.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.04 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.15 -43.91 78.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.271 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.6 m -65.36 -34.34 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.452 ' CG2' ' HB3' ' A' ' 82' ' ' ASN . 28.4 t -63.93 -43.32 97.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.907 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.19 -36.98 73.89 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.978 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 10.3 mtt -66.85 -36.99 83.59 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.1 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.66 65.56 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.69 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.51 78.0 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.213 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.406 ' HD2' ' CE2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.96 -40.48 93.51 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.89 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.0 mt -68.98 -31.66 70.67 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.003 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.39 -49.17 62.01 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.877 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.6 -46.45 90.2 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.414 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.6 p -64.45 -42.98 96.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.315 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.04 -50.47 66.1 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.536 0.208 . . . . 0.0 110.5 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -42.66 90.59 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.103 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -47.81 84.02 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.992 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -44.15 80.11 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.103 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.07 -42.25 94.35 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.861 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.13 76.61 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.03 -44.6 68.91 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.168 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.6 ptm -68.77 -33.33 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.324 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.0 -41.83 15.45 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.058 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.06 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.64 0.257 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -61.66 -36.15 80.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.766 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.48 -37.82 88.76 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.191 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -72.49 -42.0 65.37 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.81 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -49.18 76.11 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.209 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.3 p -62.35 -36.71 83.08 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.017 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.6 t -54.47 -34.79 62.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.958 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.64 -40.12 96.04 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 121.064 -0.588 . . . . 0.0 112.589 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.4 mt -64.14 -39.28 84.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.34 -35.48 80.54 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.643 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.2 -29.64 65.83 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.571 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.429 ' HG3' ' HD3' ' A' ' 17' ' ' LYS . 0.7 OUTLIER -58.63 -36.59 74.32 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.402 0.144 . . . . 0.0 111.049 179.459 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.2 mtt -58.89 -37.24 76.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.705 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -103.72 10.24 36.8 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.454 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -104.08 16.55 26.0 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.638 0.256 . . . . 0.0 111.534 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.61 28.54 9.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.26 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HD3' ' HG3' ' A' ' 12' ' ' GLU . 22.0 mttm -115.88 -35.78 4.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.129 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.42 ' CE1' HG12 ' A' ' 98' ' ' VAL . 4.8 t60 -134.44 27.17 3.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.885 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.77 -32.13 35.61 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.227 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.29 94.09 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.208 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -83.24 -32.09 26.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.48 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -95.95 12.42 30.43 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.451 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -74.3 -53.72 3.55 Favored Pre-proline 0 CA--C 1.532 0.279 0 O-C-N 122.505 -0.122 . . . . 0.0 111.112 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.451 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 3.0 Cg_exo -74.51 -1.94 11.73 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.773 2.315 . . . . 0.0 113.222 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.4 50.89 2.18 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.989 0.423 . . . . 0.0 111.06 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -109.15 -47.52 3.41 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.781 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.6 156.06 56.23 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.247 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.66 -172.76 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.882 2.388 . . . . 0.0 112.74 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -111.91 76.47 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 121.112 0.482 . . . . 0.0 111.211 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.58 107.2 1.09 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.017 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.5 p -62.31 -38.71 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.545 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.05 -45.58 60.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.587 0.232 . . . . 0.0 111.342 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.2 -48.24 52.72 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.065 0.395 . . . . 0.0 112.065 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -81.54 -21.66 38.38 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.55 58.62 5.31 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.479 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.61 74.27 1.59 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.227 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -70.9 -8.06 50.22 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.013 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.33 -20.02 57.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 121.344 -0.142 . . . . 0.0 111.193 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.87 -43.66 98.1 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.937 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.3 -38.84 90.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.717 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.36 -36.6 84.67 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.695 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.2 mt -78.39 -52.83 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.234 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.2 mt -128.91 141.47 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.806 0.336 . . . . 0.0 111.503 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.53 -31.88 12.55 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.489 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -120.7 65.34 12.37 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 120.671 0.272 . . . . 0.0 111.414 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.06 164.08 30.0 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.853 2.369 . . . . 0.0 112.718 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.1 ttm -148.37 158.89 44.38 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.5 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -138.16 164.52 28.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.21 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -40.41 78.84 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 t -62.66 -41.55 99.12 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.56 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 4.9 m -64.57 -42.32 95.71 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.972 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 15.5 mt -69.69 -45.08 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.967 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? -66.11 -34.21 77.54 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.22 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -57.5 -40.03 77.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.877 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -48.22 82.65 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.5 tp -63.96 -35.18 79.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.729 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.92 -40.99 97.76 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.503 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.86 15.37 11.43 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 60.58 28.08 17.77 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.663 0.268 . . . . 0.0 111.401 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -74.51 -33.94 62.91 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.766 0.317 . . . . 0.0 110.528 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.437 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 5.2 m-85 -70.11 105.99 3.1 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.888 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttm-85 -69.62 -29.0 66.4 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.245 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.37 164.42 38.3 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.44 -23.0 64.56 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.242 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.87 -38.32 90.38 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.742 0.306 . . . . 0.0 110.482 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -70.3 -35.22 73.56 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.437 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 16.4 t80 -59.42 -48.52 81.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.533 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.88 -33.0 81.65 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.464 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.61 -37.46 84.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.555 0.217 . . . . 0.0 111.435 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -76.43 -30.76 57.54 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.269 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.3 t -66.3 -48.57 80.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 111.027 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -64.5 -34.68 78.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.945 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.6 tp -69.06 -46.98 66.47 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.765 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 ttp -59.6 -46.43 88.96 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.198 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 96' ' ' GLN . 4.5 m-85 -60.88 -39.79 90.56 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.183 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 24.7 t -59.51 -46.32 89.18 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.846 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -74.99 -41.68 59.04 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.784 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.4 m -60.97 -34.94 75.55 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.287 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -60.28 -35.03 74.6 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.653 0.263 . . . . 0.0 111.215 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -71.63 -35.85 70.55 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.85 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -82.82 -40.94 19.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.347 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -69.45 116.59 44.27 Favored Pre-proline 0 N--CA 1.464 0.262 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.081 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.71 153.62 23.58 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.916 2.411 . . . . 0.0 112.576 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.03 136.83 28.01 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.565 2.177 . . . . 0.0 112.151 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 t70 58.19 61.24 2.37 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.03 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -126.97 150.16 49.52 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.911 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -56.52 -44.12 80.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.326 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.71 -35.89 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.198 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.5 t -64.98 -45.74 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.779 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.83 78.69 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.802 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.7 mtp -61.46 -46.59 89.44 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.01 -50.17 71.63 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.934 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -58.87 -41.11 86.31 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -61.99 -42.02 98.69 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.996 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.5 mt -60.51 -41.5 94.48 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.838 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.08 -41.88 73.51 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.916 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.55 -46.67 89.31 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.252 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.42 HG12 ' CE1' ' A' ' 18' ' ' HIS . 11.1 p -66.69 -42.64 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.014 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -47.04 79.57 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.825 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.62 -46.35 90.6 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.625 0.25 . . . . 0.0 110.976 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -47.7 84.65 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.95 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.0 mmt180 -67.66 -38.77 84.25 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.42 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -58.41 -50.71 72.72 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.009 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.13 -35.67 77.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.229 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.8 62.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.396 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.42 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 2.0 ptm -69.26 -34.01 74.11 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.93 -41.64 15.73 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.6 0.238 . . . . 0.0 110.911 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 117.947 -1.025 . . . . 0.0 111.044 -179.812 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 120.705 0.288 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -57.02 -37.11 71.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt -61.24 -46.61 89.7 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.822 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -67.73 -34.48 76.93 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.825 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.65 -39.61 70.24 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.831 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -65.59 -39.05 91.16 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.54 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -35.65 68.37 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.059 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.18 -47.58 90.38 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.109 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 32.4 mt -64.89 -44.25 96.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-O 120.788 0.328 . . . . 0.0 110.319 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 mp -62.42 -35.79 80.35 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.737 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mtmt -58.47 -28.19 65.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.375 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -58.48 -36.63 74.04 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.841 -0.163 . . . . 0.0 110.967 179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -57.46 -37.11 72.33 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.487 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -107.67 9.96 29.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.63 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -92.04 12.06 23.21 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.8 tttm 73.03 26.97 2.12 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.528 0.331 . . . . 0.0 111.284 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -120.8 -35.39 3.37 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.346 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.77 25.7 4.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.172 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.52 -34.48 31.2 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.068 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.73 76.47 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.437 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -79.58 -32.57 42.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.381 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.14 15.29 28.75 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -61.83 4.8 Favored Pre-proline 0 CA--C 1.53 0.193 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.64 -19.76 64.94 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.258 1.972 . . . . 0.0 112.799 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.38 35.94 4.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.475 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 -40.95 10.21 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.011 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -89.87 163.44 32.38 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.288 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -81.16 -174.53 2.25 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.945 2.43 . . . . 0.0 112.758 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.0 m -113.83 75.14 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.091 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -58.6 103.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.055 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.4 ' HA ' HD11 ' A' ' 36' ' ' LEU . 10.4 p -61.55 -39.19 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.633 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -72.05 -45.51 60.53 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.52 0.2 . . . . 0.0 111.536 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.95 -48.36 45.75 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 mt -81.21 -21.5 39.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.87 57.68 6.22 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.411 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.4 HD11 ' HA ' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -129.81 73.83 1.55 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.98 0.419 . . . . 0.0 111.21 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -71.69 -8.92 57.09 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.715 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.6 -20.1 57.13 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.461 0.172 . . . . 0.0 111.388 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.57 -41.81 97.94 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.884 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.68 -39.18 90.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.736 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.05 -39.62 94.48 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.628 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.8 mt -74.81 -51.66 21.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.843 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.0 mt -130.35 112.24 22.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -11.79 60.63 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.822 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -126.93 71.79 75.38 Favored Pre-proline 0 CA--C 1.534 0.341 0 CA-C-O 120.71 0.291 . . . . 0.0 111.047 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.0 145.48 99.06 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 122.897 2.398 . . . . 0.0 112.539 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 mmt -147.89 139.45 23.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.232 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -145.39 165.54 28.2 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.835 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.4 ttm -57.01 -36.56 70.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.646 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.0 t -66.35 -39.34 89.11 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.812 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.2 m -67.2 -40.11 86.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.982 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.3 mt -68.46 -45.19 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.99 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -66.09 -35.22 79.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.127 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.6 t -57.64 -42.98 84.51 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.967 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.38 -47.75 84.72 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.59 -34.53 77.19 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.693 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.81 -41.31 99.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.295 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.81 15.29 11.51 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 59.91 28.45 17.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.689 0.28 . . . . 0.0 111.424 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -72.99 -34.1 66.23 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.517 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.511 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 5.8 m-85 -72.86 103.09 3.59 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.49 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -67.3 -29.76 69.43 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.226 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -155.65 178.1 10.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.812 0.339 . . . . 0.0 111.281 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.34 -25.25 62.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.62 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -42.07 99.62 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.774 0.321 . . . . 0.0 110.267 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.92 -37.67 88.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.802 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.511 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 27.2 t80 -59.41 -51.86 68.07 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.806 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.22 -31.53 77.34 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 121.049 -0.595 . . . . 0.0 112.696 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.8 -39.39 80.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.611 0.243 . . . . 0.0 111.32 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.68 -33.11 58.26 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.169 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 40.7 t -67.44 -46.75 82.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.604 0.24 . . . . 0.0 110.789 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -59.09 -36.99 76.07 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.85 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.15 -42.09 66.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.629 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -62.17 -46.77 87.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.129 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.39 -35.57 80.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.053 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.6 t -59.78 -47.63 84.91 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.117 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -75.82 -30.74 59.1 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.584 0.231 . . . . 0.0 110.868 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.91 -41.88 97.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.822 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -61.19 -33.59 73.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.409 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -71.16 -44.47 65.46 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.06 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -75.25 -37.28 61.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.311 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -58.28 115.11 10.26 Favored Pre-proline 0 N--CA 1.465 0.282 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.34 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -58.45 163.15 10.97 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.971 2.447 . . . . 0.0 112.629 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -73.91 126.44 10.66 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.638 2.226 . . . . 0.0 112.45 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t0 58.47 62.42 1.97 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.157 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -123.06 154.09 39.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -56.81 -43.8 81.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.245 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 22.1 m -59.7 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.324 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.5 t -62.77 -44.77 99.76 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.922 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.55 -41.83 95.31 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.823 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.9 mtt -65.05 -43.61 91.72 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.606 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.91 -48.18 83.02 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.021 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -46.98 77.4 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.0 tttp -63.02 -38.06 89.67 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.842 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.6 mt -66.91 -36.27 81.88 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.086 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 7.5 tm0? -70.06 -47.85 60.27 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.074 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -61.3 -46.84 88.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.496 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.1 p -63.36 -43.31 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.234 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -65.32 -51.01 63.46 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.591 0.234 . . . . 0.0 110.803 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -42.77 92.82 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.89 85.88 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.873 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -65.66 -44.18 87.11 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.982 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -43.47 95.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.757 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.8 -44.22 90.64 Favored 'General case' 0 N--CA 1.46 0.065 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -64.72 -40.91 96.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.603 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -44.4 72.04 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.827 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -72.23 -42.34 65.82 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.206 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.492 -0.766 . . . . 0.0 110.839 179.848 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.628 0.251 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -61.42 -40.88 96.03 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.797 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -38.61 89.0 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.994 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -71.67 -36.1 70.53 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.806 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -50.19 61.61 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 p -62.25 -37.79 86.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.046 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.8 m -62.69 -36.42 82.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.915 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.11 -41.93 98.27 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.35 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.2 mt -63.97 -46.34 94.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-O 120.663 0.268 . . . . 0.0 110.657 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.9 mt -62.17 -36.25 81.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.86 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.6 mttp -58.84 -31.7 68.74 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.33 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 3.3 tt0 -58.1 -36.59 73.1 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.365 0.126 . . . . 0.0 111.016 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.0 mtt -56.87 -37.1 70.87 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.185 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.33 16.61 19.91 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.575 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.422 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . . . -95.97 15.48 20.45 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.689 0.28 . . . . 0.0 111.53 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.31 24.03 1.13 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.595 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.406 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 48.8 mttp -116.91 -32.78 4.97 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.838 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.86 18.51 3.51 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.01 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.48 -35.71 81.37 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.494 0.183 . . . . 0.0 111.494 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.54 70.42 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.114 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.42 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 10.2 m-85 -99.71 -24.84 14.58 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.594 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.55 -16.17 35.37 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.599 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 12.2 t90 -53.45 -51.83 72.2 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.298 0.094 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 90.3 Cg_endo -82.74 -19.4 6.11 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.476 2.117 . . . . 0.0 113.189 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -97.42 36.16 1.52 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.622 0.249 . . . . 0.0 111.59 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.51 -58.15 0.99 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.858 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -66.35 138.46 95.86 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.966 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.01 160.72 32.62 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.787 2.325 . . . . 0.0 112.507 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.7 m -88.91 87.49 2.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 121.024 0.44 . . . . 0.0 110.745 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.69 104.34 0.22 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.111 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.9 p -59.73 -36.6 66.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.72 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.06 -47.03 54.57 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.29 49.95 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.77 -21.51 40.96 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.87 57.19 8.1 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.387 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.58 65.28 1.26 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 111.179 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -64.94 -19.71 66.09 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -76.15 -19.46 58.45 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.195 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.429 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -59.48 -41.83 90.71 Favored 'General case' 0 CA--C 1.526 0.056 0 CA-C-O 120.496 0.189 . . . . 0.0 110.786 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.51 -32.72 74.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.653 0.263 . . . . 0.0 110.948 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 m-20 -75.81 -45.77 34.19 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.03 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 49.3 mt -74.56 -34.45 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.461 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.429 HG13 ' CE2' ' A' ' 39' ' ' TYR . 33.0 mm -103.64 107.99 23.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.631 0.253 . . . . 0.0 111.16 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -68.52 -34.05 75.2 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.468 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -130.41 88.7 46.6 Favored Pre-proline 0 CA--C 1.532 0.253 0 CA-C-O 120.704 0.287 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.72 140.72 39.68 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.738 2.292 . . . . 0.0 112.632 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttm -160.61 153.62 21.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.018 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -147.56 162.0 39.98 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.5 tpp -54.54 -38.94 67.18 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 t -62.51 -39.71 94.39 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.449 0.166 . . . . 0.0 111.108 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.7 m -70.97 -40.62 71.82 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.982 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 15.4 mt -69.7 -44.83 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.546 0.213 . . . . 0.0 110.785 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.14 -35.1 79.18 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.671 -0.241 . . . . 0.0 111.1 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -44.01 84.26 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.082 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.63 -49.76 76.24 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.844 0.354 . . . . 0.0 110.109 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.6 tp -63.09 -34.29 77.28 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.716 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.37 -39.74 88.3 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.193 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.0 15.41 10.11 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 62.77 27.18 15.97 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.303 0.241 . . . . 0.0 111.585 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -75.95 -34.43 59.83 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.84 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -78.21 99.35 6.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.938 0.399 . . . . 0.0 110.588 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -58.0 -32.58 68.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -146.55 168.21 21.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 111.057 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.18 -16.9 61.42 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.363 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -45.92 90.19 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.634 0.254 . . . . 0.0 110.334 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.41 -38.93 85.38 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -63.42 -52.65 60.65 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.603 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -64.14 -31.34 80.5 Favored Glycine 0 C--N 1.335 0.51 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.151 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.92 91.22 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.829 0.315 . . . . 0.0 111.182 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -72.2 -30.33 64.85 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.43 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.4 t -65.46 -47.99 84.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.759 0.314 . . . . 0.0 110.498 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 56.9 mtp85 -59.63 -39.68 85.1 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.25 -46.05 74.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.815 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -59.28 -46.8 87.57 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.249 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -66.09 -35.52 80.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.773 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.0 m -59.65 -46.77 88.03 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.503 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.21 -36.43 61.39 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.507 0.194 . . . . 0.0 110.977 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -39.09 83.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.231 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -57.3 -34.65 68.91 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.15 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.7 tttt -66.37 -44.02 84.32 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.598 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.39 -37.74 74.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.24 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.461 ' HB3' HG22 ' A' ' 89' ' ' VAL . 17.3 m120 -65.61 111.62 6.67 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.431 ' HG2' ' CD2' ' A' ' 86' ' ' HIS . 42.8 Cg_endo -67.18 147.14 78.41 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.629 2.219 . . . . 0.0 112.356 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.55 131.74 45.29 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.671 2.247 . . . . 0.0 112.723 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t70 63.0 64.31 0.87 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.514 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.431 ' CD2' ' HG2' ' A' ' 83' ' ' PRO . 5.5 t-80 -136.8 155.94 49.15 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.034 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -55.8 -44.46 77.82 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.403 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.6 m -63.52 -35.24 71.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.637 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.461 HG22 ' HB3' ' A' ' 82' ' ' ASN . 26.2 t -60.8 -46.27 96.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.88 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.33 -33.7 76.45 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.027 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 6.0 mtm -64.42 -46.56 82.69 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.861 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.45 -44.29 96.77 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.839 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -65.84 -43.09 89.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.731 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.42 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 22.3 tttp -63.37 -42.94 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.103 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -66.65 -39.07 88.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -69.11 -43.79 73.73 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.703 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -61.48 -46.88 88.16 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.33 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p -66.33 -42.95 91.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.808 -0.178 . . . . 0.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -63.85 -51.59 63.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.862 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.39 -41.31 98.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -47.56 85.21 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.658 0.266 . . . . 0.0 110.839 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -43.9 78.32 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.798 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.45 -42.89 97.08 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.027 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.04 -32.62 73.11 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.007 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -70.9 -44.43 66.27 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.987 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 9.2 ptm -69.06 -33.38 73.47 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.195 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 8.8 mt -83.89 -42.24 16.57 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.041 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.842 179.758 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 . . . . . 0 N--CA 1.488 1.438 0 CA-C-O 120.683 0.278 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -69.07 -34.75 75.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.948 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.06 -46.8 76.48 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.553 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -32.29 71.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.15 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.62 -40.91 84.65 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.563 0.22 . . . . 0.0 110.799 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.3 m -63.48 -38.95 93.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.856 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.9 m -56.93 -35.7 69.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.68 97.73 Favored Glycine 0 C--N 1.337 0.612 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.628 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 16.1 mt -65.47 -47.67 85.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.705 0.288 . . . . 0.0 110.66 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.45 -35.79 81.61 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.776 179.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -30.75 66.69 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.333 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.424 ' HG3' ' CD ' ' A' ' 17' ' ' LYS . 52.7 tt0 -58.55 -36.66 74.25 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.004 0.19 . . . . 0.0 110.829 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -58.53 -37.17 75.09 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.679 0.276 . . . . 0.0 110.397 178.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.82 5.29 33.0 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.81 17.84 11.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.629 0.252 . . . . 0.0 111.349 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.6 mmtt 68.02 37.37 3.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.125 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.424 ' CD ' ' HG3' ' A' ' 12' ' ' GLU . 55.0 mttt -128.09 -39.28 1.75 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.07 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -123.73 19.09 9.47 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.374 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.01 62.76 Favored 'General case' 0 C--N 1.335 -0.052 0 CA-C-O 120.643 0.259 . . . . 0.0 111.106 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.69 -36.16 62.75 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.275 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -81.42 -33.08 32.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.217 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.17 20.0 16.51 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.403 ' N ' ' CD ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.68 -50.88 62.16 Favored Pre-proline 0 CA--C 1.529 0.154 0 CA-C-N 116.94 -0.118 . . . . 0.0 111.049 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 23' ' ' TRP . 50.5 Cg_exo -53.88 -25.43 35.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.548 2.165 . . . . 0.0 112.934 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -118.84 37.11 4.2 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.132 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.16 -35.36 64.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.17 162.57 47.3 Favored Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.18 -177.4 0.12 Allowed 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.155 2.57 . . . . 0.0 112.768 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 m -120.91 83.78 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.252 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.03 101.85 0.31 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.7 p -61.83 -36.63 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.737 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -71.83 -47.65 51.69 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.563 0.22 . . . . 0.0 111.391 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -47.29 49.72 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.4 mt -80.91 -21.49 40.5 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.88 57.61 9.48 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.05 74.5 1.44 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.051 0.453 . . . . 0.0 111.296 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.92 -3.85 34.56 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.777 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -76.25 -20.0 57.8 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.37 0.129 . . . . 0.0 111.304 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -57.42 -34.06 68.53 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 116.671 -0.241 . . . . 0.0 110.969 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.48 -40.46 96.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.751 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.91 -41.02 75.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.476 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 12.8 mt -68.74 -51.44 45.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.305 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.96 150.5 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-O 120.941 0.401 . . . . 0.0 111.644 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.1 pttm -96.04 -32.77 12.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.677 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -110.96 83.39 3.63 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-O 120.705 0.288 . . . . 0.0 111.057 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -73.01 125.76 10.65 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.833 2.355 . . . . 0.0 112.65 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.1 mtp -148.63 141.36 24.56 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.148 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.66 168.99 13.6 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 26.9 mtt -56.31 -38.74 71.69 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.102 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.5 t -62.45 -35.72 80.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.833 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.3 m -73.18 -38.78 66.03 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.017 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.7 mt -66.89 -45.13 88.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.917 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.31 -34.24 74.37 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.959 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -57.32 -42.91 82.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.729 -0.214 . . . . 0.0 110.901 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -62.02 -49.38 76.24 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.879 0.371 . . . . 0.0 110.112 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.76 -32.66 74.24 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.002 179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.77 -40.6 88.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.651 0.262 . . . . 0.0 111.056 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.34 15.19 12.59 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.861 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.52 27.75 17.41 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.629 0.252 . . . . 0.0 111.599 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -70.68 -34.29 71.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.68 0.276 . . . . 0.0 110.689 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -73.63 106.55 5.44 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.608 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -80.58 -28.8 37.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.068 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -146.38 165.25 29.9 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.944 0.402 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.11 -15.67 61.48 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.55 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -63.1 -44.94 94.27 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.48 -37.98 77.49 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.848 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -66.53 -53.62 32.84 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.917 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.45 -38.0 84.87 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.665 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.92 -35.27 76.25 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.591 0.234 . . . . 0.0 111.22 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -76.17 -34.2 59.35 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.329 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.2 t -67.09 -48.24 79.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 120.621 0.248 . . . . 0.0 110.622 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.48 -34.03 76.88 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.082 179.656 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.25 -48.38 65.23 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -59.33 -42.72 92.12 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.3 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.11 -44.0 95.17 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.795 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -37.26 86.56 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.777 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -69.66 -47.85 61.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.832 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.24 -33.91 69.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.206 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -56.54 -39.45 73.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.149 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -75.01 -38.92 61.45 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.791 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -59.89 -31.86 70.2 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.674 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -92.89 148.57 36.13 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-O 120.811 0.338 . . . . 0.0 111.104 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -80.17 169.63 17.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.999 2.466 . . . . 0.0 112.653 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.22 128.67 11.49 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.513 2.142 . . . . 0.0 112.525 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 t70 62.51 69.26 0.61 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.283 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -136.31 158.05 45.35 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.229 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.18 -44.68 96.06 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.326 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.3 m -64.7 -30.65 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.373 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 12.5 t -69.37 -40.73 80.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.893 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.58 -35.36 68.11 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.024 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 6.1 mtt -65.6 -44.29 87.05 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.744 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.27 -47.59 85.36 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.238 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -59.57 -43.41 93.63 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.745 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -68.62 -40.45 80.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.868 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -34.4 78.23 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.086 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -69.3 -44.0 72.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.698 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -63.54 -46.86 84.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.15 -43.09 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.198 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.0 -50.63 67.76 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.787 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -45.98 85.39 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.762 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.2 mtp -62.44 -46.29 89.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -64.73 -42.5 95.17 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.02 -45.26 95.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.815 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.68 73.18 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.9 -43.36 65.49 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.065 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.7 ptm -69.27 -33.32 73.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.214 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.46 -42.82 14.13 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.047 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.729 0.299 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -57.97 -36.94 73.3 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 mt -62.54 -34.82 77.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.024 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 -32.62 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.076 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.31 -48.22 57.58 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.068 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 30.1 p -66.11 -36.99 84.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.385 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 82.9 p -57.57 -34.42 69.18 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.96 -43.46 98.1 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.454 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mt -63.99 -45.74 95.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.849 0.357 . . . . 0.0 110.058 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.491 HD13 ' CZ ' ' A' ' 67' ' ' PHE . 9.3 tp -61.27 -35.46 77.36 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -36.38 73.01 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.142 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -37.82 82.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.822 -0.172 . . . . 0.0 111.18 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -37.39 75.76 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 110.273 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -108.45 17.65 21.85 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.299 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.73 0.14 57.17 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt 78.43 16.78 1.17 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.288 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.57 -36.22 6.25 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.63 179.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -113.55 -3.26 13.68 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.786 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.75 -29.47 68.18 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.447 0.165 . . . . 0.0 111.409 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.67 -46.1 83.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.649 0.262 . . . . 0.0 110.85 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.6 -34.21 71.89 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.865 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -98.15 19.55 13.93 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.572 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.489 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 42.6 t90 -59.58 -51.63 79.76 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 116.77 -0.196 . . . . 0.0 111.47 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 57.0 Cg_endo -70.35 -9.66 26.38 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.251 1.967 . . . . 0.0 113.01 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -120.13 43.16 2.77 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.044 0.45 . . . . 0.0 110.903 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.43 -37.95 11.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.683 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -107.86 160.93 25.0 Favored Pre-proline 0 N--CA 1.465 0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.055 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.35 -176.07 0.13 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.969 2.446 . . . . 0.0 112.761 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.31 79.43 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.11 0.481 . . . . 0.0 111.308 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -63.76 101.44 0.36 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.68 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.66 -39.53 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.715 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -71.92 -46.86 56.15 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.271 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -70.5 -48.75 54.16 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.51 -21.49 38.6 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.66 54.23 13.29 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.476 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HB2' ' HB2' ' A' ' 39' ' ' TYR . 0.5 OUTLIER -126.34 67.88 1.22 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.016 0.436 . . . . 0.0 111.148 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -65.41 -22.2 66.75 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.312 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.3 -19.89 57.83 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.318 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.453 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.4 t80 -60.79 -45.61 93.72 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-O 120.536 0.207 . . . . 0.0 110.964 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 26.8 t -63.48 -30.88 71.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.56 -34.39 62.93 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.882 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 mt -83.73 -34.81 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.517 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.453 HG13 ' CE2' ' A' ' 39' ' ' TYR . 30.8 mm -102.28 124.55 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -87.45 -33.27 19.1 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.392 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 75.26 68.79 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.738 0.304 . . . . 0.0 110.945 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.32 128.94 32.58 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.885 2.39 . . . . 0.0 112.692 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -152.18 141.32 21.32 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.036 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.35 162.7 31.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.789 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.52 -39.89 65.01 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.716 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.7 t -64.14 -37.71 88.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.4 m -74.05 -36.49 64.37 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.297 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.43 HG23 ' CE1' ' A' ' 67' ' ' PHE . 9.6 mt -71.58 -44.3 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.859 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.9 mtpm? -64.21 -37.77 88.65 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 p -57.9 -38.76 76.41 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.372 0.13 . . . . 0.0 111.122 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -60.36 -48.25 82.55 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.5 tp -62.91 -34.98 78.57 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.468 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.17 -38.58 91.75 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.271 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.46 15.15 9.75 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 59.56 27.28 16.44 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.653 0.263 . . . . 0.0 111.504 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.67 -32.38 57.9 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.665 0.269 . . . . 0.0 110.594 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 4.7 m-85 -71.11 104.93 3.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.872 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -62.64 -30.77 71.61 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.96 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.99 172.48 11.43 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.764 0.316 . . . . 0.0 111.32 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.32 -17.58 64.29 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.589 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -62.82 -43.23 99.36 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.659 0.266 . . . . 0.0 110.507 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.89 -34.67 71.82 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.831 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.491 ' CZ ' HD13 ' A' ' 10' ' ' LEU . 1.8 t80 -62.81 -53.38 55.12 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.073 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.21 -33.19 64.5 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.705 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.41 -44.88 86.03 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.529 0.204 . . . . 0.0 111.286 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -66.7 -30.76 71.08 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.343 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.6 t -67.09 -47.33 82.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-O 120.692 0.282 . . . . 0.0 110.374 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -62.57 -41.29 98.83 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -47.63 83.53 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.724 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 12.8 tmm? -61.88 -45.98 91.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.893 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -61.92 -42.49 99.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.171 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.4 m -62.67 -42.8 99.81 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.147 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -73.86 -47.12 40.53 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.154 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.0 t -60.19 -37.39 80.06 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.243 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -60.72 -33.12 72.42 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.019 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -61.52 -35.69 78.44 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.728 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -85.53 -34.02 21.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.356 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.0 m-20 -56.76 111.67 3.59 Favored Pre-proline 0 N--CA 1.466 0.365 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.107 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.46 154.17 31.35 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.803 2.335 . . . . 0.0 112.654 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.0 136.22 24.49 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.569 2.179 . . . . 0.0 112.516 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.63 55.45 4.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.419 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -121.79 148.62 44.44 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.7 -44.09 81.17 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.308 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.7 m -61.57 -33.17 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.384 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -65.5 -44.47 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.781 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.76 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.2 mtp -65.79 -42.37 90.81 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.73 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.5 -47.69 84.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -59.71 -44.14 93.83 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.809 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -41.97 91.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.721 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 80.3 mt -65.15 -34.43 78.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.184 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -69.12 -43.92 73.42 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.631 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.41 -47.08 83.48 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.162 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.69 -42.96 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.012 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -63.57 -50.91 67.62 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.817 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -44.29 93.57 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.019 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -48.11 83.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.023 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -42.67 86.28 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -46.95 85.88 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.017 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.79 81.93 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.25 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -43.58 65.44 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.368 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -69.7 -34.12 73.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.01 -42.08 15.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.615 0.245 . . . . 0.0 111.069 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 . . . . . 0 C--O 1.252 1.189 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.586 179.94 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.631 0.253 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -59.82 -36.33 76.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.931 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 13.8 mt -58.74 -46.74 86.72 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.9 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.07 -37.46 75.5 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.086 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -40.29 96.72 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.031 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.76 -37.76 79.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.914 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.6 t -58.07 -38.53 76.52 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.998 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -45.31 95.77 Favored Glycine 0 C--N 1.336 0.535 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.379 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -64.14 -42.97 97.23 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.77 0.319 . . . . 0.0 110.357 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.2 mt -62.37 -35.61 79.7 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.706 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -28.77 64.78 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.806 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 39.6 mt-10 -58.48 -37.12 74.87 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.587 0.232 . . . . 0.0 111.006 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -37.02 78.12 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.609 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.25 21.63 15.59 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.421 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -113.47 18.8 17.41 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.717 0.294 . . . . 0.0 111.506 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.47 28.59 4.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.246 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -117.21 -31.93 5.16 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.394 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.48 ' CE1' HG13 ' A' ' 98' ' ' VAL . 1.7 t60 -148.58 30.49 0.82 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 110.832 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.81 -40.93 54.09 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.121 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.27 -37.13 74.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.119 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.419 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 25.4 m-85 -77.82 -34.17 52.13 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.435 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -103.34 20.91 16.9 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -53.3 43.45 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-N 116.933 -0.121 . . . . 0.0 111.14 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -78.36 -5.78 15.17 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.349 2.032 . . . . 0.0 112.907 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -106.36 37.79 2.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.645 0.26 . . . . 0.0 110.93 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -121.39 -58.09 1.8 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.954 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.65 145.62 92.67 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.888 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.42 ' HA ' ' CB ' ' A' ' 48' ' ' ASP . 72.2 Cg_endo -76.96 -177.12 3.57 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.607 2.205 . . . . 0.0 112.679 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.5 m -112.6 79.76 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.041 0.448 . . . . 0.0 111.172 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.94 104.35 0.23 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.968 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.4 p -62.43 -39.8 85.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.548 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.26 -45.9 58.21 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.702 -0.227 . . . . 0.0 111.606 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.99 -48.48 44.56 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.0 mt -81.31 -21.48 39.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.59 58.41 5.42 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.458 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -130.92 75.93 1.69 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.898 0.38 . . . . 0.0 111.442 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -6.16 45.15 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.741 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.28 -20.01 57.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.385 0.136 . . . . 0.0 111.291 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.18 -41.42 83.85 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.751 -0.204 . . . . 0.0 111.012 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -64.04 -40.35 96.11 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.652 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.62 -44.31 90.94 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.818 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.4 mt -71.82 -51.68 30.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.076 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 mt -128.11 104.12 11.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.915 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -59.36 -29.89 68.01 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.512 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -110.27 81.51 2.28 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 120.817 0.341 . . . . 0.0 110.615 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.21 139.03 37.73 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.668 2.246 . . . . 0.0 112.603 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.7 tpp -149.56 138.56 21.18 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.245 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.42 ' CB ' ' HA ' ' A' ' 28' ' ' PRO . 26.0 m-20 -136.75 164.42 28.31 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.722 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -52.43 -41.43 63.24 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.719 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.5 t -65.41 -38.85 91.17 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.781 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -71.43 -43.31 66.97 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.114 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.404 HG21 ' OH ' ' A' ' 61' ' ' TYR . 8.4 mt -65.14 -45.12 95.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.175 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.24 -34.68 78.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -57.56 -40.25 78.53 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.983 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -60.25 -47.65 85.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.851 0.358 . . . . 0.0 110.121 179.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.5 tp -66.97 -33.42 75.54 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.595 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -64.11 -41.52 97.22 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.402 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.23 15.15 9.39 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? 58.96 27.85 16.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.588 0.233 . . . . 0.0 111.394 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.9 -32.83 45.9 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.63 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.419 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 1.8 m-85 -65.4 105.7 1.22 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.933 0.397 . . . . 0.0 110.844 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -32.16 70.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -162.97 165.28 25.15 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.87 0.367 . . . . 0.0 111.596 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -20.11 64.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.267 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 110.27 -0.271 . . . . 0.0 110.27 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -69.68 -34.18 73.6 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.887 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.419 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 3.1 t80 -59.2 -53.64 55.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.96 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.73 -35.94 90.77 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.373 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.67 -36.65 79.27 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -76.64 -38.99 53.72 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.167 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.6 t -67.04 -47.75 81.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.948 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -59.28 -33.73 71.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.591 0.234 . . . . 0.0 110.789 179.49 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 tt -71.87 -42.1 67.26 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.473 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 9.8 tpp -60.29 -46.6 89.27 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.197 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -55.71 -40.67 72.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.147 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.2 t -67.78 -41.81 82.65 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.014 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.41 -37.64 65.85 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.393 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -35.96 73.14 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.643 0.259 . . . . 0.0 111.073 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.85 -31.78 68.83 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.193 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.12 -36.03 80.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.748 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -35.94 22.27 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.06 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.404 ' HB3' HG23 ' A' ' 89' ' ' VAL . 15.8 m-20 -67.52 125.66 91.49 Favored Pre-proline 0 N--CA 1.466 0.325 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.071 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.92 158.5 11.04 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.981 2.454 . . . . 0.0 112.86 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -74.57 118.69 5.43 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.596 2.197 . . . . 0.0 112.478 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t0 62.57 70.58 0.56 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.071 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -132.53 156.69 46.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.302 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -57.09 -44.28 83.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.186 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.9 m -64.39 -31.88 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.753 0.311 . . . . 0.0 111.141 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.404 HG23 ' HB3' ' A' ' 82' ' ' ASN . 25.8 t -65.73 -40.32 87.46 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 93' ' ' ARG . . . -57.43 -34.42 68.92 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.918 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -33.04 73.81 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.73 66.01 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -68.1 -38.52 82.39 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.856 179.742 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -61.28 -44.98 96.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.78 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.14 -34.83 78.93 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.746 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -69.96 -41.65 74.22 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.593 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.38 -46.82 88.56 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.063 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.48 HG13 ' CE1' ' A' ' 18' ' ' HIS . 8.2 p -66.17 -42.92 92.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.898 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.88 -49.82 71.2 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.7 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.51 -40.97 98.43 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.85 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -47.75 84.54 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.68 0.276 . . . . 0.0 110.663 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -43.68 80.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.633 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -45.47 92.37 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.858 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.27 -42.56 95.65 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -70.24 -36.19 74.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.755 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -40.53 76.32 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.029 179.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.67 -42.55 17.99 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -178.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.45 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 . . . . . 0 N--CA 1.488 1.434 0 CA-C-O 120.706 0.289 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.8 -36.87 85.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.866 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.65 -44.14 96.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.845 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -67.86 -39.39 83.76 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.936 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.64 95.56 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.013 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 94.5 m -59.42 -37.24 77.55 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.786 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 m -55.05 -34.13 63.3 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.266 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.78 -47.4 91.15 Favored Glycine 0 C--N 1.337 0.614 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.399 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mt -64.02 -46.64 93.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.791 0.329 . . . . 0.0 110.317 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 tp -63.02 -35.67 81.0 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.634 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.47 -27.49 64.45 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.485 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HG3' ' HB2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -58.46 -36.54 73.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.359 0.123 . . . . 0.0 111.014 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.0 mtm -57.85 -37.23 73.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.721 0.295 . . . . 0.0 110.371 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.84 8.16 32.61 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.695 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -93.32 14.48 18.24 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.561 0.22 . . . . 0.0 111.48 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 68.53 32.24 4.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.984 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.2 mttm -123.17 -37.79 2.66 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -119.34 18.23 12.95 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.321 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.27 -29.98 48.28 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.278 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.61 -37.64 76.96 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.863 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.407 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 2.8 m-85 -80.16 -33.93 38.0 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -98.07 19.38 14.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.881 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.48 -51.34 68.05 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 121.405 -0.118 . . . . 0.0 111.055 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.23 -23.2 75.2 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.614 2.209 . . . . 0.0 112.806 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -123.87 34.64 5.02 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.927 0.394 . . . . 0.0 110.542 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -76.95 -46.84 22.73 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.776 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 166.6 11.59 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.842 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.22 -171.41 0.7 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.63 2.22 . . . . 0.0 112.436 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.7 m -113.18 76.35 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.045 0.45 . . . . 0.0 111.275 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -60.1 98.56 0.06 Allowed 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.1 p -60.54 -38.65 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.833 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -72.12 -46.88 54.9 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.52 -48.34 41.18 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.5 mt -80.81 -21.5 40.83 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.15 52.13 47.04 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.35 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.47 71.66 0.85 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.05 0.452 . . . . 0.0 111.288 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -67.17 -14.85 63.3 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.477 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.17 -19.76 58.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.401 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -61.28 -39.07 89.04 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 116.74 -0.209 . . . . 0.0 111.056 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -37.9 86.44 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.773 0.32 . . . . 0.0 110.561 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -67.48 -41.73 84.12 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.917 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 18.0 mt -77.71 -54.77 11.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.239 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.3 mm -100.95 104.74 16.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.082 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -66.95 -27.3 67.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.486 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.67 72.38 78.14 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.698 0.285 . . . . 0.0 110.802 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -58.0 132.17 47.94 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.359 . . . . 0.0 112.489 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -158.42 127.63 5.66 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.31 170.81 9.92 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.931 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.2 ttm -55.73 -36.56 67.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.895 0.379 . . . . 0.0 110.182 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.0 t -62.13 -38.93 90.81 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.677 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 m -73.29 -36.29 66.28 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.105 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.4 mt -66.51 -44.78 90.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.627 0.251 . . . . 0.0 110.981 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -35.33 80.15 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.154 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.6 p -57.47 -41.14 80.03 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.472 0.177 . . . . 0.0 111.13 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -46.55 88.78 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.74 -34.73 78.49 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.775 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.38 -41.41 93.73 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.4 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.66 15.28 11.3 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.31 27.55 16.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.649 0.261 . . . . 0.0 111.498 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -73.32 -32.74 64.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.743 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.462 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 4.6 m-85 -69.04 103.93 1.99 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.781 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -63.21 -29.39 70.74 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.476 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -166.41 179.68 5.44 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.904 0.383 . . . . 0.0 111.567 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.77 -20.94 61.08 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.409 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.86 -45.99 89.98 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.674 0.273 . . . . 0.0 110.327 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.76 -30.14 69.52 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.797 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.462 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -59.85 -49.74 76.53 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.595 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.92 -33.11 77.22 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.513 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.73 -35.87 75.44 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.567 0.222 . . . . 0.0 111.17 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.3 61.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.811 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.7 t -64.82 -48.32 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.081 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -33.75 74.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.031 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.3 tp -70.69 -47.06 61.79 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.62 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.7 ttp -60.49 -43.83 96.58 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.414 ' CE2' ' HB2' ' A' ' 96' ' ' GLN . 3.2 m-85 -58.43 -43.51 88.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 t -59.27 -45.54 90.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.735 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -70.48 -39.92 73.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.724 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -42.5 91.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.106 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -58.12 -39.77 79.55 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.132 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.85 -45.65 73.99 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.978 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -72.17 -39.84 68.39 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.197 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -67.9 125.25 91.15 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.187 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.32 164.46 34.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.714 2.276 . . . . 0.0 112.428 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.38 128.91 11.55 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.562 2.175 . . . . 0.0 112.585 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.8 t0 60.2 68.07 0.8 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.0 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -131.63 157.8 42.73 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.28 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.33 -44.31 84.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.039 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.8 m -64.17 -32.87 59.13 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.163 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 23.9 t -68.74 -44.62 82.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.31 73.2 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.884 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 42.1 mtt -66.07 -40.27 90.75 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.87 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.36 90.21 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -49.12 79.05 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.407 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.1 tttm -66.57 -39.21 88.36 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.891 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -35.16 76.47 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.414 ' HB2' ' CE2' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -68.98 -44.58 72.6 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.739 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.51 -46.71 84.83 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.28 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.3 p -62.22 -43.13 97.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.14 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -49.65 70.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.669 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -42.92 99.75 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -48.01 83.36 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.996 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 106' ' ' MET . 0.0 OUTLIER -67.23 -44.27 79.9 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.912 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -59.83 -48.67 80.76 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.856 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.87 -37.59 84.72 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.521 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -72.1 -44.21 63.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 1.3 tmm? -67.03 -45.09 78.54 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.382 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -40.14 35.63 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.891 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.411 -179.666 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 120.744 0.307 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -59.58 -42.56 92.77 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.769 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.78 -46.11 83.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.813 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -33.6 74.01 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.954 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.57 -43.38 85.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.674 0.273 . . . . 0.0 110.724 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 93.9 m -62.55 -40.77 97.88 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.464 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -36.08 75.21 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.057 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.29 91.89 Favored Glycine 0 C--N 1.335 0.52 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.359 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.52 -47.51 86.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.705 0.288 . . . . 0.0 110.502 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.26 -35.61 80.92 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.16 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mttp -57.96 -31.14 66.58 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.229 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.42 ' CG ' ' HD3' ' A' ' 17' ' ' LYS . 4.3 tt0 -59.65 -38.07 80.42 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.502 0.192 . . . . 0.0 110.985 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -61.67 -38.12 86.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.727 0.299 . . . . 0.0 110.484 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -96.35 -1.74 47.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.609 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.6 9.83 22.64 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 75.65 20.85 1.79 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.612 0.365 . . . . 0.0 111.335 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.42 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 9.8 mtpt -108.73 -38.94 5.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.32 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.448 ' NE2' HG13 ' A' ' 98' ' ' VAL . 6.6 m-70 -121.44 16.35 11.3 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.289 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.08 -32.42 59.25 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.336 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.75 96.03 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.738 0.304 . . . . 0.0 111.039 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -72.84 -36.32 67.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.906 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.29 24.89 10.82 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.498 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.458 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.41 -57.73 16.34 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.388 -179.647 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 24.5 Cg_endo -62.01 -17.15 54.41 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.372 2.048 . . . . 0.0 113.002 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.37 35.51 3.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 111.08 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.99 -35.61 37.2 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.633 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.417 ' HB2' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -119.63 156.64 53.44 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.369 -179.759 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.417 ' HD2' ' HB2' ' A' ' 27' ' ' LYS . 29.6 Cg_endo -63.19 -178.55 0.46 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.902 2.402 . . . . 0.0 112.714 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.7 m -114.89 86.69 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.13 0.491 . . . . 0.0 111.156 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.44 103.56 0.25 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.713 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.2 p -59.71 -40.94 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.14 -46.05 58.05 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.01 48.77 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 mt -81.91 -21.57 37.27 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.29 64.27 2.94 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.566 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.53 79.46 1.8 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.313 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -10.26 59.29 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.662 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -76.23 -19.64 58.18 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.418 0.151 . . . . 0.0 111.34 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -57.75 -34.71 69.82 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.508 0.194 . . . . 0.0 111.141 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 35.2 t -65.21 -37.45 87.34 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.83 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -75.83 -43.41 46.08 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.213 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.404 HD13 ' CE2' ' A' ' 81' ' ' TYR . 45.7 mt -74.12 -61.6 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.279 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.8 mm -90.96 106.62 17.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.28 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 pttp -66.14 -33.69 76.36 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -124.71 94.38 44.5 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.708 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.22 110.97 2.13 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.679 2.253 . . . . 0.0 112.364 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.7 tpp -144.21 133.32 22.88 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.68 163.57 27.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.184 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 67.6 mtt -54.72 -38.25 66.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.928 -179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 t -62.36 -38.15 88.42 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.604 0.24 . . . . 0.0 110.824 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 91.3 m -74.17 -39.84 62.95 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.993 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 9.2 mt -65.35 -45.08 94.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 120.574 0.226 . . . . 0.0 111.07 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -36.51 83.28 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.9 t -57.72 -39.43 77.26 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.917 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -49.57 77.07 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.8 tp -61.16 -34.08 74.46 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.468 179.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -65.29 -37.34 86.86 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.118 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.77 15.27 8.56 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 60.83 27.25 17.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.624 0.25 . . . . 0.0 111.546 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -34.21 53.85 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.803 0.335 . . . . 0.0 110.583 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.445 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 6.0 m-85 -78.78 107.29 11.38 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.797 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -92.16 -27.38 17.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.222 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -139.15 164.06 30.78 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.894 0.378 . . . . 0.0 111.64 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.73 -18.63 60.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.509 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -45.2 93.73 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.593 0.235 . . . . 0.0 110.457 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -70.49 -36.81 74.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.705 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.445 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 5.6 t80 -63.98 -53.81 44.31 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.901 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.12 -31.51 77.04 Favored Glycine 0 C--N 1.334 0.461 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.661 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.77 94.65 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 111.446 0.165 . . . . 0.0 111.446 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.91 -39.12 83.63 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.8 t -65.2 -48.22 84.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.972 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -64.83 -34.07 77.49 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.145 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -47.81 84.35 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.876 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -60.54 -41.02 93.63 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.949 179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -58.23 -46.36 86.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.93 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.7 m -63.33 -42.03 98.93 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.765 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.3 m-20 -69.27 -34.17 74.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.885 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.07 -33.77 73.86 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.262 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -60.65 -34.21 73.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.095 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.35 -41.25 73.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.853 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.404 ' CE2' HD13 ' A' ' 42' ' ' ILE . 1.1 t80 -78.55 -34.98 46.73 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.306 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 -92.28 111.83 52.29 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.267 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.406 ' HG2' ' CD2' ' A' ' 86' ' ' HIS . 41.7 Cg_endo -66.64 156.44 65.69 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.753 2.302 . . . . 0.0 112.312 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -66.95 154.66 73.89 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.58 2.187 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.67 37.75 15.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.187 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.406 ' CD2' ' HG2' ' A' ' 83' ' ' PRO . 2.5 t-80 -120.04 150.34 40.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.156 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -44.02 85.33 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.7 p -56.76 -36.33 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.554 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 15.6 t -61.04 -44.48 98.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.659 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.65 -36.63 72.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.048 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.4 mtp -62.54 -44.14 97.07 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.898 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -40.66 96.9 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.319 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -47.96 82.76 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.716 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -62.83 -41.59 99.39 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.98 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -37.47 82.91 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.899 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -70.05 -41.83 73.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.656 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.67 -46.95 88.4 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.171 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.448 HG13 ' NE2' ' A' ' 18' ' ' HIS . 9.2 p -68.0 -42.92 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.195 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -64.4 -51.54 62.72 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.569 0.223 . . . . 0.0 110.777 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -60.62 -44.09 96.74 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.075 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 4.7 mtp -60.09 -46.73 88.6 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.987 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.08 77.81 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.147 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -42.92 95.97 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.614 -0.267 . . . . 0.0 110.887 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.98 -32.77 73.41 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.91 -44.22 70.11 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.795 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.0 ptm -69.38 -34.67 74.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.359 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.09 -42.38 17.48 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.074 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.731 0.3 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -62.08 -43.84 97.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.901 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.87 -36.83 75.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.092 179.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -61.47 -34.79 76.05 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.956 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 47.7 t -62.38 -39.21 92.45 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.881 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.4 m -59.68 -38.57 81.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.881 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.2 t -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.75 -38.09 93.37 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.37 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.2 mt -66.68 -45.86 87.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-O 120.748 0.308 . . . . 0.0 110.38 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.52 80.32 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.802 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mtpp -58.38 -28.2 64.94 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.712 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 89.7 mt-10 -58.71 -36.45 74.27 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.585 0.231 . . . . 0.0 110.68 179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 6.6 mtt -59.56 -37.23 77.89 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.556 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.67 1.9 38.1 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.423 ' HB2' ' HA ' ' A' ' 12' ' ' GLU . . . -97.22 19.5 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.647 0.26 . . . . 0.0 111.637 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 mmtt 68.62 28.59 5.72 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.304 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.2 mttt -116.1 -31.25 5.75 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.967 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 29.95 1.3 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.801 0.334 . . . . 0.0 110.805 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.15 -36.63 47.42 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.35 -31.36 69.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.264 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.41 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 23.8 m-85 -86.23 -29.81 22.86 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.584 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -113.24 23.25 13.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.554 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.5 t90 -62.77 -53.91 52.05 Favored Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 122.481 -0.137 . . . . 0.0 110.913 179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.554 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 92.4 Cg_endo -83.94 -16.77 6.2 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.634 2.223 . . . . 0.0 113.539 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -101.8 33.54 2.97 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.634 0.254 . . . . 0.0 111.61 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -107.27 -46.07 3.96 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.054 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -85.62 161.21 51.61 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.235 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -68.73 166.47 26.03 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.837 2.358 . . . . 0.0 112.743 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.8 m -90.43 82.41 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.152 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -59.74 105.1 0.34 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.053 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.37 -40.34 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.744 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -72.22 -45.06 61.82 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.27 -48.43 51.02 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.1 mt -80.75 -21.74 40.81 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.26 52.19 18.81 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.476 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.17 75.74 1.64 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.97 0.414 . . . . 0.0 111.346 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.26 -11.47 60.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.409 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -17.42 59.45 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.458 0.169 . . . . 0.0 111.458 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -55.79 -39.53 71.4 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.501 0.191 . . . . 0.0 111.129 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.37 -36.51 83.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.678 0.275 . . . . 0.0 110.65 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.78 -45.02 46.45 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.407 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.9 mt -75.4 -52.97 17.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.706 0.288 . . . . 0.0 111.427 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.1 mm -92.2 104.85 16.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.154 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -72.1 -34.15 68.4 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.365 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -114.37 92.37 27.55 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.83 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.34 128.4 18.29 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.677 2.252 . . . . 0.0 112.563 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.86 139.98 14.25 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.384 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.1 164.03 32.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.283 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.7 mtt -58.05 -36.48 72.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.909 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.0 t -61.8 -34.69 76.37 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.63 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.45 -36.47 63.35 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.175 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.7 mt -68.65 -44.62 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-O 120.676 0.274 . . . . 0.0 110.828 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -62.59 -45.37 93.23 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.203 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 p -57.59 -39.12 76.08 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.806 -0.179 . . . . 0.0 110.875 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.42 ' HD3' ' CZ ' ' A' ' 61' ' ' TYR . 20.2 tttp -60.35 -48.66 80.77 Favored 'General case' 0 N--CA 1.462 0.137 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -35.5 81.34 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.318 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.32 -37.34 86.88 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.279 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.04 15.23 7.62 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.79 27.42 17.2 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.281 0.232 . . . . 0.0 111.597 -179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -80.84 -34.53 33.76 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.725 0.297 . . . . 0.0 110.674 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.42 ' CZ ' ' HD3' ' A' ' 55' ' ' LYS . 3.3 m-85 -77.4 93.37 4.06 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.489 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.0 mtt85 -65.42 -28.87 69.55 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.808 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -159.27 174.08 15.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.861 0.362 . . . . 0.0 111.366 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -10.39 59.68 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.888 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -62.99 -47.65 82.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.569 0.223 . . . . 0.0 110.614 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -72.97 -39.22 66.31 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.579 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -58.41 -53.7 55.31 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.88 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.27 -36.21 90.24 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.446 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.31 96.43 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.606 0.241 . . . . 0.0 110.986 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.98 -37.21 69.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.226 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.7 t -64.11 -48.46 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.384 0.135 . . . . 0.0 111.272 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -64.7 -32.87 74.73 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.734 -0.212 . . . . 0.0 111.2 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -47.13 74.73 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.806 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttm -59.3 -44.34 92.53 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.228 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -58.01 -42.26 84.86 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.046 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.06 -45.47 90.7 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.93 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.5 m-20 -74.73 -33.09 62.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.121 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -39.29 79.69 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.985 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -64.56 -32.18 73.72 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -67.88 -36.46 80.29 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.801 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -82.39 -38.15 24.53 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.333 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -63.56 111.12 4.55 Favored Pre-proline 0 N--CA 1.466 0.357 0 CA-C-N 116.64 -0.254 . . . . 0.0 111.21 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.62 145.91 87.94 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.941 2.427 . . . . 0.0 112.513 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -56.14 135.96 72.65 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.662 2.241 . . . . 0.0 112.384 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 t70 60.27 60.04 2.15 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -130.66 151.93 50.57 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.94 -43.97 86.65 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.158 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -62.51 -32.15 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.599 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.5 t -62.77 -45.36 99.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.695 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -41.2 86.69 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.603 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.2 mtt -65.74 -43.39 89.13 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.745 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.58 -47.74 78.9 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.212 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -63.01 -48.92 76.71 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.829 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.41 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 36.0 tttp -62.48 -41.52 98.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.822 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.47 -36.09 82.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.695 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -70.06 -44.28 69.47 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.765 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.17 -46.81 88.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.239 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.6 p -64.73 -42.77 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.922 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -51.32 62.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.436 0.16 . . . . 0.0 110.787 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -46.25 87.83 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.998 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -46.28 90.26 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.839 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -67.07 -43.98 81.24 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.822 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.14 -42.47 94.89 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.82 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.58 -32.84 74.65 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -71.52 -44.17 65.14 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.084 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 4.7 ptm -69.28 -36.06 76.68 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.322 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.5 -41.56 21.53 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.747 -0.206 . . . . 0.0 110.863 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.987 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.744 0.307 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -61.38 -43.44 98.86 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.856 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.99 -40.54 95.1 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.725 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.04 -34.6 78.44 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.144 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.62 -38.15 86.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.737 0.303 . . . . 0.0 110.775 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.0 m -64.52 -37.37 87.31 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.314 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.0 p -58.5 -40.99 84.36 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.7 -0.227 . . . . 0.0 111.147 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -63.07 -45.87 94.58 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.073 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.2 mt -64.28 -45.56 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 120.718 0.294 . . . . 0.0 110.29 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.34 -35.53 80.69 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.641 179.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -58.15 -27.88 64.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.443 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.31 -36.33 73.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.406 0.146 . . . . 0.0 110.859 179.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.9 mmt -57.46 -37.54 73.03 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.499 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.92 10.78 28.39 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.65 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.46 11.21 24.71 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 75.2 26.9 1.16 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 122.578 0.351 . . . . 0.0 111.196 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -121.51 -34.89 3.35 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.402 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.8 OUTLIER -132.83 22.82 4.23 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.622 0.249 . . . . 0.0 111.016 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.97 -36.2 72.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.992 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.34 -36.41 66.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.215 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -75.84 -35.36 59.98 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.39 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -106.57 23.49 14.15 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -54.59 5.35 Favored Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 116.923 -0.126 . . . . 0.0 111.244 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -85.59 12.6 3.0 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.621 2.214 . . . . 0.0 113.23 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -130.53 56.13 1.78 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.03 0.443 . . . . 0.0 110.785 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.19 -48.82 1.0 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.051 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -64.77 154.08 86.38 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-O 120.599 0.238 . . . . 0.0 111.07 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.72 179.12 6.81 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.851 2.368 . . . . 0.0 112.737 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.7 m -92.57 68.9 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.018 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -59.49 98.97 0.05 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.067 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.11 -37.1 77.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.749 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.11 -45.83 59.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.584 0.216 . . . . 0.0 111.584 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.61 -47.71 45.58 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -80.94 -21.56 40.35 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.65 50.35 49.26 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.385 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -121.33 63.2 0.89 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.438 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -62.25 -18.2 60.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.448 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -76.06 -19.72 58.36 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.58 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -54.81 -39.11 68.14 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.617 0.246 . . . . 0.0 110.939 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -65.04 -40.44 94.81 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.8 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.46 -43.13 91.32 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.31 -45.4 75.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.965 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 7.7 mt -127.45 111.7 25.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.951 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -72.25 -29.86 64.32 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.358 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -118.68 66.96 7.36 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 110.784 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.82 156.42 39.39 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.769 2.313 . . . . 0.0 112.546 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.8 tpp -158.89 160.34 36.01 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.17 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -148.21 166.06 29.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.51 -37.3 70.25 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -65.67 -41.33 92.59 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.401 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -65.04 -41.03 95.59 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.047 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 18.0 mt -67.57 -44.9 86.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.9 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.45 -34.85 77.62 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.979 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.5 t -57.55 -42.23 82.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.041 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.75 -48.02 83.66 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.797 0.332 . . . . 0.0 110.177 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.3 tp -64.7 -33.69 76.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.844 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.23 -41.49 98.46 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.415 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.84 15.24 10.17 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 59.11 27.39 16.35 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.651 0.263 . . . . 0.0 111.551 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.42 -32.22 58.36 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.706 0.289 . . . . 0.0 110.687 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.403 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 1.8 m-85 -71.02 100.19 1.95 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.3 ttp85 -63.42 -31.54 72.72 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.141 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -162.65 174.56 12.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.826 0.346 . . . . 0.0 111.42 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.83 -14.55 62.81 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.885 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -46.61 87.51 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.663 0.268 . . . . 0.0 110.394 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.68 -35.48 72.83 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.013 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.403 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 3.3 t80 -61.88 -52.07 65.61 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -56.41 -33.36 61.85 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.631 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.51 96.01 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.562 0.22 . . . . 0.0 111.165 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.55 -36.68 84.58 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.423 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -63.06 -48.39 88.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 120.713 0.292 . . . . 0.0 110.789 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.1 mmp_? -64.96 -40.15 94.56 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.621 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -41.88 95.32 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.753 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.1 ttp -62.71 -46.61 87.3 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.556 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -36.21 74.15 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 38.5 m -60.57 -47.48 86.01 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.044 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -75.99 -31.55 59.02 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 121.096 -0.242 . . . . 0.0 111.07 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.28 -33.58 76.15 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.219 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.53 -37.29 75.35 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.534 0.207 . . . . 0.0 111.28 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -72.61 -39.71 67.07 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -78.24 -38.48 42.86 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.721 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.41 ' HB3' HG21 ' A' ' 89' ' ' VAL . 30.8 m-20 -62.53 128.13 91.08 Favored Pre-proline 0 N--CA 1.465 0.295 0 CA-C-O 120.554 0.216 . . . . 0.0 111.073 -179.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.68 135.5 16.14 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.602 2.201 . . . . 0.0 112.392 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -57.39 128.16 28.4 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.741 2.294 . . . . 0.0 112.406 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.0 t0 65.53 71.7 0.43 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.154 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -141.65 148.21 38.78 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.077 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -56.6 -43.08 79.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.364 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.06 -35.74 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.13 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 82' ' ' ASN . 30.0 t -66.4 -45.15 90.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.836 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.94 -39.04 80.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.814 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 24.8 mtt -63.05 -43.29 99.04 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.728 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.52 -48.61 80.25 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.5 mpp_? -54.62 -44.07 72.82 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.679 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -37.95 89.28 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.737 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.402 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -61.7 -37.26 83.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.972 179.571 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.03 -43.98 73.64 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.034 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.64 -46.59 89.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.34 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.53 -42.77 93.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.079 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.17 -50.32 66.39 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.913 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.55 -43.53 93.5 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.986 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -47.47 85.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.777 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? -67.86 -39.29 83.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.913 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -41.61 93.92 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.103 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.28 -32.91 74.81 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.284 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.4 tttp -69.72 -44.54 70.12 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.064 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 8.5 ptm -69.13 -33.38 73.36 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.089 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 12.9 mt -83.75 -41.55 17.5 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.273 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.052 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.684 0.278 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -61.67 -37.57 84.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.846 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mt -63.58 -46.91 83.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.065 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.19 -42.16 96.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.91 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.54 -44.35 96.57 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.5 m -58.96 -39.51 81.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.745 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 33.1 t -57.54 -41.13 80.33 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.055 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.12 94.46 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.578 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mt -64.12 -46.25 94.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.719 0.295 . . . . 0.0 110.459 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 mt -62.75 -35.83 81.08 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.714 179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -33.45 69.31 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.333 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.419 ' HA ' ' HB1' ' A' ' 15' ' ' ALA . 1.4 tt0 -58.55 -36.65 74.24 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.212 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.45 -36.98 72.11 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.431 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.67 12.62 22.6 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.419 ' HB1' ' HA ' ' A' ' 12' ' ' GLU . . . -96.71 17.86 15.6 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.724 0.297 . . . . 0.0 111.307 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 72.21 25.25 2.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.372 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.405 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 15.4 mtmt -118.69 -34.33 4.01 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.09 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.441 ' NE2' HG12 ' A' ' 98' ' ' VAL . 1.3 m-70 -132.42 21.72 4.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.001 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.8 -34.69 67.06 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.448 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.05 -40.28 68.45 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.744 0.306 . . . . 0.0 111.09 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -73.51 -34.21 65.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -111.62 28.69 8.51 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.456 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -68.33 -52.16 22.28 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.19 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.456 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.4 Cg_endo -85.5 11.15 3.44 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.554 2.17 . . . . 0.0 113.02 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -129.93 55.34 1.79 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.03 0.443 . . . . 0.0 110.825 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.86 -63.95 0.56 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.004 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.74 143.41 98.55 Favored Pre-proline 0 CA--C 1.531 0.241 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.834 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -57.31 156.66 24.65 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.91 2.407 . . . . 0.0 112.864 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.1 m -95.32 84.09 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.037 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.5 106.56 0.79 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.028 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.7 p -61.46 -38.42 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.621 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.3 -44.44 62.73 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.611 0.243 . . . . 0.0 111.483 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.73 43.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.3 mt -81.12 -21.54 39.79 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 57.19 7.37 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.424 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.34 64.04 1.25 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.04 0.448 . . . . 0.0 111.303 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -67.63 -13.06 61.76 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.67 179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.23 -20.08 57.77 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.404 0.145 . . . . 0.0 111.237 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -59.66 -35.65 74.85 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.557 0.218 . . . . 0.0 110.764 179.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.8 t -64.51 -38.68 91.85 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.947 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -67.18 -39.57 86.42 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.571 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.8 mt -74.13 -44.58 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.991 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.438 HG12 ' HB3' ' A' ' 77' ' ' ASN . 3.5 mp -137.82 137.01 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.656 0.265 . . . . 0.0 111.457 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -93.04 -25.45 17.94 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.804 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.91 79.82 2.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.71 153.77 38.74 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.707 2.271 . . . . 0.0 112.697 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.435 ' HB3' ' HG2' ' A' ' 74' ' ' MET . 5.6 ttm -165.64 158.87 15.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.362 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -144.28 163.95 32.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.565 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.6 ttm -54.98 -35.44 64.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.849 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 t -66.88 -40.94 87.93 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.747 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.7 m -66.83 -40.77 88.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 60.5 mt -66.81 -44.06 89.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 CA-C-O 120.78 0.324 . . . . 0.0 110.395 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.76 -36.61 82.84 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.326 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -42.31 82.25 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.432 0.16 . . . . 0.0 111.432 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -62.72 -49.55 74.6 Favored 'General case' 0 N--CA 1.461 0.102 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.8 -34.75 76.46 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.585 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -59.44 -40.58 87.24 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.05 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.67 15.34 11.2 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.19 28.37 14.01 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.303 0.241 . . . . 0.0 111.636 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -75.45 -37.35 60.39 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.678 0.275 . . . . 0.0 110.84 179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -75.88 97.46 3.95 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.542 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -78.12 -31.85 50.11 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -126.55 142.59 51.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.816 0.341 . . . . 0.0 111.105 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.03 -19.36 64.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.844 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -47.98 80.85 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.677 0.275 . . . . 0.0 110.543 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -62.31 -38.26 88.75 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.777 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -59.43 -53.85 53.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.88 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.78 87.74 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.711 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.2 74.72 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.571 0.224 . . . . 0.0 111.197 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.61 -39.93 64.2 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.312 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.7 t -63.67 -48.41 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.683 0.278 . . . . 0.0 110.646 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -64.95 -39.1 92.98 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.755 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.81 -46.07 83.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.671 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.435 ' HG2' ' HB3' ' A' ' 47' ' ' MET . 4.8 tpp -65.49 -41.73 92.93 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.353 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -55.9 -44.96 78.73 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 110.752 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.6 t -62.2 -40.69 96.9 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.733 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.438 ' HB3' HG12 ' A' ' 43' ' ' ILE . 80.6 m-20 -68.03 -46.04 72.29 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.059 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.23 -35.48 79.03 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.465 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.38 -33.46 67.85 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.883 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -64.87 -36.74 85.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.584 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.93 -37.41 29.59 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.162 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -61.14 111.16 3.78 Favored Pre-proline 0 N--CA 1.469 0.486 0 CA-C-O 120.488 0.185 . . . . 0.0 111.076 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -61.46 163.81 16.95 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.859 2.373 . . . . 0.0 112.505 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.37 151.14 65.43 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.644 2.229 . . . . 0.0 112.401 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 53.22 49.29 20.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.408 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -116.25 141.31 48.32 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.828 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -41.18 75.71 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.977 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 14.1 m -59.68 -32.79 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.578 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 32.9 t -65.71 -44.45 93.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.702 0.287 . . . . 0.0 110.574 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.32 93.87 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.876 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 11.8 mtt -61.28 -42.95 99.51 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.959 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.64 -44.66 81.5 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.269 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.68 -47.04 87.13 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -65.85 -40.22 91.5 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.2 mt -63.69 -38.79 92.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.962 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -70.16 -41.51 73.71 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.782 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -61.36 -46.86 88.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.143 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.441 HG12 ' NE2' ' A' ' 18' ' ' HIS . 9.3 p -66.06 -43.05 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.012 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -63.68 -50.14 70.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.722 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.9 -43.21 94.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.981 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -47.86 84.15 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.635 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -43.02 87.07 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.682 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.64 -41.92 91.58 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.064 179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.03 -37.08 80.95 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.907 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -67.07 -44.78 79.23 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.4 ptm -69.53 -33.46 72.83 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.256 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 19.1 mt -81.37 -42.1 20.97 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.356 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.406 179.834 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.762 0.315 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -66.62 -35.14 79.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.877 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.1 mt -61.03 -44.48 97.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.78 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -35.21 70.85 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.116 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -39.3 84.33 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.653 0.264 . . . . 0.0 110.83 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.3 m -63.1 -37.74 88.41 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.34 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.1 p -57.39 -33.72 68.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.642 -0.253 . . . . 0.0 111.129 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.44 -43.05 97.77 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.325 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 48.9 mt -64.03 -42.45 95.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.915 0.388 . . . . 0.0 110.498 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.2 mt -63.74 -35.65 81.28 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.698 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -30.8 67.19 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.748 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.61 -36.72 74.48 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.296 0.093 . . . . 0.0 111.173 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -37.63 76.29 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.651 0.262 . . . . 0.0 110.492 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.08 6.45 35.93 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.47 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.04 13.67 16.14 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.566 0.222 . . . . 0.0 111.515 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 72.64 23.44 3.01 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.474 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.9 mtmm -115.33 -33.69 5.22 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.945 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -126.27 20.07 7.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.131 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.14 -33.98 61.6 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.62 67.52 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.333 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.404 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 6.8 m-85 -83.5 -32.66 25.82 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.381 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.45 24.06 12.25 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -56.79 13.08 Favored Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.788 -0.187 . . . . 0.0 110.87 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -78.17 -4.17 14.08 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.536 2.158 . . . . 0.0 113.167 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -113.76 45.12 1.5 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.734 0.302 . . . . 0.0 110.998 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.79 -56.84 1.19 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.947 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 3.0 pttp -77.37 130.85 73.29 Favored Pre-proline 0 C--O 1.232 0.175 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.905 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 36.7 Cg_exo -60.52 -177.56 0.17 Allowed 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.858 2.372 . . . . 0.0 112.637 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.4 m -123.93 77.09 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.062 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.21 106.29 0.26 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.728 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.4 p -59.28 -40.11 80.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.672 -179.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -72.36 -46.8 53.8 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.25 -47.66 55.8 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.4 mt -81.59 -21.33 38.45 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.74 63.82 2.76 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.373 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.18 70.07 0.72 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.76 0.314 . . . . 0.0 111.132 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 16.9 m170 -65.62 -12.83 56.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.417 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.87 -19.96 21.16 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.534 0.207 . . . . 0.0 111.186 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -38.34 87.0 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.102 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -31.59 72.83 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.001 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -78.43 -47.2 18.02 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.753 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.2 mt -69.88 -38.76 76.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.321 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 32.2 mm -124.85 128.28 73.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.496 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -34.96 19.78 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.289 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -128.14 77.28 77.0 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-O 120.796 0.331 . . . . 0.0 111.004 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.83 128.45 15.06 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.779 2.319 . . . . 0.0 112.562 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 44.5 mtp -145.66 139.5 26.63 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.251 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -123.71 171.05 9.89 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.189 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 mtm -57.77 -43.11 85.27 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.198 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.0 -39.65 92.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.788 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.2 m -64.36 -44.46 91.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.646 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 15.2 mt -65.32 -44.31 94.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.433 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.87 73.58 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.2 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.5 p -57.48 -41.4 80.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.124 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -60.59 -49.63 76.75 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.02 -34.57 76.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.361 178.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.26 -37.18 86.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.997 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.55 15.29 9.65 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 62.45 28.44 16.8 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -76.99 -36.95 56.05 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.647 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -79.42 100.62 7.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.893 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 ttt-85 -64.91 -31.62 72.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -159.54 -177.44 6.4 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.931 0.396 . . . . 0.0 111.357 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.29 -12.67 61.57 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.788 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -47.37 83.64 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.671 0.272 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -73.5 -37.64 65.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.717 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -61.35 -53.04 61.8 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.031 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.94 -33.29 78.15 Favored Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.663 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.61 91.26 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.623 0.249 . . . . 0.0 111.108 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.34 -33.9 70.03 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.364 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.38 -48.47 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.623 0.249 . . . . 0.0 110.906 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.3 mtt180 -61.12 -36.81 80.71 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.847 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.67 -44.68 96.49 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.764 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.2 ttm -63.68 -46.75 84.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -58.38 -43.9 88.69 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.153 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.2 t -60.55 -43.25 97.42 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.041 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -73.47 -46.72 46.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -34.0 72.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.238 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -57.12 -35.87 69.99 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.014 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -66.5 -41.97 88.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.846 179.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -76.06 -31.26 58.7 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.297 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -91.9 102.59 6.38 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.257 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.12 133.4 26.64 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.617 2.211 . . . . 0.0 112.24 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -57.52 165.38 6.05 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.725 2.283 . . . . 0.0 112.674 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.36 31.22 8.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.02 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -127.5 142.6 51.35 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.943 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -56.73 -37.55 71.14 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.101 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.2 p -61.8 -40.22 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.389 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.0 t -67.49 -39.95 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.82 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.28 -34.34 66.35 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.81 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -47.43 83.66 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.406 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.83 -44.73 96.26 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -42.83 87.88 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.509 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.404 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 2.8 tttp -66.36 -41.91 88.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.585 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.54 -36.46 84.3 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -46.95 64.18 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.883 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -46.68 89.31 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.9 p -62.61 -43.0 98.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.51 0.195 . . . . 0.0 110.775 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -49.22 70.86 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.401 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -41.29 94.12 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.957 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.0 mtm -61.23 -47.76 84.61 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -43.82 81.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.631 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.27 -50.98 71.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.805 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.01 -37.99 89.4 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.1 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.9 mtpt -69.48 -41.35 76.27 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.738 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.93 75.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.211 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.51 -41.69 60.23 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.725 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.108 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.789 0.328 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -60.9 -36.86 80.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.848 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.91 -43.72 91.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.93 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -67.7 -40.66 84.3 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -38.16 88.55 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.085 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.9 m -60.21 -38.93 84.84 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.935 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -60.87 -37.0 80.65 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.019 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.3 -36.92 90.92 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.54 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.4 mt -64.13 -45.91 95.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.67 -35.35 79.39 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.839 179.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -57.62 -32.55 67.34 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.496 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.45 ' CG ' ' HD2' ' A' ' 17' ' ' LYS . 5.6 tt0 -60.32 -36.66 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.386 0.136 . . . . 0.0 110.954 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.8 mtt -59.27 -37.0 76.54 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.93 4.79 37.94 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.01 12.92 16.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 77.96 24.09 0.72 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.858 0.463 . . . . 0.0 111.43 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.45 ' HD2' ' CG ' ' A' ' 12' ' ' GLU . 54.0 mttp -113.79 -32.7 6.04 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.827 179.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.406 ' NE2' HG13 ' A' ' 98' ' ' VAL . 0.4 OUTLIER -137.76 25.81 2.8 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.878 179.226 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.68 -40.26 23.08 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.204 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.21 81.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.237 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -77.71 -33.38 53.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.394 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -112.06 25.99 11.03 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.438 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -69.37 -56.6 8.15 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 116.929 -0.123 . . . . 0.0 110.938 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.438 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 86.4 Cg_endo -81.82 -22.96 4.98 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.473 2.115 . . . . 0.0 112.987 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.12 35.52 1.73 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.639 0.257 . . . . 0.0 111.567 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.53 -38.42 6.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.829 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.5 mmtt -74.86 156.14 86.5 Favored Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.359 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.8 -172.32 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.921 2.414 . . . . 0.0 112.682 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.57 68.82 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 121.12 0.486 . . . . 0.0 111.612 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.85 108.4 1.18 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.977 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -60.84 -40.75 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.534 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.19 -44.97 62.18 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.51 -48.87 46.09 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.4 mt -81.09 -21.67 39.78 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.52 61.78 3.73 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.447 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.45 78.65 1.79 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.935 0.398 . . . . 0.0 111.244 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -7.66 46.1 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.867 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.22 -19.92 57.93 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.439 0.161 . . . . 0.0 111.284 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -44.72 94.08 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.853 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 22.4 t -61.21 -39.46 90.32 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.933 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.94 -35.29 80.18 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.729 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.4 mt -80.71 -49.65 18.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.168 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 26.5 mt -147.75 132.89 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.1 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.7 pttt -86.18 -20.08 29.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.753 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -107.46 86.03 2.54 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.044 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.2 143.35 39.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.769 2.313 . . . . 0.0 112.691 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -151.69 122.9 7.71 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.114 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -130.99 162.75 29.08 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.146 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.5 mtm -55.78 -40.85 73.24 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.37 -41.76 98.82 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -64.08 -40.94 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.986 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.41 HG22 ' OH ' ' A' ' 61' ' ' TYR . 12.4 mt -70.58 -45.15 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -38.39 87.41 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.026 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.6 t -57.32 -41.34 79.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.844 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -60.49 -48.36 82.09 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 16.3 tp -64.26 -34.46 78.16 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.48 -39.56 94.79 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.311 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.22 15.21 9.28 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.5 27.14 16.78 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -75.5 -34.09 60.81 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.724 0.297 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.475 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 5.2 m-85 -71.06 104.65 3.08 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.581 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -28.69 66.63 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.34 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -159.71 167.94 27.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.769 0.319 . . . . 0.0 111.286 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.4 63.36 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.515 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -62.78 -42.68 99.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.657 0.265 . . . . 0.0 110.558 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -70.85 -33.18 70.39 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.817 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.475 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 15.3 t80 -62.48 -48.34 80.03 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.89 -32.91 81.37 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.622 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.66 -44.2 96.71 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.613 0.244 . . . . 0.0 111.152 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.76 -33.46 75.72 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.2 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.27 -46.64 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.723 0.297 . . . . 0.0 110.575 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -63.35 -39.51 94.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.714 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.1 tt -70.67 -43.33 69.33 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.794 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 9.0 tmm? -60.42 -44.69 95.5 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.012 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -59.15 -40.66 86.24 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.984 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.4 m -62.33 -44.6 96.12 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -71.43 -40.34 70.49 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.903 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -38.0 84.97 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.035 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.84 -40.11 95.82 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.054 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.5 ttpt -75.14 -36.11 61.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.865 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -69.07 -35.3 76.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -82.01 136.84 46.86 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-O 120.63 0.253 . . . . 0.0 110.909 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.22 131.21 12.71 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.711 2.274 . . . . 0.0 112.368 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -57.27 147.43 76.79 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.604 2.202 . . . . 0.0 112.545 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 63.22 46.43 4.56 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.375 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -128.02 148.28 50.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.713 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -44.01 80.54 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.469 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.7 p -58.85 -35.19 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.49 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.7 t -61.0 -43.67 96.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.902 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.35 76.0 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.916 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.23 88.83 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.773 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.8 -42.0 97.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.131 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 -59.6 -43.96 93.56 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.687 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -61.51 -42.07 98.25 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.882 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 87.3 mt -63.6 -30.92 71.97 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.082 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -42.39 73.03 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.938 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -60.71 -46.83 88.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.065 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.406 HG13 ' NE2' ' A' ' 18' ' ' HIS . 10.1 p -66.79 -43.0 90.09 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.002 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -50.98 66.81 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.881 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -41.96 79.11 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.81 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -48.16 76.85 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.029 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -44.13 81.88 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.259 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.44 -49.34 69.55 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.802 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.36 -42.48 91.67 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -66.5 -42.22 87.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.919 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.87 -44.44 77.08 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.064 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.57 -40.1 61.85 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.647 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.008 -179.725 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 120.74 0.305 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -65.87 -39.48 90.74 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.754 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.28 -46.83 87.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.199 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.3 -38.01 89.5 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.838 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.27 -46.37 89.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.994 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -60.92 -39.42 89.33 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.4 m -56.03 -38.53 70.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.09 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.43 -43.25 97.6 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.624 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.8 mt -65.81 -44.87 92.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 120.748 0.308 . . . . 0.0 110.384 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.584 HD23 ' HZ ' ' A' ' 99' ' ' PHE . 50.3 mt -63.85 -35.91 82.18 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.63 179.279 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.79 -28.34 65.88 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 1.7 tt0 -58.34 -36.6 73.67 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.519 0.2 . . . . 0.0 110.935 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.455 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.4 tpp -57.96 -37.16 73.66 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.567 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.76 16.53 23.52 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.415 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.455 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -102.46 12.13 36.95 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.563 0.221 . . . . 0.0 111.533 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 tptt 71.42 25.93 3.36 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.377 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.409 ' CD ' ' HG2' ' A' ' 12' ' ' GLU . 12.7 mttm -113.34 -33.43 5.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.304 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.447 ' CD2' ' HB2' ' A' ' 21' ' ' TYR . 2.4 t60 -143.55 29.61 1.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -78.38 -38.1 42.58 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.123 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.49 92.84 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.998 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 18' ' ' HIS . 10.6 m-85 -72.61 -33.55 66.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.146 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.53 17.22 23.35 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.734 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -54.25 3.48 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.64 -5.52 16.12 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.3 2.0 . . . . 0.0 113.107 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.12 40.92 3.63 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.81 0.338 . . . . 0.0 111.047 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.42 -47.85 4.54 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.014 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -80.19 155.84 74.41 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.064 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.51 -173.7 0.73 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.716 2.278 . . . . 0.0 112.647 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.549 ' O ' HG23 ' A' ' 29' ' ' VAL . 31.2 m -111.39 84.64 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 121.131 0.491 . . . . 0.0 111.37 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -63.34 105.05 0.68 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.081 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG23 ' C ' ' A' ' 36' ' ' LEU . 12.3 p -61.9 -37.22 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.733 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -72.13 -45.75 59.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.574 0.226 . . . . 0.0 111.416 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.04 -47.84 48.8 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -80.84 -21.57 40.66 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.62 60.28 5.12 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.424 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.3 OUTLIER -127.66 66.85 1.32 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 111.325 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -63.59 -18.09 63.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.489 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -76.21 -19.08 58.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.588 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -57.63 -41.41 81.29 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.466 0.174 . . . . 0.0 111.058 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -63.55 -34.71 78.41 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.635 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -42.93 71.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.834 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 22.0 mt -73.77 -45.42 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.28 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.3 mm -121.2 119.84 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 120.674 0.274 . . . . 0.0 111.341 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -70.89 -34.3 71.43 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.49 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -129.77 77.91 76.09 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-O 120.75 0.309 . . . . 0.0 111.066 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.49 129.14 16.34 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.753 2.302 . . . . 0.0 112.5 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 73.9 mtp -132.54 155.6 48.34 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.499 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -140.1 167.32 22.41 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.303 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.0 tpp -56.38 -41.89 76.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -39.24 92.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.665 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.0 -45.08 87.05 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.811 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 27.3 mt -69.62 -45.02 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.153 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -64.64 -34.48 78.38 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.982 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.5 t -57.54 -40.25 78.42 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.082 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -61.38 -48.95 78.89 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -62.85 -36.01 81.86 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.474 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.15 -39.85 87.78 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.228 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.01 15.2 8.98 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.74 27.54 17.3 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -76.58 -35.47 58.15 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.595 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -73.68 105.07 4.83 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.75 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -79.56 -28.34 41.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.327 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -149.59 163.61 37.39 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 111.598 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.44 -18.08 63.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.778 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -62.79 -43.03 99.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.624 0.25 . . . . 0.0 110.533 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -69.95 -37.09 75.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.83 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.609 ' O ' HG23 ' A' ' 71' ' ' VAL . 26.4 t80 -65.69 -53.04 46.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.11 -37.59 80.83 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.617 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.54 -42.81 93.18 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.671 0.272 . . . . 0.0 111.006 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.3 -38.99 71.75 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.222 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 67' ' ' PHE . 41.2 t -62.54 -48.6 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.016 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -64.09 -37.87 89.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.646 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.41 -48.49 72.64 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.638 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -64.44 -42.83 95.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.083 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -57.14 -42.8 81.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.032 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t -63.38 -43.66 96.98 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.738 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -69.96 -41.53 74.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.949 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.38 -39.71 84.22 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.216 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.55 -34.43 72.65 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.141 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -65.69 -46.88 77.36 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -74.85 -40.9 60.74 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.142 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.526 ' HB3' HG22 ' A' ' 89' ' ' VAL . 24.7 m-20 -61.08 110.78 3.3 Favored Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.107 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.434 ' O ' HG21 ' A' ' 89' ' ' VAL . 57.7 Cg_endo -70.9 123.82 10.07 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.64 2.226 . . . . 0.0 112.223 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.64 161.37 1.32 Allowed 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.952 2.435 . . . . 0.0 113.005 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 61.06 42.21 12.82 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.74 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.715 ' HB3' HG23 ' A' ' 89' ' ' VAL . 4.7 t-160 -134.09 147.88 50.94 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.271 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -58.35 -41.78 85.46 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.131 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -60.55 -36.66 71.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.634 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.715 HG23 ' HB3' ' A' ' 86' ' ' HIS . 17.5 t -65.3 -47.47 87.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.68 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.61 91.53 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.967 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.8 mtp -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.01 -50.43 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.9 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -40.44 89.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.748 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -41.81 97.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.791 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.76 -34.65 77.67 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.008 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.98 -43.37 71.61 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -61.53 -46.8 88.4 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.281 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -64.87 -42.87 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.861 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.584 ' HZ ' HD23 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -64.19 -50.59 67.49 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.849 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.26 -45.52 83.93 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.058 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -47.88 84.33 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.042 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -67.49 -44.14 79.23 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.133 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.404 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 1.2 t80 -63.2 -42.74 99.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.836 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.57 74.34 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.066 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -71.65 -44.57 64.08 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.139 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 9.8 ptm -69.38 -35.78 76.16 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.76 -41.34 19.3 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.574 0.226 . . . . 0.0 111.35 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.979 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.643 0.259 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -64.92 -37.04 86.32 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.139 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.02 -40.65 98.38 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.925 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -35.23 66.41 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.821 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.54 -49.81 56.72 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.345 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.429 ' HA ' HD12 ' A' ' 9' ' ' ILE . 27.2 p -61.64 -37.1 82.76 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.781 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -56.57 -37.34 70.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.945 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.8 89.1 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.116 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 6' ' ' CYS . 5.7 mt -64.14 -39.04 84.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 CA-C-O 120.917 0.389 . . . . 0.0 110.077 179.01 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -35.81 80.43 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.248 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -29.96 65.91 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.401 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.403 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -58.51 -36.69 74.2 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.47 0.176 . . . . 0.0 111.075 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -36.87 71.68 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.76 11.63 19.43 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -101.16 21.86 13.28 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.684 0.278 . . . . 0.0 111.525 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.8 mttm 65.77 21.63 11.52 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.453 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -111.36 -30.11 7.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.948 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.407 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -145.33 30.16 1.14 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.683 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.03 -41.27 17.41 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.36 85.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.933 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -73.79 -31.6 63.35 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.202 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.488 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -109.83 24.64 12.77 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.545 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 28.2 t-105 -69.5 -51.49 16.44 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.964 -0.107 . . . . 0.0 111.211 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -80.21 -19.3 9.36 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.423 2.082 . . . . 0.0 113.095 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -105.55 37.41 2.23 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.833 0.349 . . . . 0.0 111.131 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -107.57 -46.25 3.87 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.901 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -81.67 152.43 69.52 Favored Pre-proline 0 CA--C 1.531 0.235 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.101 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -63.43 179.3 0.94 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.926 2.418 . . . . 0.0 112.917 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.5 m -94.64 66.19 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.974 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.15 100.08 0.05 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.967 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.2 p -62.7 -35.12 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.708 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -71.71 -47.49 53.63 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.588 0.232 . . . . 0.0 111.22 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.46 -47.01 52.25 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -81.19 -21.44 39.64 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.23 60.54 6.26 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.474 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.06 71.43 1.26 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.908 0.385 . . . . 0.0 111.422 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -65.39 -22.26 66.77 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.17 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.09 -19.92 58.14 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.447 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -57.62 -42.63 83.68 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.675 0.274 . . . . 0.0 110.912 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.1 t -60.2 -37.14 79.35 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.14 -39.61 78.74 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.99 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.8 mt -72.57 -51.7 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.174 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.434 HD13 ' HB2' ' A' ' 77' ' ' ASN . 13.8 mt -129.05 118.18 45.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.058 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.0 pttt -77.68 -30.38 51.93 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -112.45 77.43 2.29 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-O 120.807 0.337 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.27 153.57 61.72 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.755 2.303 . . . . 0.0 112.656 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.27 142.95 16.21 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -139.43 167.25 22.5 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 tpp -57.55 -42.19 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.928 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.2 t -64.24 -38.25 90.39 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.544 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -65.66 -43.99 87.69 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.73 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.577 HG23 ' OH ' ' A' ' 61' ' ' TYR . 22.9 mt -70.17 -45.15 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.076 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -34.8 78.29 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.928 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.6 t -57.47 -40.86 79.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.934 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -60.39 -46.91 88.31 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.795 0.331 . . . . 0.0 110.251 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.04 -34.39 77.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.548 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.69 -38.18 90.15 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.311 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.69 15.19 10.03 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.089 0.404 . . . . 0.0 112.089 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 58.07 27.26 14.65 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.595 0.236 . . . . 0.0 111.543 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -32.58 60.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.648 0.261 . . . . 0.0 110.556 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.577 ' OH ' HG23 ' A' ' 52' ' ' ILE . 8.4 m-85 -71.41 104.85 3.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.967 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -65.68 -30.77 71.51 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.062 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.87 172.36 18.79 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.738 0.304 . . . . 0.0 111.24 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.11 -16.7 63.15 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.615 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.87 -43.52 98.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.653 0.263 . . . . 0.0 110.417 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -69.69 -40.65 76.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.967 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.492 ' O ' HG23 ' A' ' 71' ' ' VAL . 68.2 t80 -59.36 -53.45 58.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.778 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -58.75 -31.51 67.81 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.737 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.69 91.1 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.636 0.218 . . . . 0.0 111.387 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.11 -31.76 72.81 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.192 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 67' ' ' PHE . 43.7 t -60.72 -48.32 89.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.684 0.278 . . . . 0.0 110.577 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.0 mtt-85 -64.33 -38.27 90.46 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.701 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.46 -46.35 76.67 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.668 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.453 ' HB2' HD11 ' A' ' 52' ' ' ILE . 5.7 tmm? -59.19 -46.35 88.65 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.85 -35.26 80.54 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.918 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -60.16 -47.32 86.42 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.15 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.434 ' HB2' HD13 ' A' ' 43' ' ' ILE . 16.3 p30 -75.36 -30.5 60.23 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.896 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.73 -41.44 95.31 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.75 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.26 -33.87 75.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.946 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -66.56 -47.13 73.77 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.918 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.75 -38.83 76.94 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.571 ' HB3' HG22 ' A' ' 89' ' ' VAL . 51.4 m-20 -72.2 127.29 90.55 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.768 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.506 ' O ' HG21 ' A' ' 89' ' ' VAL . 37.8 Cg_endo -65.95 161.01 41.46 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.678 2.252 . . . . 0.0 112.417 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.79 127.58 13.96 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.54 2.16 . . . . 0.0 112.559 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.1 t70 60.13 67.91 0.82 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.917 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.475 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.7 t-80 -133.89 165.11 25.77 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.314 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.66 -44.15 96.99 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.309 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -62.42 -31.35 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.571 HG22 ' HB3' ' A' ' 82' ' ' ASN . 39.1 t -64.89 -42.32 94.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.883 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.69 -35.2 75.69 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.005 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -45.97 90.52 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.951 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.44 -46.32 89.08 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.935 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -44.99 95.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.744 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.11 -37.42 87.38 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -68.35 -38.46 81.5 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.983 179.745 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.22 -42.47 75.67 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.088 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.6 -46.81 88.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.2 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.97 -42.99 89.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.235 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -64.83 -51.46 62.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.931 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.67 -43.6 93.91 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.91 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mtt -60.24 -47.11 87.35 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.975 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.16 77.65 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.99 -44.46 95.98 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.999 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.81 -32.5 73.83 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.089 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -44.18 66.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.081 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.3 ptm -69.3 -34.24 74.4 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.259 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.8 mt -84.08 -42.29 16.26 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.992 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.809 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 120.729 0.3 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -64.73 -42.72 95.0 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mt -59.96 -41.7 92.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.918 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -35.68 81.4 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.046 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.8 t -62.42 -37.62 86.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.131 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.39 -39.09 78.73 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.842 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -60.06 -38.72 83.67 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.091 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.65 -43.18 97.95 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.501 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.6 mt -64.4 -46.88 91.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-O 120.656 0.265 . . . . 0.0 110.536 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.7 -35.87 81.09 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.876 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.7 mtpp -58.49 -29.78 66.5 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.231 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.479 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -58.58 -36.43 73.96 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.348 0.118 . . . . 0.0 110.87 179.312 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.85 -37.34 73.72 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.468 179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.97 8.68 30.62 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 179.395 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.479 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -94.28 15.02 18.49 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.68 29.05 2.64 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.174 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.4 mttm -123.74 -31.24 3.47 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.745 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -140.69 28.63 1.96 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 111.244 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.74 -37.94 64.9 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.777 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.87 -36.39 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -73.65 -34.51 64.98 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.576 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -100.81 14.42 31.77 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -52.88 4.01 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -64.06 -12.06 30.46 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 122.612 2.208 . . . . 0.0 113.567 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -141.7 52.46 1.52 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 111.203 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -99.02 -45.41 5.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.77 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.69 160.86 25.29 Favored Pre-proline 0 N--CA 1.464 0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.218 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.79 177.06 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.28 2.653 . . . . 0.0 113.158 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.0 m -93.5 83.85 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.139 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.539 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 17.7 m-20 -61.16 93.13 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.524 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.509 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.8 p -61.1 -39.26 81.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.818 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -72.3 -46.62 54.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.6 0.238 . . . . 0.0 111.578 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.539 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.96 -48.79 42.54 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 mt -80.86 -21.33 40.81 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.14 58.13 6.37 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.431 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.509 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -128.7 60.09 1.53 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.964 0.411 . . . . 0.0 111.442 -179.758 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -61.84 -20.99 64.27 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.525 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.24 -20.26 57.58 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.344 0.116 . . . . 0.0 111.27 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.452 ' CE2' HG13 ' A' ' 43' ' ' ILE . 10.3 t80 -56.71 -42.42 79.13 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.253 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 44.5 t -66.18 -32.33 73.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.943 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.24 -34.35 61.41 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.06 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.1 mt -82.99 -41.84 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.478 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.452 HG13 ' CE2' ' A' ' 39' ' ' TYR . 36.2 mm -96.41 127.58 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.747 0.308 . . . . 0.0 111.523 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.8 -36.88 25.21 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.259 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.56 88.47 53.36 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.07 116.08 4.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.736 2.29 . . . . 0.0 112.386 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.9 mtp -140.54 149.6 42.64 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.294 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -147.73 171.52 15.53 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.227 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.514 ' HA ' HD12 ' A' ' 52' ' ' ILE . 6.4 mtt -56.04 -42.32 76.36 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.054 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t -61.93 -40.01 94.02 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.643 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.7 m -66.31 -42.53 88.15 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.951 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.514 HD12 ' HA ' ' A' ' 49' ' ' MET . 11.6 mt -65.21 -45.08 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.703 0.287 . . . . 0.0 110.78 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -36.69 84.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.04 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.8 p -57.35 -38.49 74.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.208 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -62.92 -48.67 77.93 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.5 tp -62.6 -34.48 77.11 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.529 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.61 -38.91 92.93 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.298 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.45 15.2 8.21 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 59.79 27.49 16.8 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.661 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.45 -34.36 58.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.725 0.297 . . . . 0.0 110.467 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.451 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 8.3 m-85 -79.2 92.72 5.12 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.587 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.5 mtm-85 -60.37 -34.96 74.61 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -145.28 165.64 27.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.931 0.396 . . . . 0.0 111.375 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.05 -22.28 65.87 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.836 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -41.32 99.41 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.599 0.238 . . . . 0.0 110.515 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.49 -35.34 78.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.935 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.473 ' O ' HG23 ' A' ' 71' ' ' VAL . 24.5 t80 -59.91 -47.51 85.49 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.429 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.46 -32.29 82.55 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.796 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.05 -36.87 78.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.6 0.238 . . . . 0.0 111.414 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.59 -33.21 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.177 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.7 t -64.82 -48.71 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.919 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.07 -36.07 82.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.658 179.521 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.29 -47.33 77.02 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.3 ttp -60.38 -46.87 88.41 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.343 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -63.81 -35.2 79.84 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.707 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 m -59.7 -47.24 86.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.23 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -75.39 -36.75 60.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.682 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -59.3 -40.87 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.814 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -57.66 -35.64 70.83 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.358 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -66.41 -39.57 89.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.941 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.421 ' HB2' HD11 ' A' ' 43' ' ' ILE . 3.0 t80 -81.07 -38.75 26.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.248 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.733 ' HB3' HG22 ' A' ' 89' ' ' VAL . 27.0 m-20 -57.51 110.6 2.6 Favored Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.113 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.449 ' O ' HG21 ' A' ' 89' ' ' VAL . 46.2 Cg_endo -68.59 143.66 57.65 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.666 2.244 . . . . 0.0 112.432 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 51.4 Cg_exo -54.09 132.55 50.78 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 122.69 2.26 . . . . 0.0 112.438 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.27 68.03 0.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.013 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.804 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.8 t-160 -134.82 154.66 51.53 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.111 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -44.75 81.63 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.248 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 m -65.46 -31.49 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.493 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.804 HG23 ' HB3' ' A' ' 86' ' ' HIS . 31.2 t -67.42 -47.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.74 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.43 91.05 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.857 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 7.7 mtt -64.99 -36.77 85.46 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.25 -48.22 79.4 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.44 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -48.0 83.61 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.744 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.07 -38.94 90.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.842 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -37.13 85.62 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.172 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -69.54 -46.79 65.67 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.847 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.78 -47.01 88.25 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.271 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.22 -43.3 97.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.316 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.25 -51.03 63.46 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.425 0.155 . . . . 0.0 110.948 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -43.89 88.05 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.793 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.9 mtp -61.99 -46.92 87.11 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.054 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.65 -44.41 77.96 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.134 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.403 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.5 OUTLIER -64.25 -41.85 96.78 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.877 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -36.15 83.07 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.038 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -67.91 -44.84 76.01 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.173 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.403 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 13.7 ptm -69.4 -35.36 75.7 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.401 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.62 -42.37 20.13 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.225 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.008 179.911 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.65 0.262 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -63.26 -44.98 93.6 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.783 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.86 -44.51 94.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.945 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -63.83 -38.09 89.8 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.88 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -46.04 80.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.004 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.476 ' HA ' HD12 ' A' ' 9' ' ' ILE . 22.6 m -60.44 -39.0 85.93 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.972 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.8 m -58.59 -34.51 71.18 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.079 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -47.29 91.57 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.427 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.481 HD11 ' SD ' ' A' ' 106' ' ' MET . 3.6 mt -64.06 -44.58 97.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.788 0.327 . . . . 0.0 110.259 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.776 HD11 ' HG3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -62.16 -35.79 79.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.73 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.4 -27.66 64.48 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -58.44 -36.39 73.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.922 -0.126 . . . . 0.0 111.089 179.61 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -56.94 -40.41 76.35 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.9 11.94 33.05 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.8 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.54 11.42 28.75 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.02 26.34 3.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.202 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 79.4 mttt -116.1 -33.51 5.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.994 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.418 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.6 OUTLIER -130.65 23.15 5.05 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.187 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.31 -30.29 60.31 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.227 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.72 -39.51 91.26 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.737 0.304 . . . . 0.0 111.02 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.448 ' CZ ' ' HD3' ' A' ' 94' ' ' LYS . 8.7 m-85 -81.61 -33.55 31.43 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -97.02 15.58 22.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.44 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.76 -54.79 26.7 Favored Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.9 Cg_endo -76.84 -20.5 13.28 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.337 2.024 . . . . 0.0 112.984 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -98.28 22.45 9.59 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.391 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.53 -43.48 39.06 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.435 ' HB3' ' HD2' ' A' ' 28' ' ' PRO . 26.3 mmtt -102.42 158.28 32.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.126 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 27' ' ' LYS . 74.0 Cg_endo -75.01 -176.34 2.83 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.805 2.337 . . . . 0.0 112.754 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.7 m -93.87 80.27 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.133 0.492 . . . . 0.0 111.241 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.517 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -60.31 103.86 0.27 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.142 -179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.423 ' HA ' HD12 ' A' ' 36' ' ' LEU . 14.5 p -61.52 -37.32 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.13 -46.42 56.63 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.488 0.185 . . . . 0.0 111.442 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.517 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.69 -46.91 57.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.504 HD13 HD21 ' A' ' 36' ' ' LEU . 15.5 mt -80.85 -21.45 40.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.62 47.88 73.08 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.425 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.504 HD21 HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -120.83 69.41 0.88 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.044 0.45 . . . . 0.0 111.222 -179.916 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -65.23 -18.21 65.12 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.445 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -76.3 -19.95 57.77 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.872 -0.149 . . . . 0.0 111.314 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -40.31 82.49 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.615 0.245 . . . . 0.0 110.843 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.6 t -65.58 -40.13 92.39 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.788 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -65.09 -36.14 83.36 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.861 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.4 mt -77.59 -47.83 25.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 77' ' ' ASN . 29.9 mm -99.86 103.47 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.306 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -59.66 -33.31 71.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.398 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.76 89.41 52.45 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.603 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.46 124.32 11.89 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.749 2.299 . . . . 0.0 112.72 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.9 tpt -153.47 131.26 11.61 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -129.62 167.94 17.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.948 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.3 -42.65 77.91 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.091 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.8 t -62.06 -39.94 94.11 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.838 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.5 m -64.12 -44.43 92.24 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.864 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.451 HG23 ' OH ' ' A' ' 61' ' ' TYR . 53.7 mt -69.86 -44.92 78.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.136 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.688 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.776 ' HG3' HD11 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -62.52 -35.23 78.76 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.076 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 t -57.56 -40.42 78.87 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.974 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.3 -49.41 77.7 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.469 HD22 HD13 ' A' ' 10' ' ' LEU . 6.5 tp -67.04 -33.26 75.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.503 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.14 -41.36 99.27 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.388 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.36 15.16 12.7 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.35 27.21 16.77 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -76.29 -33.67 59.09 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.706 0.289 . . . . 0.0 110.516 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.451 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.0 m-85 -70.48 110.28 5.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.76 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -81.27 -25.88 36.21 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.192 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -147.12 157.83 43.74 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.815 0.34 . . . . 0.0 111.599 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -23.17 64.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.276 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -62.6 -39.05 92.52 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.521 0.201 . . . . 0.0 110.485 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.47 -35.32 75.5 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.72 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 71' ' ' VAL . 5.1 t80 -67.53 -53.63 26.89 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.844 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.79 -36.94 81.96 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.156 -0.545 . . . . 0.0 112.806 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -58.94 -37.83 77.62 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.507 0.194 . . . . 0.0 111.219 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -76.72 -33.48 58.16 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.47 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 67' ' ' PHE . 26.7 t -64.9 -48.31 84.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.645 0.259 . . . . 0.0 110.715 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -64.62 -34.54 78.52 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.786 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.3 -44.56 71.51 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.508 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.3 -46.25 89.07 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.782 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -63.58 -35.93 82.13 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.2 p -61.25 -45.82 92.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.049 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.477 ' HB2' HD12 ' A' ' 43' ' ' ILE . 1.6 p-10 -75.92 -38.05 58.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.874 179.299 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 t -61.24 -41.23 96.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.374 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.55 -29.14 69.82 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -72.73 -36.47 67.76 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.696 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -78.84 -40.78 31.75 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.226 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.461 ' HB3' HG22 ' A' ' 89' ' ' VAL . 90.0 m-20 -70.23 112.15 11.71 Favored Pre-proline 0 N--CA 1.466 0.33 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.131 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.515 ' O ' HG21 ' A' ' 89' ' ' VAL . 22.0 Cg_exo -65.4 156.9 60.88 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.765 2.31 . . . . 0.0 112.219 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.15 149.48 70.85 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.42 2.08 . . . . 0.0 112.373 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 t0 60.93 43.31 11.81 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.317 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.781 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.5 t-80 -116.63 146.92 42.37 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.001 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -56.38 -43.52 79.32 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.257 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.6 m -62.13 -33.44 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.781 HG23 ' HB3' ' A' ' 86' ' ' HIS . 29.9 t -61.65 -42.44 94.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.764 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.38 81.37 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.78 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' MET . . . . . 0.441 ' HA ' ' CE2' ' A' ' 21' ' ' TYR . 0.7 OUTLIER -69.53 -37.26 77.04 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.48 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.45 -50.74 57.91 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.394 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -62.63 -38.78 91.59 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.54 0.209 . . . . 0.0 110.689 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.448 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 2.9 tttp -64.42 -41.74 96.43 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.756 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -68.42 -37.94 80.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.952 179.456 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.29 -41.47 80.93 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.974 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -60.75 -46.75 89.26 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.27 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 p -67.02 -42.83 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -50.54 68.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.959 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -46.98 86.0 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.601 0.239 . . . . 0.0 110.887 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -45.75 91.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.02 -43.94 77.63 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.957 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.28 -52.46 65.56 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.982 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.27 -40.02 84.76 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.309 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.38 -42.29 75.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.679 0.276 . . . . 0.0 110.787 179.562 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.481 ' SD ' HD11 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.11 -44.67 71.95 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.966 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -42.13 66.12 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.535 -0.745 . . . . 0.0 110.703 179.69 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.747 0.308 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.95 -42.8 94.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.213 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.5 mt -62.81 -42.45 99.72 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.719 0.295 . . . . 0.0 110.853 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -69.26 -36.67 77.36 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.965 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -50.23 64.41 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.534 ' HA ' HD12 ' A' ' 9' ' ' ILE . 24.0 p -64.25 -39.37 93.81 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.167 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.17 -40.51 85.84 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.927 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.47 -44.2 96.89 Favored Glycine 0 C--N 1.336 0.537 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.303 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.534 HD12 ' HA ' ' A' ' 6' ' ' CYS . 8.2 mt -64.32 -44.41 97.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-O 120.817 0.341 . . . . 0.0 110.235 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.659 HD21 ' CZ ' ' A' ' 67' ' ' PHE . 10.0 mp -62.44 -35.83 80.5 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.554 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -58.45 -29.28 66.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 43.1 tt0 -58.62 -36.54 74.22 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.562 0.22 . . . . 0.0 110.645 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.554 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 6.6 ttm -57.66 -37.12 72.84 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.528 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 7.07 31.51 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.705 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -94.09 15.36 17.27 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.592 0.234 . . . . 0.0 111.559 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? 69.05 25.61 5.83 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HB2' ' CG ' ' A' ' 12' ' ' GLU . 32.3 mttm -115.37 -29.58 6.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.228 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.404 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 1.4 t60 -144.45 33.4 1.18 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.798 0.332 . . . . 0.0 110.796 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -89.21 -38.96 13.87 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.184 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.92 -42.66 97.34 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -76.8 -29.28 55.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.326 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.9 16.46 25.88 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.487 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -71.21 -55.83 5.92 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-O 120.346 0.117 . . . . 0.0 110.987 179.993 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.487 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 12.3 Cg_exo -69.74 -25.1 29.02 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.565 2.177 . . . . 0.0 112.636 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -102.23 34.57 2.68 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.287 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.1 -45.99 4.19 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.89 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -88.97 156.94 49.11 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.325 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -62.38 -171.71 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.154 2.569 . . . . 0.0 112.842 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -116.5 87.35 1.03 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -57.92 102.49 0.1 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.267 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.408 HG23 HD12 ' A' ' 36' ' ' LEU . 12.8 p -63.75 -36.68 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.643 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.93 -47.31 53.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.614 0.245 . . . . 0.0 111.498 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.569 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -72.43 -47.16 51.25 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.15 -21.51 39.71 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.17 59.99 5.92 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.615 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.418 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -124.93 72.23 1.22 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.962 0.41 . . . . 0.0 111.342 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -69.88 -12.73 61.84 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.458 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -19.41 58.5 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.4 0.143 . . . . 0.0 111.25 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -34.8 69.59 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.534 0.207 . . . . 0.0 111.019 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -66.44 -39.97 89.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.72 0.295 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.23 -37.55 69.14 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.229 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.9 mt -79.15 -52.97 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.321 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.634 HD12 ' HB3' ' A' ' 77' ' ' ASN . 28.3 mm -106.99 126.96 62.98 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.245 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 43.0 pttt -79.43 -39.13 33.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.278 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -116.37 94.25 42.14 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.725 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.79 105.13 0.89 Allowed 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.665 2.244 . . . . 0.0 112.598 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 39.3 mtp -139.12 140.63 38.0 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.967 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.53 170.66 12.93 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.128 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -32.29 69.23 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.475 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -42.33 99.05 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.727 0.299 . . . . 0.0 110.936 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.6 m -64.4 -39.93 94.8 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.861 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.465 HG22 ' CE2' ' A' ' 67' ' ' PHE . 22.1 mt -70.49 -44.74 76.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.862 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -39.61 92.99 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.113 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.3 p -57.48 -39.07 75.61 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.177 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -49.81 75.73 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.9 tp -63.23 -34.1 76.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.458 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.97 -38.25 90.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.147 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.411 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . . . -90.18 15.26 10.63 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 63.84 26.92 14.45 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.411 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 28.0 mt-10 -79.54 -35.84 39.31 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.764 0.316 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 2.4 m-85 -76.21 101.3 5.35 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.685 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -62.19 -30.19 70.9 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.38 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.23 164.86 38.23 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.866 0.365 . . . . 0.0 111.427 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.2 -15.41 63.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.458 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.77 -44.29 96.56 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.662 0.268 . . . . 0.0 110.323 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -71.08 -35.38 71.84 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.821 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.659 ' CZ ' HD21 ' A' ' 10' ' ' LEU . 34.1 t80 -61.4 -48.1 82.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.412 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.53 -32.14 80.17 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.832 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.3 96.1 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.739 0.27 . . . . 0.0 111.055 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.59 -37.48 76.95 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.033 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 67' ' ' PHE . 42.2 t -59.86 -47.74 90.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.908 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -63.01 -35.64 80.89 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.706 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.6 tt -72.2 -43.03 65.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.734 0.302 . . . . 0.0 110.808 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ttp -66.87 -45.09 79.21 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.473 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.81 -41.43 97.88 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.8 p -61.93 -44.04 97.6 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.533 0.206 . . . . 0.0 110.792 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.634 ' HB3' HD12 ' A' ' 43' ' ' ILE . 47.2 m-80 -73.72 -39.58 64.19 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.383 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.93 -37.82 83.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -59.81 -35.35 74.51 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.982 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -63.23 -42.78 99.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.66 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -70.19 -35.02 73.66 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.189 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.828 ' HB3' HG22 ' A' ' 89' ' ' VAL . 34.0 m-20 -59.42 110.94 3.13 Favored Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.975 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.633 ' O ' HG21 ' A' ' 89' ' ' VAL . 32.1 Cg_exo -60.59 160.38 24.51 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.924 2.416 . . . . 0.0 112.689 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.41 120.72 7.66 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.53 2.153 . . . . 0.0 112.244 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.2 t70 62.52 71.43 0.53 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.658 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.721 ' HB3' HG23 ' A' ' 89' ' ' VAL . 5.8 t-160 -137.51 152.67 49.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.358 -179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -56.33 -44.31 79.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.291 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 19.0 m -60.3 -32.33 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.399 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.828 HG22 ' HB3' ' A' ' 82' ' ' ASN . 23.2 t -66.07 -43.22 92.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.784 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.06 -37.81 86.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.978 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -46.36 90.72 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.706 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.76 94.12 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.931 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -48.8 71.0 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.606 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.5 tttp -62.47 -41.51 98.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.087 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.404 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -67.83 -40.76 83.74 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.055 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.2 tm0? -70.04 -43.72 70.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.983 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -60.74 -46.76 89.21 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.314 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.95 -42.6 89.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.813 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.78 -49.77 71.65 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.84 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -46.18 88.72 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.562 0.22 . . . . 0.0 110.967 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 6.2 mtp -60.35 -45.98 91.53 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.983 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -67.98 -43.83 78.07 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.122 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.414 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.1 OUTLIER -59.88 -47.87 83.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.043 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.94 -34.08 77.18 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.114 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.92 -44.57 63.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.42 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.414 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 7.2 ptm -69.24 -33.47 73.32 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.04 -42.35 14.93 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 120.573 0.225 . . . . 0.0 110.846 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.13 -0.938 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 120.675 0.274 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -64.33 -39.36 93.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.92 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.97 -45.67 91.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.967 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -35.08 77.26 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.946 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 t -62.49 -35.84 80.62 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.231 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.7 m -58.05 -42.14 84.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.86 -34.98 78.49 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.017 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.93 -46.69 93.69 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.656 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mt -64.39 -47.37 89.77 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.772 0.32 . . . . 0.0 110.581 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mt -63.85 -35.75 81.64 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 ttpt -58.59 -30.3 67.1 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.616 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.488 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.5 -36.62 74.06 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.448 0.166 . . . . 0.0 110.983 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.471 ' HE3' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -57.92 -38.68 76.32 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.653 0.263 . . . . 0.0 110.452 179.18 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.07 3.84 39.1 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.716 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.488 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.04 16.41 12.84 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.582 0.229 . . . . 0.0 111.538 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.3 mttp 70.77 25.8 3.93 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.427 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 6.9 mttm -114.28 -32.78 5.86 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.03 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.462 ' NE2' HG11 ' A' ' 98' ' ' VAL . 4.9 m-70 -131.42 18.78 4.82 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.075 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.81 78.84 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-O 120.593 0.235 . . . . 0.0 110.938 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.41 -34.77 74.97 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.298 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -86.67 -31.0 21.3 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.699 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.9 17.2 24.56 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.42 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.08 -53.13 35.16 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.355 0.121 . . . . 0.0 110.72 179.588 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.42 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 75.2 Cg_endo -88.68 18.72 1.43 Allowed 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.732 2.288 . . . . 0.0 113.088 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -144.13 62.78 1.34 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.934 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -127.89 -55.06 1.3 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.857 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.41 157.24 75.37 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.025 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.98 -177.22 1.23 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.754 2.303 . . . . 0.0 112.732 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.62 HG11 ' CZ ' ' A' ' 39' ' ' TYR . 15.9 m -90.23 78.55 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.113 0.482 . . . . 0.0 111.418 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.579 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -60.17 97.69 0.05 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.867 179.809 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 36' ' ' LEU . 11.6 p -61.51 -39.66 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.766 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -72.25 -46.78 54.53 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.579 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -72.3 -48.2 44.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.5 -21.46 38.64 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.5 57.88 6.34 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.323 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 36' ' ' LEU . 0.5 OUTLIER -129.4 76.44 1.72 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.983 0.421 . . . . 0.0 111.406 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -75.88 -7.17 53.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.51 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.3 -19.87 57.86 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.369 0.128 . . . . 0.0 111.22 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.62 ' CZ ' HG11 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -57.8 -42.0 83.31 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.899 179.654 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.3 t -63.28 -35.69 81.19 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.908 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -73.24 -42.15 62.91 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.169 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 20.1 mt -80.79 -62.38 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.766 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 22.5 mm -97.23 125.54 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.822 0.344 . . . . 0.0 111.543 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -83.58 -34.95 25.05 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.442 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -136.81 72.88 54.77 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-O 120.808 0.337 . . . . 0.0 111.085 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.58 160.31 44.42 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.814 2.343 . . . . 0.0 112.423 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.7 mtp -150.18 163.22 38.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.319 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.43 172.24 14.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.032 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.43 ' HA ' HD12 ' A' ' 52' ' ' ILE . 16.9 ttm -54.48 -37.44 65.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.74 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.0 t -63.46 -44.25 95.02 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.82 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.2 m -64.32 -38.59 91.59 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.095 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.43 HD12 ' HA ' ' A' ' 49' ' ' MET . 15.9 mt -69.74 -44.89 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-O 120.749 0.309 . . . . 0.0 110.908 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.18 -36.32 81.52 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.277 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.2 p -57.62 -43.11 84.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.8 -49.07 77.79 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.41 ' HB2' ' HD2' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -66.18 -33.18 75.18 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.688 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -60.27 -41.44 93.31 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.468 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.03 15.17 12.08 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.04 27.35 16.26 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.62 0.248 . . . . 0.0 111.362 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -76.6 -33.67 58.42 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.667 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.41 ' HD2' ' HB2' ' A' ' 56' ' ' LEU . 2.6 m-85 -66.11 103.17 0.92 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.943 0.402 . . . . 0.0 110.622 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -32.04 63.58 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.025 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -166.92 -178.98 4.47 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.251 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.52 -15.62 61.78 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.254 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -62.84 -46.0 89.96 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.669 0.271 . . . . 0.0 110.342 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.23 -36.03 74.26 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.775 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.452 ' O ' HG23 ' A' ' 71' ' ' VAL . 19.0 t80 -59.93 -53.65 55.38 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.963 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.38 -32.15 81.91 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.615 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.38 99.41 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.199 0.2 . . . . 0.0 111.397 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.11 -35.24 73.98 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.447 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 67' ' ' PHE . 46.0 t -63.44 -48.09 88.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 120.743 0.306 . . . . 0.0 110.259 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -64.76 -39.78 94.2 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.651 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.95 -48.67 79.35 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.759 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.0 ttp -61.65 -41.7 97.88 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.136 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -41.21 81.64 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.944 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.6 m -62.79 -43.71 98.07 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.833 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -71.29 -42.29 68.87 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.98 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t -59.73 -36.66 77.03 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.028 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -60.3 -37.47 80.65 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.144 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -70.56 -39.37 73.99 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.012 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -75.07 -33.21 61.65 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.424 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.649 ' HB3' HG22 ' A' ' 89' ' ' VAL . 2.9 m-20 -88.07 111.6 43.89 Favored Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 116.754 -0.203 . . . . 0.0 111.122 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 31.8 Cg_exo -58.42 142.41 97.83 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.852 2.368 . . . . 0.0 112.543 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 32.0 Cg_exo -58.53 151.84 59.27 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.914 2.41 . . . . 0.0 112.618 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 59.29 51.39 6.86 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.709 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-160 -128.92 145.91 51.09 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.6 -40.74 75.82 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.019 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.9 m -61.99 -36.1 72.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.313 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.709 HG23 ' HB3' ' A' ' 86' ' ' HIS . 28.2 t -65.87 -46.6 88.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.769 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.84 -36.91 82.58 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.015 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -61.26 -46.36 90.69 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.26 -46.58 82.93 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtp180 -59.89 -37.28 78.92 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.839 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -59.43 -42.2 91.35 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.725 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.471 HD22 ' HE3' ' A' ' 13' ' ' MET . 20.1 mt -71.02 -32.12 68.81 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.81 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -44.23 71.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.888 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -60.69 -46.67 89.49 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.241 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.462 HG11 ' NE2' ' A' ' 18' ' ' HIS . 8.6 p -66.03 -42.95 92.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.946 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -64.14 -50.3 68.77 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.849 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.58 -46.97 83.34 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.001 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -46.1 90.81 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.867 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -43.99 78.14 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.002 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.427 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -57.48 -46.35 83.8 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.98 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.37 -36.35 83.4 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.052 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -69.14 -44.81 71.6 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.129 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.427 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 8.0 ptm -69.4 -33.31 72.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.746 -0.207 . . . . 0.0 111.408 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.81 -42.7 16.17 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.478 0.18 . . . . 0.0 111.347 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.804 -0.617 . . . . 0.0 110.737 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.69 0.281 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.52 -40.13 80.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.958 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.415 HD21 ' O ' ' A' ' 61' ' ' TYR . 78.8 mt -58.97 -33.71 70.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.911 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -72.72 -34.72 67.28 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.88 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -49.71 53.8 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.433 ' HA ' HD12 ' A' ' 9' ' ' ILE . 24.0 p -60.31 -36.81 78.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.929 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -54.56 -34.08 61.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.251 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -46.7 93.48 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.425 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.433 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.4 mt -64.53 -43.64 96.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.875 0.369 . . . . 0.0 110.303 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 mp -62.95 -35.52 80.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.452 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -58.18 -28.07 64.43 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.569 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.77 -36.83 75.03 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.527 0.203 . . . . 0.0 110.789 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.423 ' HA ' ' HB2' ' A' ' 18' ' ' HIS . 1.2 mpp? -59.83 -37.58 79.6 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.46 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -98.71 0.71 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.626 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.09 10.75 23.1 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt 75.09 21.58 1.92 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.372 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -111.13 -35.09 6.0 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.04 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.483 ' NE2' HG11 ' A' ' 98' ' ' VAL . 11.1 m-70 -124.61 18.16 8.79 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.29 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.63 -37.21 56.72 Favored 'General case' 0 N--CA 1.46 0.063 0 CA-C-O 120.652 0.263 . . . . 0.0 110.956 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.93 -38.19 76.14 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.028 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 6.6 m-85 -77.5 -32.36 54.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.248 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.454 ' HB1' ' CD1' ' A' ' 26' ' ' TYR . . . -94.39 8.08 43.23 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.435 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.9 t90 -69.92 -51.55 14.72 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.435 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.0 Cg_endo -76.39 2.13 7.63 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.308 2.005 . . . . 0.0 113.435 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -150.54 58.24 0.94 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.013 0.435 . . . . 0.0 111.011 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.454 ' CD1' ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -112.25 -54.37 2.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.665 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -72.02 153.27 92.8 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.47 -179.56 0.2 Allowed 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.894 2.396 . . . . 0.0 112.723 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.7 m -107.7 73.99 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.132 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -61.66 102.13 0.23 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.874 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.413 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.6 p -61.52 -35.62 68.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.636 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -71.79 -47.4 53.68 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.605 0.24 . . . . 0.0 111.307 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -46.38 54.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.2 mt -80.75 -21.28 41.22 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.82 58.57 8.13 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.466 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.414 HD13 ' HB2' ' A' ' 39' ' ' TYR . 0.4 OUTLIER -126.99 66.16 1.28 Allowed 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.934 0.397 . . . . 0.0 111.092 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -62.1 -21.17 64.77 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.354 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -76.46 -20.19 57.27 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.516 0.198 . . . . 0.0 111.29 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.452 ' CE1' HG13 ' A' ' 43' ' ' ILE . 1.1 t80 -59.05 -31.76 69.15 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 120.596 0.236 . . . . 0.0 110.786 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.4 t -60.15 -40.01 88.36 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.483 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -84.76 -37.95 20.22 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 121.262 -0.175 . . . . 0.0 111.2 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 12.2 mt -62.89 -33.42 60.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.452 HG13 ' CE1' ' A' ' 39' ' ' TYR . 40.0 mm -123.37 116.6 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.158 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -33.82 75.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.279 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -124.77 90.61 50.71 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.56 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.45 106.8 1.29 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.782 2.321 . . . . 0.0 112.452 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 27.0 mtp -146.46 144.7 29.84 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.298 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.74 172.09 13.45 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.606 ' HA ' HD12 ' A' ' 52' ' ' ILE . 0.4 OUTLIER -56.51 -43.28 79.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.01 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -61.99 -34.78 76.8 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.749 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 86.6 m -70.32 -41.74 72.88 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.702 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.606 HD12 ' HA ' ' A' ' 49' ' ' MET . 7.5 mt -66.64 -45.02 89.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.804 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -67.59 -34.63 77.41 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.037 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.3 t -57.55 -42.0 82.09 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.973 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -60.72 -49.6 76.84 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.814 0.34 . . . . 0.0 110.176 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.564 HD22 ' HE2' ' A' ' 67' ' ' PHE . 14.1 tp -60.99 -35.9 78.04 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -59.86 -39.58 85.7 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.119 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.4 15.18 11.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.925 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.36 28.54 16.95 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.59 0.234 . . . . 0.0 111.562 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -74.66 -37.35 62.73 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.722 0.296 . . . . 0.0 110.508 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.519 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 7.7 m-85 -73.91 100.67 3.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.819 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -69.91 -32.37 70.64 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.005 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -145.78 159.87 42.57 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.021 0.439 . . . . 0.0 111.473 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.557 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -70.66 -14.5 62.49 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.192 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -62.96 -45.52 92.04 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 120.69 0.281 . . . . 0.0 110.6 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -71.46 -32.46 68.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.794 179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.564 ' HE2' HD22 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -55.2 -53.49 55.3 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.969 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.2 -31.3 78.55 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.68 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.77 -41.36 95.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.668 0.271 . . . . 0.0 111.069 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.9 -38.96 64.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.361 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 67' ' ' PHE . 26.8 t -64.31 -46.23 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.734 0.302 . . . . 0.0 110.83 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.1 mtt-85 -59.18 -33.39 70.88 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.103 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.1 -46.63 50.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.931 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.25 -42.26 90.71 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -63.8 -38.75 92.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.9 m -66.33 -38.99 88.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.019 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.417 ' CG ' HG23 ' A' ' 43' ' ' ILE . 16.2 m-20 -70.9 -44.07 67.0 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.975 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -58.23 -34.12 70.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.101 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -56.66 -37.26 70.55 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.219 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -66.29 -47.77 72.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.205 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -72.46 -33.86 67.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.079 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.976 ' HB3' HG22 ' A' ' 89' ' ' VAL . 21.5 m-20 -65.39 114.01 13.83 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.132 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.638 ' O ' HG21 ' A' ' 89' ' ' VAL . 35.5 Cg_exo -58.43 167.59 4.76 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.902 2.401 . . . . 0.0 112.66 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.03 116.96 4.91 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.48 2.12 . . . . 0.0 112.334 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.4 t0 61.51 68.72 0.69 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.109 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.528 ' HB3' HG23 ' A' ' 89' ' ' VAL . 4.3 t-80 -125.77 158.96 33.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.04 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.15 -43.91 78.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.271 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.6 m -65.36 -34.34 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.976 HG22 ' HB3' ' A' ' 82' ' ' ASN . 28.4 t -63.93 -43.32 97.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.907 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.19 -36.98 73.89 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.978 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' MET . . . . . 0.417 ' HG2' ' CD2' ' A' ' 21' ' ' TYR . 10.3 mtt -66.85 -36.99 83.59 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.1 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.66 65.56 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.69 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.51 78.0 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.213 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.434 ' HD2' ' CE2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.96 -40.48 93.51 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.89 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.0 mt -68.98 -31.66 70.67 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.003 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.39 -49.17 62.01 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.877 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.6 -46.45 90.2 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.414 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.483 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.6 p -64.45 -42.98 96.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.315 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.04 -50.47 66.1 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.536 0.208 . . . . 0.0 110.5 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -42.66 90.59 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.103 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -47.81 84.02 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.992 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -44.15 80.11 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.103 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.557 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 1.9 t80 -65.07 -42.25 94.35 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.861 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.13 76.61 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.03 -44.6 68.91 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.168 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.6 ptm -68.77 -33.33 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.324 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.0 -41.83 15.45 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.058 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.06 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.64 0.257 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -61.66 -36.15 80.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.766 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.48 -37.82 88.76 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.191 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -72.49 -42.0 65.37 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.81 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -49.18 76.11 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.209 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.3 p -62.35 -36.71 83.08 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.017 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.6 t -54.47 -34.79 62.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.958 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.64 -40.12 96.04 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 121.064 -0.588 . . . . 0.0 112.589 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.4 mt -64.14 -39.28 84.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.518 HD13 ' CD2' ' A' ' 56' ' ' LEU . 0.5 OUTLIER -63.34 -35.48 80.54 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.643 179.114 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.2 -29.64 65.83 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.571 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG3' ' HD3' ' A' ' 17' ' ' LYS . 0.7 OUTLIER -58.63 -36.59 74.32 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.402 0.144 . . . . 0.0 111.049 179.459 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.451 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.2 mtt -58.89 -37.24 76.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.705 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -103.72 10.24 36.8 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.454 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -104.08 16.55 26.0 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.638 0.256 . . . . 0.0 111.534 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.61 28.54 9.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.26 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HD3' ' HG3' ' A' ' 12' ' ' GLU . 22.0 mttm -115.88 -35.78 4.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.129 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.619 ' CE1' HD23 ' A' ' 95' ' ' LEU . 2.6 t-80 -134.44 27.17 3.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.885 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.451 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -80.77 -32.13 35.61 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.29 94.09 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.208 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -83.24 -32.09 26.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.48 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -95.95 12.42 30.43 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.451 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -74.3 -53.72 3.55 Favored Pre-proline 0 CA--C 1.532 0.279 0 O-C-N 122.505 -0.122 . . . . 0.0 111.112 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.451 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 3.0 Cg_exo -74.51 -1.94 11.73 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.773 2.315 . . . . 0.0 113.222 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.4 50.89 2.18 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.989 0.423 . . . . 0.0 111.06 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -109.15 -47.52 3.41 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.781 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.6 156.06 56.23 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.247 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.66 -172.76 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.882 2.388 . . . . 0.0 112.74 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -111.91 76.47 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 121.112 0.482 . . . . 0.0 111.211 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.58 107.2 1.09 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.017 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 36' ' ' LEU . 9.5 p -62.31 -38.71 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.545 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.05 -45.58 60.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.587 0.232 . . . . 0.0 111.342 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.2 -48.24 52.72 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.065 0.395 . . . . 0.0 112.065 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -81.54 -21.66 38.38 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.55 58.62 5.31 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.479 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -130.61 74.27 1.59 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.227 -179.791 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -70.9 -8.06 50.22 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.013 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.33 -20.02 57.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 121.344 -0.142 . . . . 0.0 111.193 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.87 -43.66 98.1 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.937 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.3 -38.84 90.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.717 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.36 -36.6 84.67 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.695 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.405 HG22 HG13 ' A' ' 43' ' ' ILE . 13.2 mt -78.39 -52.83 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.234 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.405 HG13 HG22 ' A' ' 42' ' ' ILE . 3.2 mt -128.91 141.47 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.806 0.336 . . . . 0.0 111.503 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.53 -31.88 12.55 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.489 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -120.7 65.34 12.37 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 120.671 0.272 . . . . 0.0 111.414 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.06 164.08 30.0 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.853 2.369 . . . . 0.0 112.718 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.1 ttm -148.37 158.89 44.38 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.5 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -138.16 164.52 28.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.21 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -40.41 78.84 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 t -62.66 -41.55 99.12 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.56 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 4.9 m -64.57 -42.32 95.71 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.972 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.559 HG23 ' OH ' ' A' ' 61' ' ' TYR . 15.5 mt -69.69 -45.08 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.967 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? -66.11 -34.21 77.54 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.22 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -57.5 -40.03 77.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.877 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -48.22 82.65 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.518 ' CD2' HD13 ' A' ' 10' ' ' LEU . 13.5 tp -63.96 -35.18 79.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.729 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.92 -40.99 97.76 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.503 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.86 15.37 11.43 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 60.58 28.08 17.77 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.663 0.268 . . . . 0.0 111.401 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -74.51 -33.94 62.91 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.766 0.317 . . . . 0.0 110.528 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.559 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.2 m-85 -70.11 105.99 3.1 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.888 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttm-85 -69.62 -29.0 66.4 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.245 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.37 164.42 38.3 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.44 -23.0 64.56 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.242 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.87 -38.32 90.38 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.742 0.306 . . . . 0.0 110.482 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -70.3 -35.22 73.56 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.512 ' O ' HG23 ' A' ' 71' ' ' VAL . 16.4 t80 -59.42 -48.52 81.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.533 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.88 -33.0 81.65 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.464 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.61 -37.46 84.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.555 0.217 . . . . 0.0 111.435 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -76.43 -30.76 57.54 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.269 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 67' ' ' PHE . 39.3 t -66.3 -48.57 80.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 111.027 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -64.5 -34.68 78.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.945 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.6 tp -69.06 -46.98 66.47 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.765 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 ttp -59.6 -46.43 88.96 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.198 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.462 ' CZ ' ' HB2' ' A' ' 96' ' ' GLN . 4.5 m-85 -60.88 -39.79 90.56 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.183 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 24.7 t -59.51 -46.32 89.18 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.846 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -74.99 -41.68 59.04 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.784 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.4 m -60.97 -34.94 75.55 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.287 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -60.28 -35.03 74.6 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.653 0.263 . . . . 0.0 111.215 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -71.63 -35.85 70.55 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.85 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -82.82 -40.94 19.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.347 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.666 ' HB3' HG22 ' A' ' 89' ' ' VAL . 29.2 m-20 -69.45 116.59 44.27 Favored Pre-proline 0 N--CA 1.464 0.262 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.081 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.539 ' O ' HG21 ' A' ' 89' ' ' VAL . 50.7 Cg_exo -54.71 153.62 23.58 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.916 2.411 . . . . 0.0 112.576 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.03 136.83 28.01 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.565 2.177 . . . . 0.0 112.151 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 t70 58.19 61.24 2.37 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.03 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.689 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.4 t-80 -126.97 150.16 49.52 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.911 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -56.52 -44.12 80.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.326 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.71 -35.89 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.198 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.689 HG23 ' HB3' ' A' ' 86' ' ' HIS . 19.5 t -64.98 -45.74 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.779 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.83 78.69 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.802 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.7 mtp -61.46 -46.59 89.44 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.711 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -56.01 -50.17 71.63 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.934 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -58.87 -41.11 86.31 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -61.99 -42.02 98.69 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.996 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 92' ' ' ALA . 5.5 mt -60.51 -41.5 94.48 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.838 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.08 -41.88 73.51 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.916 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.55 -46.67 89.31 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.252 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.1 p -66.69 -42.64 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.014 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -47.04 79.57 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.825 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.62 -46.35 90.6 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.625 0.25 . . . . 0.0 110.976 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -47.7 84.65 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.95 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.0 mmt180 -67.66 -38.77 84.25 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.451 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -58.41 -50.71 72.72 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.009 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.13 -35.67 77.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.229 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.8 62.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.396 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.451 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 2.0 ptm -69.26 -34.01 74.11 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.93 -41.64 15.73 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.6 0.238 . . . . 0.0 110.911 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 117.947 -1.025 . . . . 0.0 111.044 -179.812 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 120.705 0.288 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -57.02 -37.11 71.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt -61.24 -46.61 89.7 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.822 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -67.73 -34.48 76.93 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.825 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.65 -39.61 70.24 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.831 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -65.59 -39.05 91.16 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.54 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -35.65 68.37 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.059 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.18 -47.58 90.38 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.109 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 32.4 mt -64.89 -44.25 96.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-O 120.788 0.328 . . . . 0.0 110.319 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.527 HD11 ' CZ ' ' A' ' 67' ' ' PHE . 2.8 mp -62.42 -35.79 80.35 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.737 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mtmt -58.47 -28.19 65.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.375 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 33.3 tt0 -58.48 -36.63 74.04 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.841 -0.163 . . . . 0.0 110.967 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -57.46 -37.11 72.33 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.487 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -107.67 9.96 29.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.63 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.472 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -92.04 12.06 23.21 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.8 tttm 73.03 26.97 2.12 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.528 0.331 . . . . 0.0 111.284 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 25.7 mttt -120.8 -35.39 3.37 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.346 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.703 ' CD2' HD23 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -131.77 25.7 4.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.172 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.52 -34.48 31.2 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.068 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.73 76.47 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.437 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -79.58 -32.57 42.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.381 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.14 15.29 28.75 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -61.83 4.8 Favored Pre-proline 0 CA--C 1.53 0.193 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.64 -19.76 64.94 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.258 1.972 . . . . 0.0 112.799 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.38 35.94 4.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.475 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 -40.95 10.21 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.011 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -89.87 163.44 32.38 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.288 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -81.16 -174.53 2.25 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.945 2.43 . . . . 0.0 112.758 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.0 m -113.83 75.14 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.091 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -58.6 103.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.055 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.552 HG23 ' C ' ' A' ' 36' ' ' LEU . 10.4 p -61.55 -39.19 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.633 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -72.05 -45.51 60.53 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.52 0.2 . . . . 0.0 111.536 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.95 -48.36 45.75 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 mt -81.21 -21.5 39.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.87 57.68 6.22 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.411 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.552 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -129.81 73.83 1.55 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.98 0.419 . . . . 0.0 111.21 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -71.69 -8.92 57.09 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.715 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.6 -20.1 57.13 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.461 0.172 . . . . 0.0 111.388 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.483 ' CD2' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -61.57 -41.81 97.94 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.884 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.68 -39.18 90.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.736 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.05 -39.62 94.48 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.628 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.471 HD12 ' HA ' ' A' ' 39' ' ' TYR . 5.8 mt -74.81 -51.66 21.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.843 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.458 HD13 ' HB2' ' A' ' 77' ' ' ASN . 10.0 mt -130.35 112.24 22.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -11.79 60.63 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.822 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.448 ' H ' HG22 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -126.93 71.79 75.38 Favored Pre-proline 0 CA--C 1.534 0.341 0 CA-C-O 120.71 0.291 . . . . 0.0 111.047 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.0 145.48 99.06 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 122.897 2.398 . . . . 0.0 112.539 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 mmt -147.89 139.45 23.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.232 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -145.39 165.54 28.2 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.835 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.439 ' HA ' HD12 ' A' ' 52' ' ' ILE . 3.4 ttm -57.01 -36.56 70.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.646 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.0 t -66.35 -39.34 89.11 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.812 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.2 m -67.2 -40.11 86.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.982 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.561 HG23 ' OH ' ' A' ' 61' ' ' TYR . 13.3 mt -68.46 -45.19 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.99 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -66.09 -35.22 79.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.127 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.6 t -57.64 -42.98 84.51 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.967 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.38 -47.75 84.72 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.59 -34.53 77.19 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.693 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.81 -41.31 99.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.295 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.81 15.29 11.51 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 59.91 28.45 17.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.689 0.28 . . . . 0.0 111.424 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -72.99 -34.1 66.23 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.517 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.561 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.8 m-85 -72.86 103.09 3.59 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.49 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -67.3 -29.76 69.43 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.226 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -155.65 178.1 10.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.812 0.339 . . . . 0.0 111.281 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.34 -25.25 62.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.62 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -42.07 99.62 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.774 0.321 . . . . 0.0 110.267 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.92 -37.67 88.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.802 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.527 ' CZ ' HD11 ' A' ' 10' ' ' LEU . 27.2 t80 -59.41 -51.86 68.07 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.806 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.22 -31.53 77.34 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 121.049 -0.595 . . . . 0.0 112.696 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 72' ' ' ARG . . . -58.8 -39.39 80.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.611 0.243 . . . . 0.0 111.32 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.68 -33.11 58.26 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.169 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 67' ' ' PHE . 40.7 t -67.44 -46.75 82.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.604 0.24 . . . . 0.0 110.789 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 15.5 ptt180 -59.09 -36.99 76.07 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.85 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.15 -42.09 66.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.629 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -62.17 -46.77 87.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.129 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.39 -35.57 80.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.053 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.6 t -59.78 -47.63 84.91 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.117 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.458 ' HB2' HD13 ' A' ' 43' ' ' ILE . 15.9 p30 -75.82 -30.74 59.1 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.584 0.231 . . . . 0.0 110.868 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.91 -41.88 97.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.822 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -61.19 -33.59 73.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.409 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -71.16 -44.47 65.46 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.06 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -75.25 -37.28 61.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.311 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.78 ' HB3' HG22 ' A' ' 89' ' ' VAL . 9.1 m-20 -58.28 115.11 10.26 Favored Pre-proline 0 N--CA 1.465 0.282 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.34 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.489 ' O ' HG21 ' A' ' 89' ' ' VAL . 34.4 Cg_exo -58.45 163.15 10.97 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.971 2.447 . . . . 0.0 112.629 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -73.91 126.44 10.66 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.638 2.226 . . . . 0.0 112.45 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t0 58.47 62.42 1.97 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.157 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.471 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.5 t-80 -123.06 154.09 39.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -56.81 -43.8 81.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.245 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 22.1 m -59.7 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.324 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.78 HG22 ' HB3' ' A' ' 82' ' ' ASN . 22.5 t -62.77 -44.77 99.76 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.922 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.55 -41.83 95.31 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.823 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.9 mtt -65.05 -43.61 91.72 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.606 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.497 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -60.91 -48.18 83.02 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.021 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -46.98 77.4 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.0 tttp -63.02 -38.06 89.67 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.842 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.703 HD23 ' CD2' ' A' ' 18' ' ' HIS . 12.6 mt -66.91 -36.27 81.88 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.086 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 7.5 tm0? -70.06 -47.85 60.27 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.074 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -61.3 -46.84 88.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.496 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.401 HG13 ' N ' ' A' ' 99' ' ' PHE . 14.1 p -63.36 -43.31 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.234 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.401 ' N ' HG13 ' A' ' 98' ' ' VAL . 2.2 t80 -65.32 -51.01 63.46 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.591 0.234 . . . . 0.0 110.803 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -42.77 92.82 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.89 85.88 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.873 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -65.66 -44.18 87.11 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.982 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -43.47 95.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.757 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.8 -44.22 90.64 Favored 'General case' 0 N--CA 1.46 0.065 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -64.72 -40.91 96.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.603 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -44.4 72.04 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.827 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -72.23 -42.34 65.82 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.206 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.492 -0.766 . . . . 0.0 110.839 179.848 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.628 0.251 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -61.42 -40.88 96.03 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.797 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -38.61 89.0 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.994 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -71.67 -36.1 70.53 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.806 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -50.19 61.61 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.556 ' HA ' HD12 ' A' ' 9' ' ' ILE . 29.7 p -62.25 -37.79 86.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.046 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.8 m -62.69 -36.42 82.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.915 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.11 -41.93 98.27 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.35 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.556 HD12 ' HA ' ' A' ' 6' ' ' CYS . 11.2 mt -63.97 -46.34 94.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-O 120.663 0.268 . . . . 0.0 110.657 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.9 mt -62.17 -36.25 81.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.86 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.6 mttp -58.84 -31.7 68.74 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.33 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 3.3 tt0 -58.1 -36.59 73.1 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.365 0.126 . . . . 0.0 111.016 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.0 mtt -56.87 -37.1 70.87 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.185 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.33 16.61 19.91 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.575 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -95.97 15.48 20.45 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.689 0.28 . . . . 0.0 111.53 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.31 24.03 1.13 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.595 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 48.8 mttp -116.91 -32.78 4.97 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.838 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.86 18.51 3.51 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.01 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.48 -35.71 81.37 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.494 0.183 . . . . 0.0 111.494 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.54 70.42 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.114 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.443 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 10.2 m-85 -99.71 -24.84 14.58 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.594 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.55 -16.17 35.37 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.623 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 12.2 t90 -53.45 -51.83 72.2 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.298 0.094 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.623 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 90.3 Cg_endo -82.74 -19.4 6.11 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.476 2.117 . . . . 0.0 113.189 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -97.42 36.16 1.52 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.622 0.249 . . . . 0.0 111.59 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.51 -58.15 0.99 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.858 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -66.35 138.46 95.86 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.966 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.01 160.72 32.62 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.787 2.325 . . . . 0.0 112.507 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 29' ' ' VAL . 8.7 m -88.91 87.49 2.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 121.024 0.44 . . . . 0.0 110.745 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.69 104.34 0.22 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.111 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.498 HG23 ' C ' ' A' ' 36' ' ' LEU . 12.9 p -59.73 -36.6 66.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.72 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.06 -47.03 54.57 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.29 49.95 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.77 -21.51 40.96 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.87 57.19 8.1 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.387 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.498 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -126.58 65.28 1.26 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 111.179 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -64.94 -19.71 66.09 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -76.15 -19.46 58.45 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.195 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.447 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -59.48 -41.83 90.71 Favored 'General case' 0 CA--C 1.526 0.056 0 CA-C-O 120.496 0.189 . . . . 0.0 110.786 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.51 -32.72 74.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.653 0.263 . . . . 0.0 110.948 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 m-20 -75.81 -45.77 34.19 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.03 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.617 HD12 ' CE2' ' A' ' 81' ' ' TYR . 49.3 mt -74.56 -34.45 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.461 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.447 HG13 ' CE2' ' A' ' 39' ' ' TYR . 33.0 mm -103.64 107.99 23.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.631 0.253 . . . . 0.0 111.16 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -68.52 -34.05 75.2 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.468 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -130.41 88.7 46.6 Favored Pre-proline 0 CA--C 1.532 0.253 0 CA-C-O 120.704 0.287 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.72 140.72 39.68 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.738 2.292 . . . . 0.0 112.632 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttm -160.61 153.62 21.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.018 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -147.56 162.0 39.98 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.5 tpp -54.54 -38.94 67.18 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 t -62.51 -39.71 94.39 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.449 0.166 . . . . 0.0 111.108 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.7 m -70.97 -40.62 71.82 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.982 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.4 HG22 ' CE2' ' A' ' 67' ' ' PHE . 15.4 mt -69.7 -44.83 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.546 0.213 . . . . 0.0 110.785 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.14 -35.1 79.18 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.671 -0.241 . . . . 0.0 111.1 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -44.01 84.26 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.082 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.63 -49.76 76.24 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.844 0.354 . . . . 0.0 110.109 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.6 tp -63.09 -34.29 77.28 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.716 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.37 -39.74 88.3 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.193 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.0 15.41 10.11 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 62.77 27.18 15.97 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.303 0.241 . . . . 0.0 111.585 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -75.95 -34.43 59.83 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.84 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -78.21 99.35 6.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.938 0.399 . . . . 0.0 110.588 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -58.0 -32.58 68.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -146.55 168.21 21.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 111.057 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.18 -16.9 61.42 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.363 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -45.92 90.19 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.634 0.254 . . . . 0.0 110.334 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.41 -38.93 85.38 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.53 ' O ' HG23 ' A' ' 71' ' ' VAL . 20.1 t80 -63.42 -52.65 60.65 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.603 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -64.14 -31.34 80.5 Favored Glycine 0 C--N 1.335 0.51 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.151 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.92 91.22 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.829 0.315 . . . . 0.0 111.182 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -72.2 -30.33 64.85 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.43 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 67' ' ' PHE . 43.4 t -65.46 -47.99 84.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.759 0.314 . . . . 0.0 110.498 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 56.9 mtp85 -59.63 -39.68 85.1 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.25 -46.05 74.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.815 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -59.28 -46.8 87.57 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.249 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -66.09 -35.52 80.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.773 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.0 m -59.65 -46.77 88.03 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.503 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.21 -36.43 61.39 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.507 0.194 . . . . 0.0 110.977 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -39.09 83.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.231 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -57.3 -34.65 68.91 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.15 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.7 tttt -66.37 -44.02 84.32 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.598 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.617 ' CE2' HD12 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -70.39 -37.74 74.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.24 179.757 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.736 ' HB3' HG22 ' A' ' 89' ' ' VAL . 78.1 m-20 -65.61 111.62 6.67 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.529 ' O ' HG21 ' A' ' 89' ' ' VAL . 42.8 Cg_endo -67.18 147.14 78.41 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.629 2.219 . . . . 0.0 112.356 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 50.2 Cg_exo -53.55 131.74 45.29 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.671 2.247 . . . . 0.0 112.723 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t70 63.0 64.31 0.87 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.514 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.562 ' HB3' HG23 ' A' ' 89' ' ' VAL . 5.5 t-80 -136.8 155.94 49.15 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.034 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -55.8 -44.46 77.82 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.403 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.6 m -63.52 -35.24 71.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.637 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.736 HG22 ' HB3' ' A' ' 82' ' ' ASN . 26.2 t -60.8 -46.27 96.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.88 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.33 -33.7 76.45 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.027 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 6.0 mtm -64.42 -46.56 82.69 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.861 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.45 -44.29 96.77 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.839 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -65.84 -43.09 89.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.731 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.443 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 22.3 tttp -63.37 -42.94 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.103 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -66.65 -39.07 88.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -69.11 -43.79 73.73 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.703 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -61.48 -46.88 88.16 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.33 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p -66.33 -42.95 91.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.808 -0.178 . . . . 0.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -63.85 -51.59 63.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.862 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.39 -41.31 98.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -47.56 85.21 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.658 0.266 . . . . 0.0 110.839 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -43.9 78.32 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.798 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.456 ' HD1' HD12 ' A' ' 107' ' ' LEU . 0.3 OUTLIER -60.45 -42.89 97.08 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.027 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.04 -32.62 73.11 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.007 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -70.9 -44.43 66.27 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.987 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 9.2 ptm -69.06 -33.38 73.47 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.195 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LEU . . . . . 0.456 HD12 ' HD1' ' A' ' 103' ' ' PHE . 8.8 mt -83.89 -42.24 16.57 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.041 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.842 179.758 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 . . . . . 0 N--CA 1.488 1.438 0 CA-C-O 120.683 0.278 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -69.07 -34.75 75.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.948 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.06 -46.8 76.48 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.553 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -32.29 71.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.15 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.62 -40.91 84.65 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.563 0.22 . . . . 0.0 110.799 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.3 m -63.48 -38.95 93.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.856 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.9 m -56.93 -35.7 69.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.68 97.73 Favored Glycine 0 C--N 1.337 0.612 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.628 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 16.1 mt -65.47 -47.67 85.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.705 0.288 . . . . 0.0 110.66 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.493 HD13 ' HG3' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -63.45 -35.79 81.61 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.776 179.403 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -30.75 66.69 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.333 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.491 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 52.7 tt0 -58.55 -36.66 74.25 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.004 0.19 . . . . 0.0 110.829 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -58.53 -37.17 75.09 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.679 0.276 . . . . 0.0 110.397 178.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.82 5.29 33.0 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.491 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.81 17.84 11.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.629 0.252 . . . . 0.0 111.349 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 47.6 mmtt 68.02 37.37 3.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.125 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.436 ' CD ' ' HG3' ' A' ' 12' ' ' GLU . 55.0 mttt -128.09 -39.28 1.75 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.07 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -123.73 19.09 9.47 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.374 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.01 62.76 Favored 'General case' 0 C--N 1.335 -0.052 0 CA-C-O 120.643 0.259 . . . . 0.0 111.106 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.69 -36.16 62.75 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.275 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 5.3 m-85 -81.42 -33.08 32.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.217 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.17 20.0 16.51 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.403 ' N ' ' CD ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.68 -50.88 62.16 Favored Pre-proline 0 CA--C 1.529 0.154 0 CA-C-N 116.94 -0.118 . . . . 0.0 111.049 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 23' ' ' TRP . 50.5 Cg_exo -53.88 -25.43 35.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.548 2.165 . . . . 0.0 112.934 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -118.84 37.11 4.2 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.132 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.16 -35.36 64.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.17 162.57 47.3 Favored Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.18 -177.4 0.12 Allowed 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.155 2.57 . . . . 0.0 112.768 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 m -120.91 83.78 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.252 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.03 101.85 0.31 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.7 p -61.83 -36.63 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.737 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -71.83 -47.65 51.69 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.563 0.22 . . . . 0.0 111.391 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -47.29 49.72 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.4 mt -80.91 -21.49 40.5 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.88 57.61 9.48 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.455 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.6 OUTLIER -126.05 74.5 1.44 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.051 0.453 . . . . 0.0 111.296 -179.862 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.92 -3.85 34.56 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.777 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -76.25 -20.0 57.8 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.37 0.129 . . . . 0.0 111.304 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.507 ' HA ' HD12 ' A' ' 42' ' ' ILE . 4.3 t80 -57.42 -34.06 68.53 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 116.671 -0.241 . . . . 0.0 110.969 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.48 -40.46 96.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.751 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.91 -41.02 75.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.476 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.507 HD12 ' HA ' ' A' ' 39' ' ' TYR . 12.8 mt -68.74 -51.44 45.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.305 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.96 150.5 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-O 120.941 0.401 . . . . 0.0 111.644 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.1 pttm -96.04 -32.77 12.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.677 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -110.96 83.39 3.63 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-O 120.705 0.288 . . . . 0.0 111.057 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -73.01 125.76 10.65 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.833 2.355 . . . . 0.0 112.65 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.1 mtp -148.63 141.36 24.56 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.148 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.66 168.99 13.6 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.493 ' HA ' HD12 ' A' ' 52' ' ' ILE . 26.9 mtt -56.31 -38.74 71.69 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.102 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.5 t -62.45 -35.72 80.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.833 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.3 m -73.18 -38.78 66.03 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.017 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' A' ' 49' ' ' MET . 19.7 mt -66.89 -45.13 88.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.917 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.493 ' HG3' HD13 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -69.31 -34.24 74.37 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.959 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -57.32 -42.91 82.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.729 -0.214 . . . . 0.0 110.901 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -62.02 -49.38 76.24 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.879 0.371 . . . . 0.0 110.112 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 56' ' ' LEU . 10.3 tp -63.76 -32.66 74.24 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.002 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.77 -40.6 88.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.651 0.262 . . . . 0.0 111.056 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.34 15.19 12.59 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.861 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.52 27.75 17.41 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.629 0.252 . . . . 0.0 111.599 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -70.68 -34.29 71.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.68 0.276 . . . . 0.0 110.689 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -73.63 106.55 5.44 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.608 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -80.58 -28.8 37.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.068 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -146.38 165.25 29.9 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.944 0.402 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.11 -15.67 61.48 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.55 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -63.1 -44.94 94.27 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.48 -37.98 77.49 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.848 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.1 t80 -66.53 -53.62 32.84 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.45 -38.0 84.87 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.665 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.92 -35.27 76.25 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.591 0.234 . . . . 0.0 111.22 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -76.17 -34.2 59.35 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.329 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.2 t -67.09 -48.24 79.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 120.621 0.248 . . . . 0.0 110.622 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.48 -34.03 76.88 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.082 179.656 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.25 -48.38 65.23 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -59.33 -42.72 92.12 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.3 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.11 -44.0 95.17 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.795 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -37.26 86.56 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.777 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -69.66 -47.85 61.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.832 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.24 -33.91 69.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.206 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -56.54 -39.45 73.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.149 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -75.01 -38.92 61.45 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.791 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -59.89 -31.86 70.2 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.674 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.779 ' HB2' HG22 ' A' ' 89' ' ' VAL . 21.8 p30 -92.89 148.57 36.13 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-O 120.811 0.338 . . . . 0.0 111.104 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.76 ' O ' HG21 ' A' ' 89' ' ' VAL . 97.7 Cg_endo -80.17 169.63 17.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.999 2.466 . . . . 0.0 112.653 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.22 128.67 11.49 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.513 2.142 . . . . 0.0 112.525 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 t70 62.51 69.26 0.61 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.283 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.855 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.7 t-160 -136.31 158.05 45.35 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.229 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.18 -44.68 96.06 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.326 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.3 m -64.7 -30.65 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.373 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.855 HG23 ' HB3' ' A' ' 86' ' ' HIS . 12.5 t -69.37 -40.73 80.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.893 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.58 -35.36 68.11 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.024 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' MET . . . . . 0.412 ' HG2' ' CD2' ' A' ' 21' ' ' TYR . 6.1 mtt -65.6 -44.29 87.05 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.744 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.27 -47.59 85.36 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.238 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -59.57 -43.41 93.63 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.745 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.417 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.0 tttt -68.62 -40.45 80.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.868 179.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -34.4 78.23 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.086 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -69.3 -44.0 72.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.698 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -63.54 -46.86 84.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.15 -43.09 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.198 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.0 -50.63 67.76 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.787 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -45.98 85.39 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.762 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.2 mtp -62.44 -46.29 89.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -64.73 -42.5 95.17 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.02 -45.26 95.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.815 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.68 73.18 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.9 -43.36 65.49 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.065 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.7 ptm -69.27 -33.32 73.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.214 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.46 -42.82 14.13 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.047 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.729 0.299 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -57.97 -36.94 73.3 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 mt -62.54 -34.82 77.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.024 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 -32.62 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.076 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.31 -48.22 57.58 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.068 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.661 ' HA ' HD12 ' A' ' 9' ' ' ILE . 30.1 p -66.11 -36.99 84.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.385 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 82.9 p -57.57 -34.42 69.18 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.96 -43.46 98.1 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.454 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.661 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.3 mt -63.99 -45.74 95.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.849 0.357 . . . . 0.0 110.058 179.316 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.582 HD21 ' HG2' ' A' ' 53' ' ' LYS . 9.3 tp -61.27 -35.46 77.36 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -36.38 73.01 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.142 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -37.82 82.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.822 -0.172 . . . . 0.0 111.18 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -37.39 75.76 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 110.273 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -108.45 17.65 21.85 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.299 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.73 0.14 57.17 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt 78.43 16.78 1.17 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.288 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.57 -36.22 6.25 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.63 179.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -113.55 -3.26 13.68 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.786 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.75 -29.47 68.18 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.447 0.165 . . . . 0.0 111.409 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.67 -46.1 83.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.649 0.262 . . . . 0.0 110.85 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.6 -34.21 71.89 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.865 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -98.15 19.55 13.93 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.572 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.505 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 42.6 t90 -59.58 -51.63 79.76 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 116.77 -0.196 . . . . 0.0 111.47 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 57.0 Cg_endo -70.35 -9.66 26.38 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.251 1.967 . . . . 0.0 113.01 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -120.13 43.16 2.77 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.044 0.45 . . . . 0.0 110.903 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.43 -37.95 11.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.683 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -107.86 160.93 25.0 Favored Pre-proline 0 N--CA 1.465 0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.055 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.35 -176.07 0.13 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.969 2.446 . . . . 0.0 112.761 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.31 79.43 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.11 0.481 . . . . 0.0 111.308 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.686 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 2.2 t0 -63.76 101.44 0.36 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.68 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.66 -39.53 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.715 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -71.92 -46.86 56.15 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.271 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -70.5 -48.75 54.16 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.51 -21.49 38.6 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.66 54.23 13.29 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.476 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 39' ' ' TYR . 0.5 OUTLIER -126.34 67.88 1.22 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.016 0.436 . . . . 0.0 111.148 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -65.41 -22.2 66.75 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.312 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.3 -19.89 57.83 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.318 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.471 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.4 t80 -60.79 -45.61 93.72 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-O 120.536 0.207 . . . . 0.0 110.964 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 26.8 t -63.48 -30.88 71.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.56 -34.39 62.93 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.882 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 mt -83.73 -34.81 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.517 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.678 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.8 mm -102.28 124.55 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -87.45 -33.27 19.1 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.392 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 75.26 68.79 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.738 0.304 . . . . 0.0 110.945 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.32 128.94 32.58 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.885 2.39 . . . . 0.0 112.692 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -152.18 141.32 21.32 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.036 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.35 162.7 31.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.789 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.407 ' HA ' HD12 ' A' ' 52' ' ' ILE . 0.0 OUTLIER -53.52 -39.89 65.01 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.716 179.628 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.7 t -64.14 -37.71 88.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.4 m -74.05 -36.49 64.37 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.297 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.65 HG23 ' OH ' ' A' ' 61' ' ' TYR . 9.6 mt -71.58 -44.3 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.859 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.582 ' HG2' HD21 ' A' ' 10' ' ' LEU . 3.9 mtpm? -64.21 -37.77 88.65 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 p -57.9 -38.76 76.41 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.372 0.13 . . . . 0.0 111.122 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -60.36 -48.25 82.55 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.5 tp -62.91 -34.98 78.57 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.468 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.17 -38.58 91.75 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.271 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.46 15.15 9.75 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 59.56 27.28 16.44 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.653 0.263 . . . . 0.0 111.504 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.67 -32.38 57.9 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.665 0.269 . . . . 0.0 110.594 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.65 ' OH ' HG23 ' A' ' 52' ' ' ILE . 4.7 m-85 -71.11 104.93 3.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.872 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -62.64 -30.77 71.61 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.96 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.99 172.48 11.43 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.764 0.316 . . . . 0.0 111.32 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.32 -17.58 64.29 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.589 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -62.82 -43.23 99.36 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.659 0.266 . . . . 0.0 110.507 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.89 -34.67 71.82 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.831 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.8 t80 -62.81 -53.38 55.12 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.073 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.21 -33.19 64.5 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.705 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.41 -44.88 86.03 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.529 0.204 . . . . 0.0 111.286 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -66.7 -30.76 71.08 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.343 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 67' ' ' PHE . 42.6 t -67.09 -47.33 82.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-O 120.692 0.282 . . . . 0.0 110.374 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -62.57 -41.29 98.83 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -47.63 83.53 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.724 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 12.8 tmm? -61.88 -45.98 91.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.893 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -61.92 -42.49 99.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.171 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.4 m -62.67 -42.8 99.81 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.147 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.678 ' HB3' HD12 ' A' ' 43' ' ' ILE . 2.6 m120 -73.86 -47.12 40.53 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.154 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.0 t -60.19 -37.39 80.06 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.243 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -60.72 -33.12 72.42 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.019 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -61.52 -35.69 78.44 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.728 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -85.53 -34.02 21.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.356 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.506 ' HB3' HG22 ' A' ' 89' ' ' VAL . 23.0 m-20 -56.76 111.67 3.59 Favored Pre-proline 0 N--CA 1.466 0.365 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.107 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.687 ' O ' HG21 ' A' ' 89' ' ' VAL . 50.0 Cg_exo -56.46 154.17 31.35 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.803 2.335 . . . . 0.0 112.654 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.0 136.22 24.49 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.569 2.179 . . . . 0.0 112.516 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.63 55.45 4.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.419 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.774 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.9 t-80 -121.79 148.62 44.44 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.7 -44.09 81.17 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.308 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.7 m -61.57 -33.17 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.384 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.774 HG23 ' HB3' ' A' ' 86' ' ' HIS . 25.4 t -65.5 -44.47 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.781 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.76 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.2 mtp -65.79 -42.37 90.81 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.73 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.5 -47.69 84.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.489 ' HD2' HG12 ' A' ' 89' ' ' VAL . 8.2 mtp180 -59.71 -44.14 93.83 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.809 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -41.97 91.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.721 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 80.3 mt -65.15 -34.43 78.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.184 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -69.12 -43.92 73.42 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.631 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.41 -47.08 83.48 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.162 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.69 -42.96 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.012 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -63.57 -50.91 67.62 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.817 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -44.29 93.57 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.019 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -48.11 83.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.023 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -42.67 86.28 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.404 ' O ' ' HG3' ' A' ' 106' ' ' MET . 0.5 OUTLIER -62.64 -46.95 85.88 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.017 179.791 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.79 81.93 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.25 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -43.58 65.44 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.368 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -69.7 -34.12 73.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.76 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.01 -42.08 15.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.615 0.245 . . . . 0.0 111.069 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 . . . . . 0 C--O 1.252 1.189 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.586 179.94 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.631 0.253 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -59.82 -36.33 76.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.931 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.459 HD22 HH21 ' A' ' 59' ' ' ARG . 13.8 mt -58.74 -46.74 86.72 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.9 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.07 -37.46 75.5 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.086 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -40.29 96.72 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.031 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.76 -37.76 79.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.914 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.6 t -58.07 -38.53 76.52 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.998 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -45.31 95.77 Favored Glycine 0 C--N 1.336 0.535 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.379 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -64.14 -42.97 97.23 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.77 0.319 . . . . 0.0 110.357 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.598 HD13 ' HE2' ' A' ' 53' ' ' LYS . 10.2 mt -62.37 -35.61 79.7 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.706 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -28.77 64.78 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.806 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.48 -37.12 74.87 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.587 0.232 . . . . 0.0 111.006 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -37.02 78.12 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.609 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.25 21.63 15.59 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -113.47 18.8 17.41 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.717 0.294 . . . . 0.0 111.506 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.47 28.59 4.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.246 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -117.21 -31.93 5.16 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.394 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.573 ' CE1' ' HG ' ' A' ' 95' ' ' LEU . 2.7 t-80 -148.58 30.49 0.82 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 110.832 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.81 -40.93 54.09 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.121 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.27 -37.13 74.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.119 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.442 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 25.4 m-85 -77.82 -34.17 52.13 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.435 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.588 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -103.34 20.91 16.9 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.413 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.93 -53.3 43.45 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-N 116.933 -0.121 . . . . 0.0 111.14 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.413 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 84.3 Cg_endo -78.36 -5.78 15.17 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.349 2.032 . . . . 0.0 112.907 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -106.36 37.79 2.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.645 0.26 . . . . 0.0 110.93 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -121.39 -58.09 1.8 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.954 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.65 145.62 92.67 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.888 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.96 -177.12 3.57 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.607 2.205 . . . . 0.0 112.679 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 29' ' ' VAL . 13.5 m -112.6 79.76 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.041 0.448 . . . . 0.0 111.172 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.588 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -58.94 104.35 0.23 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.968 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 36' ' ' LEU . 10.4 p -62.43 -39.8 85.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.548 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.26 -45.9 58.21 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.702 -0.227 . . . . 0.0 111.606 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.588 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.99 -48.48 44.56 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.318 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.0 mt -81.31 -21.48 39.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.59 58.41 5.42 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.458 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.558 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -130.92 75.93 1.69 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.898 0.38 . . . . 0.0 111.442 -179.835 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -6.16 45.15 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.741 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.28 -20.01 57.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.385 0.136 . . . . 0.0 111.291 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.18 -41.42 83.85 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.751 -0.204 . . . . 0.0 111.012 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -64.04 -40.35 96.11 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.652 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.62 -44.31 90.94 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.818 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.4 mt -71.82 -51.68 30.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.076 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 mt -128.11 104.12 11.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.915 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -59.36 -29.89 68.01 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.512 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -110.27 81.51 2.28 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 120.817 0.341 . . . . 0.0 110.615 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.21 139.03 37.73 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.668 2.246 . . . . 0.0 112.603 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.605 ' HB3' ' HE2' ' A' ' 74' ' ' MET . 8.7 tpp -149.56 138.56 21.18 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.245 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -136.75 164.42 28.31 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.722 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -52.43 -41.43 63.24 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.719 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.5 t -65.41 -38.85 91.17 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.781 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -71.43 -43.31 66.97 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.114 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.536 HG23 ' OH ' ' A' ' 61' ' ' TYR . 8.4 mt -65.14 -45.12 95.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.175 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.598 ' HE2' HD13 ' A' ' 10' ' ' LEU . 1.0 OUTLIER -65.24 -34.68 78.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -57.56 -40.25 78.53 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.983 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -60.25 -47.65 85.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.851 0.358 . . . . 0.0 110.121 179.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.5 tp -66.97 -33.42 75.54 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.595 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -64.11 -41.52 97.22 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.402 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.23 15.15 9.39 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.459 HH21 HD22 ' A' ' 3' ' ' LEU . 1.5 mmp_? 58.96 27.85 16.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.588 0.233 . . . . 0.0 111.394 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.9 -32.83 45.9 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.63 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.536 ' OH ' HG23 ' A' ' 52' ' ' ILE . 1.8 m-85 -65.4 105.7 1.22 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.933 0.397 . . . . 0.0 110.844 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -32.16 70.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -162.97 165.28 25.15 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.87 0.367 . . . . 0.0 111.596 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -20.11 64.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.267 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -62.78 -41.51 99.28 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 110.27 -0.271 . . . . 0.0 110.27 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -69.68 -34.18 73.6 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.887 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.448 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.1 t80 -59.2 -53.64 55.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.96 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.73 -35.94 90.77 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.373 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.67 -36.65 79.27 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -76.64 -38.99 53.72 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.167 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 67' ' ' PHE . 44.6 t -67.04 -47.75 81.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.948 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -59.28 -33.73 71.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.591 0.234 . . . . 0.0 110.789 179.49 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 tt -71.87 -42.1 67.26 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.473 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.605 ' HE2' ' HB3' ' A' ' 47' ' ' MET . 9.8 tpp -60.29 -46.6 89.27 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.197 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -55.71 -40.67 72.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.147 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.2 t -67.78 -41.81 82.65 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.014 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.41 -37.64 65.85 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.393 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -35.96 73.14 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.643 0.259 . . . . 0.0 111.073 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.85 -31.78 68.83 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.193 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.12 -36.03 80.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.748 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -35.94 22.27 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.06 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.838 ' HB3' HG22 ' A' ' 89' ' ' VAL . 15.8 m-20 -67.52 125.66 91.49 Favored Pre-proline 0 N--CA 1.466 0.325 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.071 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.719 ' O ' HG21 ' A' ' 89' ' ' VAL . 52.1 Cg_exo -54.92 158.5 11.04 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.981 2.454 . . . . 0.0 112.86 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -74.57 118.69 5.43 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.596 2.197 . . . . 0.0 112.478 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t0 62.57 70.58 0.56 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.071 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.733 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.0 t-160 -132.53 156.69 46.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.302 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -57.09 -44.28 83.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.186 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.9 m -64.39 -31.88 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.753 0.311 . . . . 0.0 111.141 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.838 HG22 ' HB3' ' A' ' 82' ' ' ASN . 25.8 t -65.73 -40.32 87.46 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.413 ' HA ' ' HD3' ' A' ' 93' ' ' ARG . . . -57.43 -34.42 68.92 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.918 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -33.04 73.81 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.73 66.01 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -68.1 -38.52 82.39 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.856 179.742 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.442 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -61.28 -44.98 96.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.78 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 22' ' ' ALA . 0.3 OUTLIER -66.14 -34.83 78.93 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.746 179.551 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -69.96 -41.65 74.22 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.593 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.38 -46.82 88.56 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.063 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.2 p -66.17 -42.92 92.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.898 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.88 -49.82 71.2 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.7 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.51 -40.97 98.43 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.85 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -47.75 84.54 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.68 0.276 . . . . 0.0 110.663 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -43.68 80.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.633 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -45.47 92.37 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.858 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.27 -42.56 95.65 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -70.24 -36.19 74.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.755 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -40.53 76.32 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.029 179.184 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.67 -42.55 17.99 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -178.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.45 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 . . . . . 0 N--CA 1.488 1.434 0 CA-C-O 120.706 0.289 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.8 -36.87 85.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.866 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.65 -44.14 96.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.845 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -67.86 -39.39 83.76 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.936 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.64 95.56 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.013 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.429 ' HA ' HD12 ' A' ' 9' ' ' ILE . 94.5 m -59.42 -37.24 77.55 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.786 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 m -55.05 -34.13 63.3 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.266 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.78 -47.4 91.15 Favored Glycine 0 C--N 1.337 0.614 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.399 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.1 mt -64.02 -46.64 93.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.791 0.329 . . . . 0.0 110.317 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.534 HD23 ' HG2' ' A' ' 53' ' ' LYS . 1.2 tp -63.02 -35.67 81.0 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.634 179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.47 -27.49 64.45 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.485 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.497 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -58.46 -36.54 73.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.359 0.123 . . . . 0.0 111.014 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.0 mtm -57.85 -37.23 73.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.721 0.295 . . . . 0.0 110.371 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.84 8.16 32.61 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.695 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.497 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.32 14.48 18.24 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.561 0.22 . . . . 0.0 111.48 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 68.53 32.24 4.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.984 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.2 mttm -123.17 -37.79 2.66 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -119.34 18.23 12.95 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.321 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.27 -29.98 48.28 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.278 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.61 -37.64 76.96 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.863 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.412 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 2.8 m-85 -80.16 -33.93 38.0 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.429 ' HB1' ' CE ' ' A' ' 49' ' ' MET . . . -98.07 19.38 14.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.881 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.48 -51.34 68.05 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 121.405 -0.118 . . . . 0.0 111.055 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.23 -23.2 75.2 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.614 2.209 . . . . 0.0 112.806 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -123.87 34.64 5.02 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.927 0.394 . . . . 0.0 110.542 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -76.95 -46.84 22.73 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.776 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 166.6 11.59 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.842 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.22 -171.41 0.7 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.63 2.22 . . . . 0.0 112.436 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.47 HG11 ' CE2' ' A' ' 39' ' ' TYR . 5.7 m -113.18 76.35 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.045 0.45 . . . . 0.0 111.275 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -60.1 98.56 0.06 Allowed 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.1 p -60.54 -38.65 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.833 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -72.12 -46.88 54.9 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.52 -48.34 41.18 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.5 mt -80.81 -21.5 40.83 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.15 52.13 47.04 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.35 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.47 71.66 0.85 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.05 0.452 . . . . 0.0 111.288 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -67.17 -14.85 63.3 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.477 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.17 -19.76 58.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.401 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.47 ' CE2' HG11 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -61.28 -39.07 89.04 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 116.74 -0.209 . . . . 0.0 111.056 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -37.9 86.44 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.773 0.32 . . . . 0.0 110.561 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -67.48 -41.73 84.12 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.917 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 18.0 mt -77.71 -54.77 11.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.239 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.811 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.3 mm -100.95 104.74 16.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.082 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -66.95 -27.3 67.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.486 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.67 72.38 78.14 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.698 0.285 . . . . 0.0 110.802 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -58.0 132.17 47.94 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.359 . . . . 0.0 112.489 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -158.42 127.63 5.66 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.31 170.81 9.92 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.931 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.616 ' HA ' HD12 ' A' ' 52' ' ' ILE . 18.2 ttm -55.73 -36.56 67.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.895 0.379 . . . . 0.0 110.182 179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.0 t -62.13 -38.93 90.81 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.677 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 m -73.29 -36.29 66.28 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.105 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 49' ' ' MET . 23.4 mt -66.51 -44.78 90.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.627 0.251 . . . . 0.0 110.981 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.534 ' HG2' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -66.24 -35.33 80.15 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.154 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.6 p -57.47 -41.14 80.03 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.472 0.177 . . . . 0.0 111.13 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -46.55 88.78 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.74 -34.73 78.49 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.775 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.38 -41.41 93.73 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.4 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.494 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . . . -90.66 15.28 11.3 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.31 27.55 16.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.649 0.261 . . . . 0.0 111.498 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 34.5 mt-10 -73.32 -32.74 64.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.743 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.468 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 4.6 m-85 -69.04 103.93 1.99 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.781 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -63.21 -29.39 70.74 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.476 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -166.41 179.68 5.44 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.904 0.383 . . . . 0.0 111.567 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.77 -20.94 61.08 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.409 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.86 -45.99 89.98 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.674 0.273 . . . . 0.0 110.327 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.76 -30.14 69.52 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.797 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.468 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -59.85 -49.74 76.53 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.595 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.92 -33.11 77.22 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.513 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.73 -35.87 75.44 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.567 0.222 . . . . 0.0 111.17 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.3 61.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.811 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.7 t -64.82 -48.32 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.081 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -33.75 74.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.031 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.3 tp -70.69 -47.06 61.79 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.62 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.7 ttp -60.49 -43.83 96.58 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.411 ' CE2' ' HB2' ' A' ' 96' ' ' GLN . 3.2 m-85 -58.43 -43.51 88.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 t -59.27 -45.54 90.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.735 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.811 ' HB3' HD12 ' A' ' 43' ' ' ILE . 58.9 m-20 -70.48 -39.92 73.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.724 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -42.5 91.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.106 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -58.12 -39.77 79.55 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.132 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.85 -45.65 73.99 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.978 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -72.17 -39.84 68.39 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.197 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.659 ' HB3' HG22 ' A' ' 89' ' ' VAL . 82.6 m-20 -67.9 125.25 91.15 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.187 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.684 ' O ' HG21 ' A' ' 89' ' ' VAL . 53.4 Cg_endo -69.32 164.46 34.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.714 2.276 . . . . 0.0 112.428 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.38 128.91 11.55 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.562 2.175 . . . . 0.0 112.585 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.8 t0 60.2 68.07 0.8 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.0 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.662 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-80 -131.63 157.8 42.73 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.28 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.33 -44.31 84.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.039 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.8 m -64.17 -32.87 59.13 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.163 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.684 HG21 ' O ' ' A' ' 83' ' ' PRO . 23.9 t -68.74 -44.62 82.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.31 73.2 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.884 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 42.1 mtt -66.07 -40.27 90.75 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.87 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.36 90.21 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -49.12 79.05 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.412 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.1 tttm -66.57 -39.21 88.36 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.891 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -35.16 76.47 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.411 ' HB2' ' CE2' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -68.98 -44.58 72.6 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.739 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.51 -46.71 84.83 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.28 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.616 HG23 ' NH1' ' A' ' 102' ' ' ARG . 9.3 p -62.22 -43.13 97.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.14 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -49.65 70.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.669 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -42.92 99.75 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -48.01 83.36 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.996 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.616 ' NH1' HG23 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -67.23 -44.27 79.9 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.912 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -59.83 -48.67 80.76 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.856 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.87 -37.59 84.72 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.521 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -72.1 -44.21 63.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 1.3 tmm? -67.03 -45.09 78.54 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.382 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -40.14 35.63 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.891 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.411 -179.666 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 120.744 0.307 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -59.58 -42.56 92.77 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.769 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.489 HD21 ' O ' ' A' ' 61' ' ' TYR . 5.8 mt -64.78 -46.11 83.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.813 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -33.6 74.01 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.954 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.57 -43.38 85.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.674 0.273 . . . . 0.0 110.724 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.591 ' HA ' HD12 ' A' ' 9' ' ' ILE . 93.9 m -62.55 -40.77 97.88 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.464 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -36.08 75.21 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.057 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.29 91.89 Favored Glycine 0 C--N 1.335 0.52 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.359 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mt -65.52 -47.51 86.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.705 0.288 . . . . 0.0 110.502 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.26 -35.61 80.92 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.16 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mttp -57.96 -31.14 66.58 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.229 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.433 ' CG ' ' HD3' ' A' ' 17' ' ' LYS . 4.3 tt0 -59.65 -38.07 80.42 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.502 0.192 . . . . 0.0 110.985 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.403 ' HA ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -61.67 -38.12 86.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.727 0.299 . . . . 0.0 110.484 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -96.35 -1.74 47.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.609 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.6 9.83 22.64 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 75.65 20.85 1.79 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.612 0.365 . . . . 0.0 111.335 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 9.8 mtpt -108.73 -38.94 5.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.32 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.472 ' NE2' HG11 ' A' ' 98' ' ' VAL . 6.6 m-70 -121.44 16.35 11.3 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.289 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.08 -32.42 59.25 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.336 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.75 96.03 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.738 0.304 . . . . 0.0 111.039 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -72.84 -36.32 67.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.906 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.29 24.89 10.82 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.498 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.469 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.41 -57.73 16.34 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.388 -179.647 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 24.5 Cg_endo -62.01 -17.15 54.41 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.372 2.048 . . . . 0.0 113.002 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.37 35.51 3.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 111.08 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.99 -35.61 37.2 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.633 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HB2' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -119.63 156.64 53.44 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.369 -179.759 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.426 ' HD2' ' HB2' ' A' ' 27' ' ' LYS . 29.6 Cg_endo -63.19 -178.55 0.46 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.902 2.402 . . . . 0.0 112.714 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.7 m -114.89 86.69 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.13 0.491 . . . . 0.0 111.156 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.44 103.56 0.25 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.713 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 36' ' ' LEU . 12.2 p -59.71 -40.94 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.14 -46.05 58.05 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.01 48.77 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 mt -81.91 -21.57 37.27 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.29 64.27 2.94 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.566 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.525 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -134.53 79.46 1.8 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.313 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -10.26 59.29 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.662 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -76.23 -19.64 58.18 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.418 0.151 . . . . 0.0 111.34 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.405 ' CZ ' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -57.75 -34.71 69.82 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.508 0.194 . . . . 0.0 111.141 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 35.2 t -65.21 -37.45 87.34 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.83 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -75.83 -43.41 46.08 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.213 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.7 mt -74.12 -61.6 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.279 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.405 HG13 ' CZ ' ' A' ' 39' ' ' TYR . 30.8 mm -90.96 106.62 17.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.28 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 pttp -66.14 -33.69 76.36 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -124.71 94.38 44.5 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.708 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.22 110.97 2.13 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.679 2.253 . . . . 0.0 112.364 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.7 tpp -144.21 133.32 22.88 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.68 163.57 27.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.184 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.611 ' HA ' HD12 ' A' ' 52' ' ' ILE . 67.6 mtt -54.72 -38.25 66.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.928 -179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 t -62.36 -38.15 88.42 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.604 0.24 . . . . 0.0 110.824 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 91.3 m -74.17 -39.84 62.95 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.993 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 49' ' ' MET . 9.2 mt -65.35 -45.08 94.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 120.574 0.226 . . . . 0.0 111.07 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -36.51 83.28 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.9 t -57.72 -39.43 77.26 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.917 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -49.57 77.07 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.8 tp -61.16 -34.08 74.46 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.468 179.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -65.29 -37.34 86.86 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.118 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.77 15.27 8.56 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 60.83 27.25 17.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.624 0.25 . . . . 0.0 111.546 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -34.21 53.85 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.803 0.335 . . . . 0.0 110.583 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.489 ' O ' HD21 ' A' ' 3' ' ' LEU . 6.0 m-85 -78.78 107.29 11.38 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.797 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -92.16 -27.38 17.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.222 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -139.15 164.06 30.78 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.894 0.378 . . . . 0.0 111.64 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.73 -18.63 60.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.509 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -45.2 93.73 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.593 0.235 . . . . 0.0 110.457 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -70.49 -36.81 74.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.705 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.449 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 5.6 t80 -63.98 -53.81 44.31 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.901 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.12 -31.51 77.04 Favored Glycine 0 C--N 1.334 0.461 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.661 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.77 94.65 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 111.446 0.165 . . . . 0.0 111.446 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.91 -39.12 83.63 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.401 HG21 ' CZ ' ' A' ' 99' ' ' PHE . 21.8 t -65.2 -48.22 84.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.972 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -64.83 -34.07 77.49 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.145 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -47.81 84.35 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.876 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -60.54 -41.02 93.63 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.949 179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -58.23 -46.36 86.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.93 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.7 m -63.33 -42.03 98.93 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.765 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.3 m-20 -69.27 -34.17 74.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.885 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.07 -33.77 73.86 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.262 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -60.65 -34.21 73.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.095 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.35 -41.25 73.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.853 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.55 -34.98 46.73 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.306 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -92.28 111.83 52.29 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.267 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -66.64 156.44 65.69 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.753 2.302 . . . . 0.0 112.312 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -66.95 154.66 73.89 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.58 2.187 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.67 37.75 15.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.187 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.479 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.8 OUTLIER -120.04 150.34 40.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.156 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -44.02 85.33 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.7 p -56.76 -36.33 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.554 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.479 HG23 ' HB3' ' A' ' 86' ' ' HIS . 15.6 t -61.04 -44.48 98.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.659 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.65 -36.63 72.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.048 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.4 mtp -62.54 -44.14 97.07 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.898 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -40.66 96.9 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.319 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -47.96 82.76 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.716 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -62.83 -41.59 99.39 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.98 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -37.47 82.91 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.899 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -70.05 -41.83 73.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.656 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.67 -46.95 88.4 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.171 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.472 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.2 p -68.0 -42.92 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.195 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.401 ' CZ ' HG21 ' A' ' 71' ' ' VAL . 5.7 t80 -64.4 -51.54 62.72 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.569 0.223 . . . . 0.0 110.777 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -60.62 -44.09 96.74 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.075 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 4.7 mtp -60.09 -46.73 88.6 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.987 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.08 77.81 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.147 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -42.92 95.97 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.614 -0.267 . . . . 0.0 110.887 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.98 -32.77 73.41 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.91 -44.22 70.11 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.795 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.0 ptm -69.38 -34.67 74.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.359 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.09 -42.38 17.48 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.074 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.731 0.3 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -62.08 -43.84 97.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.901 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.41 HD22 ' O ' ' A' ' 61' ' ' TYR . 0.8 OUTLIER -58.87 -36.83 75.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.092 179.33 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -61.47 -34.79 76.05 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.956 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 47.7 t -62.38 -39.21 92.45 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.881 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.4 m -59.68 -38.57 81.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.881 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.2 t -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.75 -38.09 93.37 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.37 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.2 mt -66.68 -45.86 87.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-O 120.748 0.308 . . . . 0.0 110.38 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.52 80.32 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.802 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mtpp -58.38 -28.2 64.94 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.712 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -58.71 -36.45 74.27 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.585 0.231 . . . . 0.0 110.68 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.462 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 6.6 mtt -59.56 -37.23 77.89 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.556 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.67 1.9 38.1 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.22 19.5 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.647 0.26 . . . . 0.0 111.637 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 mmtt 68.62 28.59 5.72 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.304 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.2 mttt -116.1 -31.25 5.75 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.967 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 29.95 1.3 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.801 0.334 . . . . 0.0 110.805 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -78.15 -36.63 47.42 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.123 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.35 -31.36 69.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.264 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 23.8 m-85 -86.23 -29.81 22.86 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.584 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.646 ' HB2' HD21 ' A' ' 95' ' ' LEU . . . -113.24 23.25 13.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.584 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.5 t90 -62.77 -53.91 52.05 Favored Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 122.481 -0.137 . . . . 0.0 110.913 179.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 92.4 Cg_endo -83.94 -16.77 6.2 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.634 2.223 . . . . 0.0 113.539 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -101.8 33.54 2.97 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.634 0.254 . . . . 0.0 111.61 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -107.27 -46.07 3.96 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.054 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -85.62 161.21 51.61 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.235 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -68.73 166.47 26.03 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.837 2.358 . . . . 0.0 112.743 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.561 HG21 ' CZ ' ' A' ' 39' ' ' TYR . 9.8 m -90.43 82.41 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.152 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . 66.4 m-20 -59.74 105.1 0.34 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.053 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 36' ' ' LEU . 12.3 p -61.37 -40.34 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.744 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -72.22 -45.06 61.82 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . . . -71.27 -48.43 51.02 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.432 HD13 HD21 ' A' ' 36' ' ' LEU . 12.1 mt -80.75 -21.74 40.81 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.26 52.19 18.81 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.476 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.432 HD21 HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -128.17 75.74 1.64 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.97 0.414 . . . . 0.0 111.346 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.26 -11.47 60.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.409 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -17.42 59.45 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.458 0.169 . . . . 0.0 111.458 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.561 ' CZ ' HG21 ' A' ' 29' ' ' VAL . 11.5 t80 -55.79 -39.53 71.4 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.501 0.191 . . . . 0.0 111.129 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.37 -36.51 83.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.678 0.275 . . . . 0.0 110.65 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.78 -45.02 46.45 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.407 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.9 mt -75.4 -52.97 17.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.706 0.288 . . . . 0.0 111.427 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.412 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.1 mm -92.2 104.85 16.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.154 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -72.1 -34.15 68.4 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.365 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -114.37 92.37 27.55 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.83 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.34 128.4 18.29 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.677 2.252 . . . . 0.0 112.563 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.86 139.98 14.25 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.384 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.1 164.03 32.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.283 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.817 ' HA ' HD12 ' A' ' 52' ' ' ILE . 5.7 mtt -58.05 -36.48 72.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.909 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.0 t -61.8 -34.69 76.37 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.63 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.45 -36.47 63.35 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.175 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.817 HD12 ' HA ' ' A' ' 49' ' ' MET . 7.7 mt -68.65 -44.62 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-O 120.676 0.274 . . . . 0.0 110.828 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -62.59 -45.37 93.23 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.203 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 p -57.59 -39.12 76.08 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.806 -0.179 . . . . 0.0 110.875 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.427 ' HD3' ' CZ ' ' A' ' 61' ' ' TYR . 20.2 tttp -60.35 -48.66 80.77 Favored 'General case' 0 N--CA 1.462 0.137 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -35.5 81.34 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.318 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.32 -37.34 86.88 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.279 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.04 15.23 7.62 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.79 27.42 17.2 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.281 0.232 . . . . 0.0 111.597 -179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -80.84 -34.53 33.76 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.725 0.297 . . . . 0.0 110.674 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.427 ' CZ ' ' HD3' ' A' ' 55' ' ' LYS . 3.3 m-85 -77.4 93.37 4.06 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.489 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.0 mtt85 -65.42 -28.87 69.55 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.808 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -159.27 174.08 15.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.861 0.362 . . . . 0.0 111.366 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -10.39 59.68 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.888 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -62.99 -47.65 82.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.569 0.223 . . . . 0.0 110.614 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -72.97 -39.22 66.31 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.579 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.698 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.9 t80 -58.41 -53.7 55.31 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.27 -36.21 90.24 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.446 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.31 96.43 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.606 0.241 . . . . 0.0 110.986 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.98 -37.21 69.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.226 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 67' ' ' PHE . 22.7 t -64.11 -48.46 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.384 0.135 . . . . 0.0 111.272 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -64.7 -32.87 74.73 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.734 -0.212 . . . . 0.0 111.2 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -47.13 74.73 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.806 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttm -59.3 -44.34 92.53 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.228 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -58.01 -42.26 84.86 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.046 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.06 -45.47 90.7 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.93 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.412 ' HB3' HD12 ' A' ' 43' ' ' ILE . 46.5 m-20 -74.73 -33.09 62.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.121 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -39.29 79.69 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.985 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -64.56 -32.18 73.72 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -67.88 -36.46 80.29 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.801 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -82.39 -38.15 24.53 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.333 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.879 ' HB3' HG22 ' A' ' 89' ' ' VAL . 42.2 m-20 -63.56 111.12 4.55 Favored Pre-proline 0 N--CA 1.466 0.357 0 CA-C-N 116.64 -0.254 . . . . 0.0 111.21 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.496 ' O ' HG21 ' A' ' 89' ' ' VAL . 23.6 Cg_exo -64.62 145.91 87.94 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.941 2.427 . . . . 0.0 112.513 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 43.8 Cg_exo -56.14 135.96 72.65 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.662 2.241 . . . . 0.0 112.384 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 t70 60.27 60.04 2.15 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.754 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.3 t-80 -130.66 151.93 50.57 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.94 -43.97 86.65 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.158 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -62.51 -32.15 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.599 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.879 HG22 ' HB3' ' A' ' 82' ' ' ASN . 34.5 t -62.77 -45.36 99.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.695 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -41.2 86.69 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.603 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.2 mtt -65.74 -43.39 89.13 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.745 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.58 -47.74 78.9 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.212 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -63.01 -48.92 76.71 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.829 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.434 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 36.0 tttp -62.48 -41.52 98.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.822 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.646 HD21 ' HB2' ' A' ' 22' ' ' ALA . 1.6 mt -63.47 -36.09 82.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.695 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -70.06 -44.28 69.47 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.765 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.17 -46.81 88.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.239 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.6 p -64.73 -42.77 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.922 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -51.32 62.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.436 0.16 . . . . 0.0 110.787 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -46.25 87.83 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.998 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -46.28 90.26 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.839 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -67.07 -43.98 81.24 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.822 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.14 -42.47 94.89 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.82 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.58 -32.84 74.65 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -71.52 -44.17 65.14 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.084 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 4.7 ptm -69.28 -36.06 76.68 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.322 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.5 -41.56 21.53 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.747 -0.206 . . . . 0.0 110.863 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.987 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.744 0.307 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -61.38 -43.44 98.86 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.856 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.99 -40.54 95.1 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.725 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.04 -34.6 78.44 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.144 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.62 -38.15 86.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.737 0.303 . . . . 0.0 110.775 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.0 m -64.52 -37.37 87.31 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.314 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.0 p -58.5 -40.99 84.36 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.7 -0.227 . . . . 0.0 111.147 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -63.07 -45.87 94.58 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.073 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.2 mt -64.28 -45.56 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 120.718 0.294 . . . . 0.0 110.29 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.692 HD22 ' HE3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -63.34 -35.53 80.69 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.641 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -58.15 -27.88 64.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.443 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -58.31 -36.33 73.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.406 0.146 . . . . 0.0 110.859 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.9 mmt -57.46 -37.54 73.03 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.499 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.92 10.78 28.39 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.65 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -91.46 11.21 24.71 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 75.2 26.9 1.16 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 122.578 0.351 . . . . 0.0 111.196 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -121.51 -34.89 3.35 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.455 ' CE1' ' HG ' ' A' ' 95' ' ' LEU . 0.7 OUTLIER -132.83 22.82 4.23 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.622 0.249 . . . . 0.0 111.016 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.97 -36.2 72.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.992 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.34 -36.41 66.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.215 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -75.84 -35.36 59.98 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.39 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB2' HD21 ' A' ' 95' ' ' LEU . . . -106.57 23.49 14.15 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -54.59 5.35 Favored Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 116.923 -0.126 . . . . 0.0 111.244 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -85.59 12.6 3.0 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.621 2.214 . . . . 0.0 113.23 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -130.53 56.13 1.78 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.03 0.443 . . . . 0.0 110.785 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.19 -48.82 1.0 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.051 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -64.77 154.08 86.38 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-O 120.599 0.238 . . . . 0.0 111.07 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.72 179.12 6.81 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.851 2.368 . . . . 0.0 112.737 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.7 m -92.57 68.9 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.018 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -59.49 98.97 0.05 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.067 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.11 -37.1 77.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.749 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.11 -45.83 59.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.584 0.216 . . . . 0.0 111.584 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.61 -47.71 45.58 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -80.94 -21.56 40.35 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.65 50.35 49.26 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.385 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -121.33 63.2 0.89 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.438 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -62.25 -18.2 60.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.448 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -76.06 -19.72 58.36 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.58 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -54.81 -39.11 68.14 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.617 0.246 . . . . 0.0 110.939 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -65.04 -40.44 94.81 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.8 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.46 -43.13 91.32 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.31 -45.4 75.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.965 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.516 HD13 ' HB2' ' A' ' 77' ' ' ASN . 7.7 mt -127.45 111.7 25.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.951 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -72.25 -29.86 64.32 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.358 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -118.68 66.96 7.36 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 110.784 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.82 156.42 39.39 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.769 2.313 . . . . 0.0 112.546 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.8 tpp -158.89 160.34 36.01 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.17 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -148.21 166.06 29.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.51 -37.3 70.25 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -65.67 -41.33 92.59 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.401 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -65.04 -41.03 95.59 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.047 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.502 HG23 ' OH ' ' A' ' 61' ' ' TYR . 18.0 mt -67.57 -44.9 86.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.9 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.692 ' HE3' HD22 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -62.45 -34.85 77.62 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.979 179.673 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.5 t -57.55 -42.23 82.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.041 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.75 -48.02 83.66 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.797 0.332 . . . . 0.0 110.177 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.3 tp -64.7 -33.69 76.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.844 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.23 -41.49 98.46 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.415 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.84 15.24 10.17 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 59.11 27.39 16.35 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.651 0.263 . . . . 0.0 111.551 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.42 -32.22 58.36 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.706 0.289 . . . . 0.0 110.687 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.502 ' OH ' HG23 ' A' ' 52' ' ' ILE . 1.8 m-85 -71.02 100.19 1.95 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.3 ttp85 -63.42 -31.54 72.72 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.141 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -162.65 174.56 12.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.826 0.346 . . . . 0.0 111.42 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.53 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -69.83 -14.55 62.81 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.885 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -46.61 87.51 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.663 0.268 . . . . 0.0 110.394 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.68 -35.48 72.83 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.013 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.412 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 3.3 t80 -61.88 -52.07 65.61 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -56.41 -33.36 61.85 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.631 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.51 96.01 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.562 0.22 . . . . 0.0 111.165 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.402 ' HB3' HG12 ' A' ' 52' ' ' ILE . 1.1 m-20 -63.55 -36.68 84.58 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.423 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -63.06 -48.39 88.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 120.713 0.292 . . . . 0.0 110.789 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.1 mmp_? -64.96 -40.15 94.56 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.621 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -41.88 95.32 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.753 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.1 ttp -62.71 -46.61 87.3 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.556 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -36.21 74.15 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 38.5 m -60.57 -47.48 86.01 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.044 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.516 ' HB2' HD13 ' A' ' 43' ' ' ILE . 12.2 p30 -75.99 -31.55 59.02 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 121.096 -0.242 . . . . 0.0 111.07 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.28 -33.58 76.15 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.219 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.53 -37.29 75.35 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.534 0.207 . . . . 0.0 111.28 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -72.61 -39.71 67.07 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -78.24 -38.48 42.86 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.721 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -62.53 128.13 91.08 Favored Pre-proline 0 N--CA 1.465 0.295 0 CA-C-O 120.554 0.216 . . . . 0.0 111.073 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.461 ' O ' HG21 ' A' ' 89' ' ' VAL . 72.6 Cg_endo -76.68 135.5 16.14 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.602 2.201 . . . . 0.0 112.392 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 36.8 Cg_exo -57.39 128.16 28.4 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.741 2.294 . . . . 0.0 112.406 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.0 t0 65.53 71.7 0.43 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.154 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.74 ' HB3' HG23 ' A' ' 89' ' ' VAL . 7.6 t-160 -141.65 148.21 38.78 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.077 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -56.6 -43.08 79.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.364 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.449 HG22 ' ND1' ' A' ' 86' ' ' HIS . 26.8 m -62.06 -35.74 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.13 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.74 HG23 ' HB3' ' A' ' 86' ' ' HIS . 30.0 t -66.4 -45.15 90.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.836 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.94 -39.04 80.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.814 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 24.8 mtt -63.05 -43.29 99.04 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.728 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.52 -48.61 80.25 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.5 mpp_? -54.62 -44.07 72.82 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.679 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -37.95 89.28 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.737 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.455 ' HG ' ' CE1' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -61.7 -37.26 83.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.972 179.571 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.03 -43.98 73.64 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.034 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.64 -46.59 89.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.34 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.53 -42.77 93.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.079 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.17 -50.32 66.39 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.913 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.55 -43.53 93.5 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.986 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -47.47 85.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.777 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? -67.86 -39.29 83.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.913 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.53 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 0.2 OUTLIER -65.3 -41.61 93.92 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.103 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.28 -32.91 74.81 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.284 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.4 tttp -69.72 -44.54 70.12 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.064 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 8.5 ptm -69.13 -33.38 73.36 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.089 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 12.9 mt -83.75 -41.55 17.5 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.273 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.052 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.684 0.278 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -61.67 -37.57 84.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.846 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.652 HD21 ' O ' ' A' ' 61' ' ' TYR . 3.7 mt -63.58 -46.91 83.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.065 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.19 -42.16 96.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.91 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.54 -44.35 96.57 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.586 ' HA ' HD12 ' A' ' 9' ' ' ILE . 34.5 m -58.96 -39.51 81.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.745 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 33.1 t -57.54 -41.13 80.33 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.055 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.12 94.46 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.578 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.586 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.2 mt -64.12 -46.25 94.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.719 0.295 . . . . 0.0 110.459 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.6 HD13 ' HG2' ' A' ' 53' ' ' LYS . 5.7 mt -62.75 -35.83 81.08 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.714 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -33.45 69.31 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.333 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 1.4 tt0 -58.55 -36.65 74.24 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.212 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.45 -36.98 72.11 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.431 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.67 12.62 22.6 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.478 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -96.71 17.86 15.6 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.724 0.297 . . . . 0.0 111.307 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 72.21 25.25 2.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.372 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 15.4 mtmt -118.69 -34.33 4.01 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.09 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.449 ' NE2' HG11 ' A' ' 98' ' ' VAL . 1.3 m-70 -132.42 21.72 4.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.001 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.8 -34.69 67.06 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.448 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.05 -40.28 68.45 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.744 0.306 . . . . 0.0 111.09 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -73.51 -34.21 65.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -111.62 28.69 8.51 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.483 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -68.33 -52.16 22.28 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.19 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.4 Cg_endo -85.5 11.15 3.44 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.554 2.17 . . . . 0.0 113.02 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -129.93 55.34 1.79 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.03 0.443 . . . . 0.0 110.825 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.86 -63.95 0.56 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.004 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 0.1 OUTLIER -65.74 143.41 98.55 Favored Pre-proline 0 CA--C 1.531 0.241 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.834 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 46.5 Cg_exo -57.31 156.66 24.65 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.91 2.407 . . . . 0.0 112.864 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.1 m -95.32 84.09 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.037 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.5 106.56 0.79 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.028 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.7 p -61.46 -38.42 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.621 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.3 -44.44 62.73 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.611 0.243 . . . . 0.0 111.483 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.73 43.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.3 mt -81.12 -21.54 39.79 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 57.19 7.37 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.424 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.423 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -126.34 64.04 1.25 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.04 0.448 . . . . 0.0 111.303 -179.83 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -67.63 -13.06 61.76 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.67 179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.23 -20.08 57.77 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.404 0.145 . . . . 0.0 111.237 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.511 ' CE1' HD13 ' A' ' 43' ' ' ILE . 1.0 OUTLIER -59.66 -35.65 74.85 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.557 0.218 . . . . 0.0 110.764 179.351 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.8 t -64.51 -38.68 91.85 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.947 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -67.18 -39.57 86.42 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.571 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.474 HD12 ' CE2' ' A' ' 81' ' ' TYR . 42.8 mt -74.13 -44.58 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.991 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.511 HD13 ' CE1' ' A' ' 39' ' ' TYR . 3.5 mp -137.82 137.01 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.656 0.265 . . . . 0.0 111.457 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -93.04 -25.45 17.94 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.804 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.91 79.82 2.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.71 153.77 38.74 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.707 2.271 . . . . 0.0 112.697 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.424 ' HB3' ' HG2' ' A' ' 74' ' ' MET . 5.6 ttm -165.64 158.87 15.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.362 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -144.28 163.95 32.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.565 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.6 ttm -54.98 -35.44 64.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.849 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 t -66.88 -40.94 87.93 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.747 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.7 m -66.83 -40.77 88.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.411 HD13 HG22 ' A' ' 71' ' ' VAL . 60.5 mt -66.81 -44.06 89.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 CA-C-O 120.78 0.324 . . . . 0.0 110.395 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HG2' HD13 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -66.76 -36.61 82.84 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.326 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -42.31 82.25 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.432 0.16 . . . . 0.0 111.432 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -62.72 -49.55 74.6 Favored 'General case' 0 N--CA 1.461 0.102 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.8 -34.75 76.46 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.585 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -59.44 -40.58 87.24 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.05 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.67 15.34 11.2 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.19 28.37 14.01 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.303 0.241 . . . . 0.0 111.636 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -75.45 -37.35 60.39 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.678 0.275 . . . . 0.0 110.84 179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.652 ' O ' HD21 ' A' ' 3' ' ' LEU . 7.1 m-85 -75.88 97.46 3.95 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.542 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -78.12 -31.85 50.11 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -126.55 142.59 51.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.816 0.341 . . . . 0.0 111.105 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.03 -19.36 64.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.844 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -47.98 80.85 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.677 0.275 . . . . 0.0 110.543 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -62.31 -38.26 88.75 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.777 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.465 ' HZ ' HD11 ' A' ' 10' ' ' LEU . 30.2 t80 -59.43 -53.85 53.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.88 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.78 87.74 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.711 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.2 74.72 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.571 0.224 . . . . 0.0 111.197 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.61 -39.93 64.2 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.312 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 67' ' ' PHE . 29.7 t -63.67 -48.41 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.683 0.278 . . . . 0.0 110.646 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -64.95 -39.1 92.98 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.755 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.81 -46.07 83.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.671 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.424 ' HG2' ' HB3' ' A' ' 47' ' ' MET . 4.8 tpp -65.49 -41.73 92.93 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.353 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -55.9 -44.96 78.73 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 110.752 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.6 t -62.2 -40.69 96.9 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.733 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.418 ' HB3' HG12 ' A' ' 43' ' ' ILE . 80.6 m-20 -68.03 -46.04 72.29 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.059 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.23 -35.48 79.03 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.465 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.38 -33.46 67.85 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.883 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.468 ' HD3' HG23 ' A' ' 42' ' ' ILE . 5.4 tttp -64.87 -36.74 85.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.584 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.474 ' CE2' HD12 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -80.93 -37.41 29.59 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.162 179.524 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.451 ' HB3' HG22 ' A' ' 89' ' ' VAL . 21.9 m120 -61.14 111.16 3.78 Favored Pre-proline 0 N--CA 1.469 0.486 0 CA-C-O 120.488 0.185 . . . . 0.0 111.076 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -61.46 163.81 16.95 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.859 2.373 . . . . 0.0 112.505 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.37 151.14 65.43 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.644 2.229 . . . . 0.0 112.401 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 53.22 49.29 20.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.408 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.717 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.9 t-80 -116.25 141.31 48.32 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.828 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -41.18 75.71 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.977 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 14.1 m -59.68 -32.79 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.578 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.717 HG23 ' HB3' ' A' ' 86' ' ' HIS . 32.9 t -65.71 -44.45 93.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.702 0.287 . . . . 0.0 110.574 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.32 93.87 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.876 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 11.8 mtt -61.28 -42.95 99.51 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.959 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.64 -44.66 81.5 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.269 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.68 -47.04 87.13 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -65.85 -40.22 91.5 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.2 mt -63.69 -38.79 92.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.962 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -70.16 -41.51 73.71 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.782 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -61.36 -46.86 88.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.143 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.449 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.3 p -66.06 -43.05 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.012 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -63.68 -50.14 70.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.722 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.9 -43.21 94.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.981 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -47.86 84.15 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.635 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -43.02 87.07 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.682 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.402 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.1 OUTLIER -59.64 -41.92 91.58 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.064 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.03 -37.08 80.95 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.907 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -67.07 -44.78 79.23 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.402 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 7.4 ptm -69.53 -33.46 72.83 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.256 179.588 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 19.1 mt -81.37 -42.1 20.97 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.356 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.406 179.834 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.762 0.315 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -66.62 -35.14 79.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.877 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.478 HD21 ' O ' ' A' ' 61' ' ' TYR . 11.1 mt -61.03 -44.48 97.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.78 179.407 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -35.21 70.85 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.116 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -39.3 84.33 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.653 0.264 . . . . 0.0 110.83 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.3 m -63.1 -37.74 88.41 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.34 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.1 p -57.39 -33.72 68.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.642 -0.253 . . . . 0.0 111.129 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.44 -43.05 97.77 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.325 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 48.9 mt -64.03 -42.45 95.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.915 0.388 . . . . 0.0 110.498 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.2 mt -63.74 -35.65 81.28 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.698 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -30.8 67.19 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.748 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.61 -36.72 74.48 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.296 0.093 . . . . 0.0 111.173 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -37.63 76.29 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.651 0.262 . . . . 0.0 110.492 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.08 6.45 35.93 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.47 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.486 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -91.04 13.67 16.14 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.566 0.222 . . . . 0.0 111.515 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 72.64 23.44 3.01 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.474 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.9 mtmm -115.33 -33.69 5.22 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.945 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.454 ' O ' ' HB3' ' A' ' 22' ' ' ALA . 3.0 m-70 -126.27 20.07 7.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.131 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.14 -33.98 61.6 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.62 67.52 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.333 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.401 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 6.8 m-85 -83.5 -32.66 25.82 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.381 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 18' ' ' HIS . . . -104.45 24.06 12.25 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -56.79 13.08 Favored Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.788 -0.187 . . . . 0.0 110.87 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -78.17 -4.17 14.08 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.536 2.158 . . . . 0.0 113.167 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -113.76 45.12 1.5 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.734 0.302 . . . . 0.0 110.998 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.79 -56.84 1.19 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.947 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 3.0 pttp -77.37 130.85 73.29 Favored Pre-proline 0 C--O 1.232 0.175 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.905 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 36.7 Cg_exo -60.52 -177.56 0.17 Allowed 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.858 2.372 . . . . 0.0 112.637 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.546 ' O ' HG23 ' A' ' 29' ' ' VAL . 29.4 m -123.93 77.09 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.062 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.716 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -56.21 106.29 0.26 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.728 179.923 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 36' ' ' LEU . 11.4 p -59.28 -40.11 80.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.672 -179.466 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -72.36 -46.8 53.8 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.716 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.25 -47.66 55.8 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.4 mt -81.59 -21.33 38.45 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.74 63.82 2.76 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.373 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -114.18 70.07 0.72 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.76 0.314 . . . . 0.0 111.132 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 16.9 m170 -65.62 -12.83 56.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.417 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.87 -19.96 21.16 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.534 0.207 . . . . 0.0 111.186 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -38.34 87.0 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.102 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -31.59 72.83 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.001 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -78.43 -47.2 18.02 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.753 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.2 mt -69.88 -38.76 76.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.321 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 32.2 mm -124.85 128.28 73.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.496 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -34.96 19.78 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.289 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -128.14 77.28 77.0 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-O 120.796 0.331 . . . . 0.0 111.004 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.83 128.45 15.06 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.779 2.319 . . . . 0.0 112.562 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 44.5 mtp -145.66 139.5 26.63 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.251 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -123.71 171.05 9.89 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.189 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 mtm -57.77 -43.11 85.27 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.198 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.404 ' HB3' ' HG3' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -62.0 -39.65 92.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.788 179.594 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.2 m -64.36 -44.46 91.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.646 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.419 HG23 ' OH ' ' A' ' 61' ' ' TYR . 15.2 mt -65.32 -44.31 94.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.433 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.87 73.58 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.2 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.5 p -57.48 -41.4 80.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.124 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -60.59 -49.63 76.75 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.02 -34.57 76.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.361 178.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.26 -37.18 86.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.997 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.55 15.29 9.65 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 62.45 28.44 16.8 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -76.99 -36.95 56.05 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.647 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.478 ' O ' HD21 ' A' ' 3' ' ' LEU . 28.9 m-85 -79.42 100.62 7.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.893 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 ttt-85 -64.91 -31.62 72.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -159.54 -177.44 6.4 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.931 0.396 . . . . 0.0 111.357 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.627 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -71.29 -12.67 61.57 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.788 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -47.37 83.64 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.671 0.272 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -73.5 -37.64 65.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.717 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.521 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.9 t80 -61.35 -53.04 61.8 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.031 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.94 -33.29 78.15 Favored Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.663 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.61 91.26 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.623 0.249 . . . . 0.0 111.108 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.34 -33.9 70.03 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.364 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.9 t -63.38 -48.47 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.623 0.249 . . . . 0.0 110.906 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.3 mtt180 -61.12 -36.81 80.71 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.847 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.67 -44.68 96.49 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.764 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.2 ttm -63.68 -46.75 84.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -58.38 -43.9 88.69 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.153 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.2 t -60.55 -43.25 97.42 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.041 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -73.47 -46.72 46.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -34.0 72.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.238 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -57.12 -35.87 69.99 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.014 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -66.5 -41.97 88.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.846 179.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -76.06 -31.26 58.7 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.297 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -91.9 102.59 6.38 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.257 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 89' ' ' VAL . 55.2 Cg_endo -69.12 133.4 26.64 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.617 2.211 . . . . 0.0 112.24 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -57.52 165.38 6.05 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.725 2.283 . . . . 0.0 112.674 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.36 31.22 8.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.02 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.472 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.9 OUTLIER -127.5 142.6 51.35 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.943 -179.817 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -56.73 -37.55 71.14 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.101 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.2 p -61.8 -40.22 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.389 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.599 HG21 ' O ' ' A' ' 83' ' ' PRO . 24.0 t -67.49 -39.95 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.82 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.28 -34.34 66.35 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.81 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -47.43 83.66 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.406 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.83 -44.73 96.26 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -42.83 87.88 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.509 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.401 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 2.8 tttp -66.36 -41.91 88.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.585 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.54 -36.46 84.3 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -46.95 64.18 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.883 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -46.68 89.31 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.9 p -62.61 -43.0 98.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.51 0.195 . . . . 0.0 110.775 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -49.22 70.86 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.401 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -41.29 94.12 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.957 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.0 mtm -61.23 -47.76 84.61 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -43.82 81.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.631 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.627 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 0.7 OUTLIER -59.27 -50.98 71.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.805 179.536 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.01 -37.99 89.4 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.1 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.9 mtpt -69.48 -41.35 76.27 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.738 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.93 75.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.211 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.51 -41.69 60.23 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.725 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.108 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.789 0.328 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -60.9 -36.86 80.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.848 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.91 -43.72 91.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.93 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -67.7 -40.66 84.3 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -38.16 88.55 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.085 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.9 m -60.21 -38.93 84.84 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.935 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -60.87 -37.0 80.65 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.019 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.3 -36.92 90.92 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.54 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.431 HG23 ' CD ' ' A' ' 102' ' ' ARG . 54.4 mt -64.13 -45.91 95.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 179.31 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.635 HD22 ' HE3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -62.67 -35.35 79.39 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.839 179.225 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -57.62 -32.55 67.34 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.496 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.477 ' CG ' ' HD2' ' A' ' 17' ' ' LYS . 5.6 tt0 -60.32 -36.66 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.386 0.136 . . . . 0.0 110.954 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.52 ' HE1' HD22 ' A' ' 95' ' ' LEU . 4.8 mtt -59.27 -37.0 76.54 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.93 4.79 37.94 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -90.01 12.92 16.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 77.96 24.09 0.72 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.858 0.463 . . . . 0.0 111.43 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HD2' ' CG ' ' A' ' 12' ' ' GLU . 54.0 mttp -113.79 -32.7 6.04 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.827 179.353 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.414 ' NE2' HG11 ' A' ' 98' ' ' VAL . 0.4 OUTLIER -137.76 25.81 2.8 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.878 179.226 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.68 -40.26 23.08 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.204 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.21 81.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.237 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -77.71 -33.38 53.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.394 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -112.06 25.99 11.03 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.464 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -69.37 -56.6 8.15 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 116.929 -0.123 . . . . 0.0 110.938 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 86.4 Cg_endo -81.82 -22.96 4.98 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.473 2.115 . . . . 0.0 112.987 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.12 35.52 1.73 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.639 0.257 . . . . 0.0 111.567 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.53 -38.42 6.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.829 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.5 mmtt -74.86 156.14 86.5 Favored Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.359 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.8 -172.32 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.921 2.414 . . . . 0.0 112.682 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.854 HG21 ' CE2' ' A' ' 39' ' ' TYR . 30.8 m -120.57 68.82 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 121.12 0.486 . . . . 0.0 111.612 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.473 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . 2.0 m-20 -62.85 108.4 1.18 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.977 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 36' ' ' LEU . 9.7 p -60.84 -40.75 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.534 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.19 -44.97 62.18 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.473 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . . . -71.51 -48.87 46.09 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.4 mt -81.09 -21.67 39.78 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.52 61.78 3.73 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.447 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.624 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -133.45 78.65 1.79 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.935 0.398 . . . . 0.0 111.244 -179.884 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -7.66 46.1 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.867 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.22 -19.92 57.93 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.439 0.161 . . . . 0.0 111.284 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.854 ' CE2' HG21 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -59.89 -44.72 94.08 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.853 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 22.4 t -61.21 -39.46 90.32 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.933 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.94 -35.29 80.18 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.729 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.555 HG22 HG13 ' A' ' 43' ' ' ILE . 17.4 mt -80.71 -49.65 18.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.168 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.887 HD12 ' CE2' ' A' ' 81' ' ' TYR . 26.5 mt -147.75 132.89 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.1 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.7 pttt -86.18 -20.08 29.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.753 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.53 ' H ' HG22 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -107.46 86.03 2.54 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.044 -179.751 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.2 143.35 39.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.769 2.313 . . . . 0.0 112.691 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -151.69 122.9 7.71 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.114 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -130.99 162.75 29.08 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.146 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.5 mtm -55.78 -40.85 73.24 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.37 -41.76 98.82 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -64.08 -40.94 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.986 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.411 HG23 ' OH ' ' A' ' 61' ' ' TYR . 12.4 mt -70.58 -45.15 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.635 ' HE3' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -66.39 -38.39 87.41 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.026 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.6 t -57.32 -41.34 79.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.844 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -60.49 -48.36 82.09 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 16.3 tp -64.26 -34.46 78.16 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.48 -39.56 94.79 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.311 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.22 15.21 9.28 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.5 27.14 16.78 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -75.5 -34.09 60.81 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.724 0.297 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.484 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 5.2 m-85 -71.06 104.65 3.08 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.581 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -28.69 66.63 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.34 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -159.71 167.94 27.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.769 0.319 . . . . 0.0 111.286 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.4 63.36 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.515 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -62.78 -42.68 99.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.657 0.265 . . . . 0.0 110.558 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -70.85 -33.18 70.39 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.817 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.484 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 15.3 t80 -62.48 -48.34 80.03 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.89 -32.91 81.37 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.622 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.66 -44.2 96.71 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.613 0.244 . . . . 0.0 111.152 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.76 -33.46 75.72 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.2 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.27 -46.64 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.723 0.297 . . . . 0.0 110.575 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -63.35 -39.51 94.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.714 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.1 tt -70.67 -43.33 69.33 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.794 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 9.0 tmm? -60.42 -44.69 95.5 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.012 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 4.2 m-85 -59.15 -40.66 86.24 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.984 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.4 m -62.33 -44.6 96.12 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -71.43 -40.34 70.49 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.903 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -38.0 84.97 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.035 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.84 -40.11 95.82 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.054 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.5 ttpt -75.14 -36.11 61.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.865 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.887 ' CE2' HD12 ' A' ' 43' ' ' ILE . 3.8 m-85 -69.07 -35.3 76.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.503 ' HB3' HG22 ' A' ' 89' ' ' VAL . 28.7 m-80 -82.01 136.84 46.86 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-O 120.63 0.253 . . . . 0.0 110.909 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.453 ' O ' HG21 ' A' ' 89' ' ' VAL . 72.5 Cg_endo -76.22 131.21 12.71 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.711 2.274 . . . . 0.0 112.368 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -57.27 147.43 76.79 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.604 2.202 . . . . 0.0 112.545 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 63.22 46.43 4.56 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.375 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.637 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-80 -128.02 148.28 50.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -44.01 80.54 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.469 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.7 p -58.85 -35.19 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.49 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.637 HG23 ' HB3' ' A' ' 86' ' ' HIS . 21.7 t -61.0 -43.67 96.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.902 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.35 76.0 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.916 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.23 88.83 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.773 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.8 -42.0 97.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.131 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.519 ' HD2' HG12 ' A' ' 89' ' ' VAL . 11.1 mtt180 -59.6 -43.96 93.56 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.687 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -61.51 -42.07 98.25 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.882 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.52 HD22 ' HE1' ' A' ' 13' ' ' MET . 87.3 mt -63.6 -30.92 71.97 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.082 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.02 -42.39 73.03 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.938 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -60.71 -46.83 88.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.065 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.414 HG11 ' NE2' ' A' ' 18' ' ' HIS . 10.1 p -66.79 -43.0 90.09 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.002 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -50.98 66.81 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.881 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -41.96 79.11 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.81 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -48.16 76.85 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.029 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.431 ' CD ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.84 -44.13 81.88 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.259 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.44 -49.34 69.55 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.802 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.36 -42.48 91.67 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -66.5 -42.22 87.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.919 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.87 -44.44 77.08 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.064 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.57 -40.1 61.85 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.647 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.008 -179.725 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 120.74 0.305 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -65.87 -39.48 90.74 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.754 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.28 -46.83 87.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.199 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.3 -38.01 89.5 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.838 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.27 -46.37 89.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.994 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -60.92 -39.42 89.33 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.4 m -56.03 -38.53 70.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.09 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.43 -43.25 97.6 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.624 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.8 mt -65.81 -44.87 92.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 120.748 0.308 . . . . 0.0 110.384 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.584 HD23 ' HZ ' ' A' ' 99' ' ' PHE . 50.3 mt -63.85 -35.91 82.18 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.63 179.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.79 -28.34 65.88 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 1.7 tt0 -58.34 -36.6 73.67 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.519 0.2 . . . . 0.0 110.935 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.455 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.4 tpp -57.96 -37.16 73.66 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.567 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.76 16.53 23.52 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.415 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.455 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -102.46 12.13 36.95 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.563 0.221 . . . . 0.0 111.533 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 tptt 71.42 25.93 3.36 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.377 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.409 ' CD ' ' HG2' ' A' ' 12' ' ' GLU . 12.7 mttm -113.34 -33.43 5.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.304 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.447 ' CD2' ' HB2' ' A' ' 21' ' ' TYR . 2.4 t60 -143.55 29.61 1.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -78.38 -38.1 42.58 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.123 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.49 92.84 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.998 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 18' ' ' HIS . 10.6 m-85 -72.61 -33.55 66.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.146 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.53 17.22 23.35 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.734 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -54.25 3.48 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.64 -5.52 16.12 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.3 2.0 . . . . 0.0 113.107 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.12 40.92 3.63 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.81 0.338 . . . . 0.0 111.047 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.42 -47.85 4.54 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.014 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -80.19 155.84 74.41 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.064 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.51 -173.7 0.73 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.716 2.278 . . . . 0.0 112.647 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.549 ' O ' HG23 ' A' ' 29' ' ' VAL . 31.2 m -111.39 84.64 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 121.131 0.491 . . . . 0.0 111.37 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -63.34 105.05 0.68 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.081 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG23 ' C ' ' A' ' 36' ' ' LEU . 12.3 p -61.9 -37.22 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.733 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -72.13 -45.75 59.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.574 0.226 . . . . 0.0 111.416 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.04 -47.84 48.8 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -80.84 -21.57 40.66 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.62 60.28 5.12 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.424 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.3 OUTLIER -127.66 66.85 1.32 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 111.325 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -63.59 -18.09 63.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.489 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -76.21 -19.08 58.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.588 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -57.63 -41.41 81.29 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.466 0.174 . . . . 0.0 111.058 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -63.55 -34.71 78.41 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.635 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -42.93 71.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.834 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 22.0 mt -73.77 -45.42 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.28 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.3 mm -121.2 119.84 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 120.674 0.274 . . . . 0.0 111.341 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -70.89 -34.3 71.43 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.49 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -129.77 77.91 76.09 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-O 120.75 0.309 . . . . 0.0 111.066 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.49 129.14 16.34 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.753 2.302 . . . . 0.0 112.5 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 73.9 mtp -132.54 155.6 48.34 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.499 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -140.1 167.32 22.41 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.303 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.0 tpp -56.38 -41.89 76.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -39.24 92.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.665 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.0 -45.08 87.05 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.811 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 27.3 mt -69.62 -45.02 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.153 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -64.64 -34.48 78.38 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.982 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.5 t -57.54 -40.25 78.42 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.082 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -61.38 -48.95 78.89 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -62.85 -36.01 81.86 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.474 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.15 -39.85 87.78 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.228 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.01 15.2 8.98 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.74 27.54 17.3 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -76.58 -35.47 58.15 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.595 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -73.68 105.07 4.83 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.75 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -79.56 -28.34 41.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.327 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -149.59 163.61 37.39 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 111.598 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.44 -18.08 63.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.778 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -62.79 -43.03 99.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.624 0.25 . . . . 0.0 110.533 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -69.95 -37.09 75.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.83 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.609 ' O ' HG23 ' A' ' 71' ' ' VAL . 26.4 t80 -65.69 -53.04 46.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.11 -37.59 80.83 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.617 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.54 -42.81 93.18 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.671 0.272 . . . . 0.0 111.006 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.3 -38.99 71.75 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.222 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 67' ' ' PHE . 41.2 t -62.54 -48.6 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.016 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -64.09 -37.87 89.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.646 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.41 -48.49 72.64 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.638 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -64.44 -42.83 95.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.083 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -57.14 -42.8 81.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.032 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t -63.38 -43.66 96.98 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.738 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -69.96 -41.53 74.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.949 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.38 -39.71 84.22 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.216 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.55 -34.43 72.65 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.141 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -65.69 -46.88 77.36 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -74.85 -40.9 60.74 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.142 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.526 ' HB3' HG22 ' A' ' 89' ' ' VAL . 24.7 m-20 -61.08 110.78 3.3 Favored Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.107 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.434 ' O ' HG21 ' A' ' 89' ' ' VAL . 57.7 Cg_endo -70.9 123.82 10.07 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.64 2.226 . . . . 0.0 112.223 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.64 161.37 1.32 Allowed 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.952 2.435 . . . . 0.0 113.005 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 61.06 42.21 12.82 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.74 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.715 ' HB3' HG23 ' A' ' 89' ' ' VAL . 4.7 t-160 -134.09 147.88 50.94 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.271 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -58.35 -41.78 85.46 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.131 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -60.55 -36.66 71.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.634 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.715 HG23 ' HB3' ' A' ' 86' ' ' HIS . 17.5 t -65.3 -47.47 87.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.68 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.61 91.53 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.967 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.8 mtp -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.01 -50.43 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.9 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -40.44 89.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.748 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -41.81 97.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.791 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.76 -34.65 77.67 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.008 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.98 -43.37 71.61 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -61.53 -46.8 88.4 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.281 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -64.87 -42.87 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.861 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.584 ' HZ ' HD23 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -64.19 -50.59 67.49 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.849 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.26 -45.52 83.93 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.058 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -47.88 84.33 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.042 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -67.49 -44.14 79.23 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.133 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.404 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 1.2 t80 -63.2 -42.74 99.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.836 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.57 74.34 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.066 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -71.65 -44.57 64.08 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.139 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 9.8 ptm -69.38 -35.78 76.16 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.76 -41.34 19.3 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.574 0.226 . . . . 0.0 111.35 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.979 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.643 0.259 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -64.92 -37.04 86.32 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.139 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.02 -40.65 98.38 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.925 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -35.23 66.41 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.821 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.54 -49.81 56.72 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.345 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.429 ' HA ' HD12 ' A' ' 9' ' ' ILE . 27.2 p -61.64 -37.1 82.76 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.781 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -56.57 -37.34 70.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.945 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.8 89.1 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.116 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 6' ' ' CYS . 5.7 mt -64.14 -39.04 84.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 CA-C-O 120.917 0.389 . . . . 0.0 110.077 179.01 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -35.81 80.43 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.248 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -29.96 65.91 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.401 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.403 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -58.51 -36.69 74.2 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.47 0.176 . . . . 0.0 111.075 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -36.87 71.68 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.76 11.63 19.43 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -101.16 21.86 13.28 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.684 0.278 . . . . 0.0 111.525 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.8 mttm 65.77 21.63 11.52 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.453 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -111.36 -30.11 7.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.948 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.407 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -145.33 30.16 1.14 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.683 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.03 -41.27 17.41 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.36 85.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.933 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -73.79 -31.6 63.35 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.202 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.488 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -109.83 24.64 12.77 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.545 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 28.2 t-105 -69.5 -51.49 16.44 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.964 -0.107 . . . . 0.0 111.211 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -80.21 -19.3 9.36 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.423 2.082 . . . . 0.0 113.095 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -105.55 37.41 2.23 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.833 0.349 . . . . 0.0 111.131 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -107.57 -46.25 3.87 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.901 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -81.67 152.43 69.52 Favored Pre-proline 0 CA--C 1.531 0.235 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.101 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -63.43 179.3 0.94 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.926 2.418 . . . . 0.0 112.917 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.5 m -94.64 66.19 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.974 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.15 100.08 0.05 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.967 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.2 p -62.7 -35.12 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.708 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -71.71 -47.49 53.63 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.588 0.232 . . . . 0.0 111.22 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.46 -47.01 52.25 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -81.19 -21.44 39.64 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.23 60.54 6.26 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.474 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.06 71.43 1.26 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.908 0.385 . . . . 0.0 111.422 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -65.39 -22.26 66.77 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.17 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.09 -19.92 58.14 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.447 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -57.62 -42.63 83.68 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.675 0.274 . . . . 0.0 110.912 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.1 t -60.2 -37.14 79.35 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.14 -39.61 78.74 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.99 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.8 mt -72.57 -51.7 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.174 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.434 HD13 ' HB2' ' A' ' 77' ' ' ASN . 13.8 mt -129.05 118.18 45.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.058 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.0 pttt -77.68 -30.38 51.93 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -112.45 77.43 2.29 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-O 120.807 0.337 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.27 153.57 61.72 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.755 2.303 . . . . 0.0 112.656 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.27 142.95 16.21 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -139.43 167.25 22.5 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 tpp -57.55 -42.19 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.928 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.2 t -64.24 -38.25 90.39 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.544 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -65.66 -43.99 87.69 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.73 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.577 HG23 ' OH ' ' A' ' 61' ' ' TYR . 22.9 mt -70.17 -45.15 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.076 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -34.8 78.29 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.928 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.6 t -57.47 -40.86 79.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.934 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -60.39 -46.91 88.31 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.795 0.331 . . . . 0.0 110.251 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.04 -34.39 77.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.548 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.69 -38.18 90.15 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.311 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.69 15.19 10.03 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.089 0.404 . . . . 0.0 112.089 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 58.07 27.26 14.65 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.595 0.236 . . . . 0.0 111.543 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -32.58 60.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.648 0.261 . . . . 0.0 110.556 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.577 ' OH ' HG23 ' A' ' 52' ' ' ILE . 8.4 m-85 -71.41 104.85 3.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.967 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -65.68 -30.77 71.51 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.062 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.87 172.36 18.79 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.738 0.304 . . . . 0.0 111.24 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.11 -16.7 63.15 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.615 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.87 -43.52 98.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.653 0.263 . . . . 0.0 110.417 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -69.69 -40.65 76.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.967 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.492 ' O ' HG23 ' A' ' 71' ' ' VAL . 68.2 t80 -59.36 -53.45 58.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.778 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -58.75 -31.51 67.81 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.737 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.69 91.1 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.636 0.218 . . . . 0.0 111.387 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.11 -31.76 72.81 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.192 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 67' ' ' PHE . 43.7 t -60.72 -48.32 89.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.684 0.278 . . . . 0.0 110.577 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.0 mtt-85 -64.33 -38.27 90.46 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.701 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.46 -46.35 76.67 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.668 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.453 ' HB2' HD11 ' A' ' 52' ' ' ILE . 5.7 tmm? -59.19 -46.35 88.65 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.85 -35.26 80.54 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.918 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -60.16 -47.32 86.42 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.15 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.434 ' HB2' HD13 ' A' ' 43' ' ' ILE . 16.3 p30 -75.36 -30.5 60.23 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.896 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.73 -41.44 95.31 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.75 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.26 -33.87 75.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.946 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -66.56 -47.13 73.77 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.918 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.75 -38.83 76.94 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.571 ' HB3' HG22 ' A' ' 89' ' ' VAL . 51.4 m-20 -72.2 127.29 90.55 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.768 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.506 ' O ' HG21 ' A' ' 89' ' ' VAL . 37.8 Cg_endo -65.95 161.01 41.46 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.678 2.252 . . . . 0.0 112.417 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.79 127.58 13.96 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.54 2.16 . . . . 0.0 112.559 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.1 t70 60.13 67.91 0.82 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.917 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.475 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.7 t-80 -133.89 165.11 25.77 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.314 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.66 -44.15 96.99 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.309 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -62.42 -31.35 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.571 HG22 ' HB3' ' A' ' 82' ' ' ASN . 39.1 t -64.89 -42.32 94.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.883 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.69 -35.2 75.69 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.005 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -45.97 90.52 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.951 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.44 -46.32 89.08 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.935 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -44.99 95.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.744 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.11 -37.42 87.38 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -68.35 -38.46 81.5 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.983 179.745 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.22 -42.47 75.67 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.088 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.6 -46.81 88.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.2 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.97 -42.99 89.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.235 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -64.83 -51.46 62.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.931 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.67 -43.6 93.91 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.91 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mtt -60.24 -47.11 87.35 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.975 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.16 77.65 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.99 -44.46 95.98 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.999 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.81 -32.5 73.83 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.089 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -44.18 66.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.081 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.3 ptm -69.3 -34.24 74.4 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.259 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.8 mt -84.08 -42.29 16.26 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.992 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.809 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 120.729 0.3 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -64.73 -42.72 95.0 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mt -59.96 -41.7 92.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.918 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -35.68 81.4 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.046 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.8 t -62.42 -37.62 86.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.131 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.39 -39.09 78.73 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.842 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -60.06 -38.72 83.67 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.091 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.65 -43.18 97.95 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.501 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.6 mt -64.4 -46.88 91.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-O 120.656 0.265 . . . . 0.0 110.536 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.7 -35.87 81.09 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.876 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.7 mtpp -58.49 -29.78 66.5 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.231 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.479 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -58.58 -36.43 73.96 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.348 0.118 . . . . 0.0 110.87 179.312 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.85 -37.34 73.72 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.468 179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.97 8.68 30.62 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 179.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.479 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -94.28 15.02 18.49 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.68 29.05 2.64 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.174 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.4 mttm -123.74 -31.24 3.47 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.745 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -140.69 28.63 1.96 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 111.244 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.74 -37.94 64.9 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.777 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.87 -36.39 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -73.65 -34.51 64.98 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.576 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -100.81 14.42 31.77 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -52.88 4.01 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -64.06 -12.06 30.46 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 122.612 2.208 . . . . 0.0 113.567 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -141.7 52.46 1.52 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 111.203 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -99.02 -45.41 5.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.77 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.69 160.86 25.29 Favored Pre-proline 0 N--CA 1.464 0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.218 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.79 177.06 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.28 2.653 . . . . 0.0 113.158 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.0 m -93.5 83.85 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.139 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.539 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 17.7 m-20 -61.16 93.13 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.524 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.509 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.8 p -61.1 -39.26 81.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.818 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -72.3 -46.62 54.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.6 0.238 . . . . 0.0 111.578 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.539 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.96 -48.79 42.54 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 mt -80.86 -21.33 40.81 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.14 58.13 6.37 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.431 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.509 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -128.7 60.09 1.53 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.964 0.411 . . . . 0.0 111.442 -179.758 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -61.84 -20.99 64.27 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.525 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.24 -20.26 57.58 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.344 0.116 . . . . 0.0 111.27 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.452 ' CE2' HG13 ' A' ' 43' ' ' ILE . 10.3 t80 -56.71 -42.42 79.13 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.253 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 44.5 t -66.18 -32.33 73.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.943 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.24 -34.35 61.41 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.06 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.1 mt -82.99 -41.84 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.478 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.452 HG13 ' CE2' ' A' ' 39' ' ' TYR . 36.2 mm -96.41 127.58 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.747 0.308 . . . . 0.0 111.523 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.8 -36.88 25.21 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.259 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.56 88.47 53.36 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.07 116.08 4.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.736 2.29 . . . . 0.0 112.386 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.9 mtp -140.54 149.6 42.64 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.294 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -147.73 171.52 15.53 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.227 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.514 ' HA ' HD12 ' A' ' 52' ' ' ILE . 6.4 mtt -56.04 -42.32 76.36 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.054 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t -61.93 -40.01 94.02 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.643 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.7 m -66.31 -42.53 88.15 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.951 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.514 HD12 ' HA ' ' A' ' 49' ' ' MET . 11.6 mt -65.21 -45.08 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.703 0.287 . . . . 0.0 110.78 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -36.69 84.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.04 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.8 p -57.35 -38.49 74.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.208 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -62.92 -48.67 77.93 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.5 tp -62.6 -34.48 77.11 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.529 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.61 -38.91 92.93 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.298 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.45 15.2 8.21 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 59.79 27.49 16.8 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.661 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.45 -34.36 58.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.725 0.297 . . . . 0.0 110.467 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.451 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 8.3 m-85 -79.2 92.72 5.12 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.587 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.5 mtm-85 -60.37 -34.96 74.61 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -145.28 165.64 27.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.931 0.396 . . . . 0.0 111.375 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.05 -22.28 65.87 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.836 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -41.32 99.41 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.599 0.238 . . . . 0.0 110.515 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.49 -35.34 78.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.935 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.473 ' O ' HG23 ' A' ' 71' ' ' VAL . 24.5 t80 -59.91 -47.51 85.49 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.429 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.46 -32.29 82.55 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.796 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.05 -36.87 78.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.6 0.238 . . . . 0.0 111.414 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.59 -33.21 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.177 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.7 t -64.82 -48.71 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.919 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.07 -36.07 82.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.658 179.521 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.29 -47.33 77.02 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.3 ttp -60.38 -46.87 88.41 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.343 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -63.81 -35.2 79.84 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.707 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 m -59.7 -47.24 86.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.23 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -75.39 -36.75 60.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.682 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -59.3 -40.87 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.814 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -57.66 -35.64 70.83 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.358 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -66.41 -39.57 89.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.941 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.421 ' HB2' HD11 ' A' ' 43' ' ' ILE . 3.0 t80 -81.07 -38.75 26.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.248 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.733 ' HB3' HG22 ' A' ' 89' ' ' VAL . 27.0 m-20 -57.51 110.6 2.6 Favored Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.113 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.449 ' O ' HG21 ' A' ' 89' ' ' VAL . 46.2 Cg_endo -68.59 143.66 57.65 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.666 2.244 . . . . 0.0 112.432 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 51.4 Cg_exo -54.09 132.55 50.78 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 122.69 2.26 . . . . 0.0 112.438 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.27 68.03 0.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.013 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.804 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.8 t-160 -134.82 154.66 51.53 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.111 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -44.75 81.63 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.248 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 m -65.46 -31.49 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.493 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.804 HG23 ' HB3' ' A' ' 86' ' ' HIS . 31.2 t -67.42 -47.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.74 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.43 91.05 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.857 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 7.7 mtt -64.99 -36.77 85.46 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.25 -48.22 79.4 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.44 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -48.0 83.61 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.744 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.07 -38.94 90.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.842 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -37.13 85.62 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.172 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -69.54 -46.79 65.67 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.847 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.78 -47.01 88.25 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.271 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.22 -43.3 97.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.316 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.25 -51.03 63.46 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.425 0.155 . . . . 0.0 110.948 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -43.89 88.05 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.793 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.9 mtp -61.99 -46.92 87.11 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.054 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.65 -44.41 77.96 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.134 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.403 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.5 OUTLIER -64.25 -41.85 96.78 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.877 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -36.15 83.07 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.038 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -67.91 -44.84 76.01 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.173 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.403 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 13.7 ptm -69.4 -35.36 75.7 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.401 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.62 -42.37 20.13 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.225 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.008 179.911 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.65 0.262 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -63.26 -44.98 93.6 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.783 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.86 -44.51 94.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.945 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -63.83 -38.09 89.8 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.88 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -46.04 80.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.004 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.476 ' HA ' HD12 ' A' ' 9' ' ' ILE . 22.6 m -60.44 -39.0 85.93 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.972 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.8 m -58.59 -34.51 71.18 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.079 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -47.29 91.57 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.427 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.481 HD11 ' SD ' ' A' ' 106' ' ' MET . 3.6 mt -64.06 -44.58 97.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.788 0.327 . . . . 0.0 110.259 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.776 HD11 ' HG3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -62.16 -35.79 79.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.73 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.4 -27.66 64.48 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -58.44 -36.39 73.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.922 -0.126 . . . . 0.0 111.089 179.61 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -56.94 -40.41 76.35 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.9 11.94 33.05 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.8 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.54 11.42 28.75 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.02 26.34 3.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.202 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 79.4 mttt -116.1 -33.51 5.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.994 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.418 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.6 OUTLIER -130.65 23.15 5.05 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.187 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.31 -30.29 60.31 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.227 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.72 -39.51 91.26 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.737 0.304 . . . . 0.0 111.02 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.448 ' CZ ' ' HD3' ' A' ' 94' ' ' LYS . 8.7 m-85 -81.61 -33.55 31.43 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -97.02 15.58 22.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.44 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.76 -54.79 26.7 Favored Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.9 Cg_endo -76.84 -20.5 13.28 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.337 2.024 . . . . 0.0 112.984 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -98.28 22.45 9.59 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.391 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.53 -43.48 39.06 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.435 ' HB3' ' HD2' ' A' ' 28' ' ' PRO . 26.3 mmtt -102.42 158.28 32.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.126 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 27' ' ' LYS . 74.0 Cg_endo -75.01 -176.34 2.83 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.805 2.337 . . . . 0.0 112.754 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.7 m -93.87 80.27 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.133 0.492 . . . . 0.0 111.241 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.517 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -60.31 103.86 0.27 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.142 -179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.423 ' HA ' HD12 ' A' ' 36' ' ' LEU . 14.5 p -61.52 -37.32 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.13 -46.42 56.63 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.488 0.185 . . . . 0.0 111.442 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.517 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.69 -46.91 57.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.504 HD13 HD21 ' A' ' 36' ' ' LEU . 15.5 mt -80.85 -21.45 40.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.62 47.88 73.08 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.425 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.504 HD21 HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -120.83 69.41 0.88 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.044 0.45 . . . . 0.0 111.222 -179.916 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -65.23 -18.21 65.12 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.445 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -76.3 -19.95 57.77 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.872 -0.149 . . . . 0.0 111.314 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -40.31 82.49 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.615 0.245 . . . . 0.0 110.843 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.6 t -65.58 -40.13 92.39 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.788 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -65.09 -36.14 83.36 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.861 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.4 mt -77.59 -47.83 25.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 77' ' ' ASN . 29.9 mm -99.86 103.47 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.306 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -59.66 -33.31 71.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.398 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.76 89.41 52.45 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.603 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.46 124.32 11.89 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.749 2.299 . . . . 0.0 112.72 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.9 tpt -153.47 131.26 11.61 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -129.62 167.94 17.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.948 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.3 -42.65 77.91 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.091 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.8 t -62.06 -39.94 94.11 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.838 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.5 m -64.12 -44.43 92.24 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.864 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.451 HG23 ' OH ' ' A' ' 61' ' ' TYR . 53.7 mt -69.86 -44.92 78.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.136 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.688 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.776 ' HG3' HD11 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -62.52 -35.23 78.76 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.076 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 t -57.56 -40.42 78.87 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.974 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.3 -49.41 77.7 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.469 HD22 HD13 ' A' ' 10' ' ' LEU . 6.5 tp -67.04 -33.26 75.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.503 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.14 -41.36 99.27 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.388 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.36 15.16 12.7 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.35 27.21 16.77 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -76.29 -33.67 59.09 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.706 0.289 . . . . 0.0 110.516 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.451 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.0 m-85 -70.48 110.28 5.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.76 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -81.27 -25.88 36.21 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.192 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -147.12 157.83 43.74 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.815 0.34 . . . . 0.0 111.599 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -23.17 64.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.276 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -62.6 -39.05 92.52 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.521 0.201 . . . . 0.0 110.485 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.47 -35.32 75.5 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.72 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 71' ' ' VAL . 5.1 t80 -67.53 -53.63 26.89 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.844 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.79 -36.94 81.96 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.156 -0.545 . . . . 0.0 112.806 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -58.94 -37.83 77.62 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.507 0.194 . . . . 0.0 111.219 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -76.72 -33.48 58.16 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.47 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 67' ' ' PHE . 26.7 t -64.9 -48.31 84.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.645 0.259 . . . . 0.0 110.715 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -64.62 -34.54 78.52 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.786 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.3 -44.56 71.51 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.508 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.3 -46.25 89.07 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.782 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -63.58 -35.93 82.13 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.2 p -61.25 -45.82 92.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.049 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.477 ' HB2' HD12 ' A' ' 43' ' ' ILE . 1.6 p-10 -75.92 -38.05 58.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.874 179.299 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 t -61.24 -41.23 96.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.374 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.55 -29.14 69.82 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -72.73 -36.47 67.76 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.696 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -78.84 -40.78 31.75 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.226 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.461 ' HB3' HG22 ' A' ' 89' ' ' VAL . 90.0 m-20 -70.23 112.15 11.71 Favored Pre-proline 0 N--CA 1.466 0.33 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.131 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.515 ' O ' HG21 ' A' ' 89' ' ' VAL . 22.0 Cg_exo -65.4 156.9 60.88 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.765 2.31 . . . . 0.0 112.219 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.15 149.48 70.85 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.42 2.08 . . . . 0.0 112.373 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 t0 60.93 43.31 11.81 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.317 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.781 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.5 t-80 -116.63 146.92 42.37 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.001 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -56.38 -43.52 79.32 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.257 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.6 m -62.13 -33.44 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.781 HG23 ' HB3' ' A' ' 86' ' ' HIS . 29.9 t -61.65 -42.44 94.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.764 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.38 81.37 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.78 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' MET . . . . . 0.441 ' HA ' ' CE2' ' A' ' 21' ' ' TYR . 0.7 OUTLIER -69.53 -37.26 77.04 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.48 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.45 -50.74 57.91 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.394 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -62.63 -38.78 91.59 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.54 0.209 . . . . 0.0 110.689 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.448 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 2.9 tttp -64.42 -41.74 96.43 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.756 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -68.42 -37.94 80.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.952 179.456 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.29 -41.47 80.93 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.974 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -60.75 -46.75 89.26 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.27 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 p -67.02 -42.83 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -50.54 68.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.959 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -46.98 86.0 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.601 0.239 . . . . 0.0 110.887 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -45.75 91.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.02 -43.94 77.63 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.957 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.28 -52.46 65.56 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.982 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.27 -40.02 84.76 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.309 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.38 -42.29 75.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.679 0.276 . . . . 0.0 110.787 179.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.481 ' SD ' HD11 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.11 -44.67 71.95 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.966 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -42.13 66.12 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.535 -0.745 . . . . 0.0 110.703 179.69 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.747 0.308 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.95 -42.8 94.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.213 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.5 mt -62.81 -42.45 99.72 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.719 0.295 . . . . 0.0 110.853 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -69.26 -36.67 77.36 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.965 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -50.23 64.41 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.534 ' HA ' HD12 ' A' ' 9' ' ' ILE . 24.0 p -64.25 -39.37 93.81 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.167 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.17 -40.51 85.84 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.927 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.47 -44.2 96.89 Favored Glycine 0 C--N 1.336 0.537 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.303 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.534 HD12 ' HA ' ' A' ' 6' ' ' CYS . 8.2 mt -64.32 -44.41 97.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-O 120.817 0.341 . . . . 0.0 110.235 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.659 HD21 ' CZ ' ' A' ' 67' ' ' PHE . 10.0 mp -62.44 -35.83 80.5 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.554 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -58.45 -29.28 66.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 43.1 tt0 -58.62 -36.54 74.22 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.562 0.22 . . . . 0.0 110.645 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.554 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 6.6 ttm -57.66 -37.12 72.84 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.528 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 7.07 31.51 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.705 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -94.09 15.36 17.27 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.592 0.234 . . . . 0.0 111.559 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? 69.05 25.61 5.83 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HB2' ' CG ' ' A' ' 12' ' ' GLU . 32.3 mttm -115.37 -29.58 6.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.228 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.404 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 1.4 t60 -144.45 33.4 1.18 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.798 0.332 . . . . 0.0 110.796 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -89.21 -38.96 13.87 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.184 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.92 -42.66 97.34 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -76.8 -29.28 55.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.326 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.9 16.46 25.88 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.487 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -71.21 -55.83 5.92 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-O 120.346 0.117 . . . . 0.0 110.987 179.993 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.487 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 12.3 Cg_exo -69.74 -25.1 29.02 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.565 2.177 . . . . 0.0 112.636 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -102.23 34.57 2.68 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.287 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.1 -45.99 4.19 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.89 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -88.97 156.94 49.11 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.325 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -62.38 -171.71 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.154 2.569 . . . . 0.0 112.842 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -116.5 87.35 1.03 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -57.92 102.49 0.1 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.267 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.408 HG23 HD12 ' A' ' 36' ' ' LEU . 12.8 p -63.75 -36.68 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.643 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.93 -47.31 53.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.614 0.245 . . . . 0.0 111.498 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.569 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -72.43 -47.16 51.25 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.15 -21.51 39.71 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.17 59.99 5.92 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.615 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.418 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -124.93 72.23 1.22 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.962 0.41 . . . . 0.0 111.342 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -69.88 -12.73 61.84 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.458 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -19.41 58.5 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.4 0.143 . . . . 0.0 111.25 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -34.8 69.59 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.534 0.207 . . . . 0.0 111.019 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -66.44 -39.97 89.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.72 0.295 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.23 -37.55 69.14 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.229 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.9 mt -79.15 -52.97 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.321 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.634 HD12 ' HB3' ' A' ' 77' ' ' ASN . 28.3 mm -106.99 126.96 62.98 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.245 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 43.0 pttt -79.43 -39.13 33.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.278 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -116.37 94.25 42.14 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.725 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.79 105.13 0.89 Allowed 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.665 2.244 . . . . 0.0 112.598 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 39.3 mtp -139.12 140.63 38.0 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.967 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.53 170.66 12.93 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.128 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -32.29 69.23 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.475 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -42.33 99.05 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.727 0.299 . . . . 0.0 110.936 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.6 m -64.4 -39.93 94.8 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.861 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.465 HG22 ' CE2' ' A' ' 67' ' ' PHE . 22.1 mt -70.49 -44.74 76.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.862 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -39.61 92.99 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.113 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.3 p -57.48 -39.07 75.61 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.177 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -49.81 75.73 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.9 tp -63.23 -34.1 76.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.458 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.97 -38.25 90.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.147 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.411 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . . . -90.18 15.26 10.63 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 63.84 26.92 14.45 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.411 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 28.0 mt-10 -79.54 -35.84 39.31 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.764 0.316 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 2.4 m-85 -76.21 101.3 5.35 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.685 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -62.19 -30.19 70.9 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.38 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.23 164.86 38.23 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.866 0.365 . . . . 0.0 111.427 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.2 -15.41 63.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.458 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.77 -44.29 96.56 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.662 0.268 . . . . 0.0 110.323 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -71.08 -35.38 71.84 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.821 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.659 ' CZ ' HD21 ' A' ' 10' ' ' LEU . 34.1 t80 -61.4 -48.1 82.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.412 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.53 -32.14 80.17 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.832 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.3 96.1 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.739 0.27 . . . . 0.0 111.055 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.59 -37.48 76.95 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.033 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 67' ' ' PHE . 42.2 t -59.86 -47.74 90.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.908 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -63.01 -35.64 80.89 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.706 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.6 tt -72.2 -43.03 65.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.734 0.302 . . . . 0.0 110.808 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ttp -66.87 -45.09 79.21 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.473 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.81 -41.43 97.88 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.8 p -61.93 -44.04 97.6 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.533 0.206 . . . . 0.0 110.792 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.634 ' HB3' HD12 ' A' ' 43' ' ' ILE . 47.2 m-80 -73.72 -39.58 64.19 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.383 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.93 -37.82 83.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -59.81 -35.35 74.51 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.982 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -63.23 -42.78 99.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.66 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -70.19 -35.02 73.66 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.189 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.828 ' HB3' HG22 ' A' ' 89' ' ' VAL . 34.0 m-20 -59.42 110.94 3.13 Favored Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.975 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.633 ' O ' HG21 ' A' ' 89' ' ' VAL . 32.1 Cg_exo -60.59 160.38 24.51 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.924 2.416 . . . . 0.0 112.689 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.41 120.72 7.66 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.53 2.153 . . . . 0.0 112.244 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.2 t70 62.52 71.43 0.53 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.658 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.721 ' HB3' HG23 ' A' ' 89' ' ' VAL . 5.8 t-160 -137.51 152.67 49.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.358 -179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -56.33 -44.31 79.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.291 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 19.0 m -60.3 -32.33 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.399 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.828 HG22 ' HB3' ' A' ' 82' ' ' ASN . 23.2 t -66.07 -43.22 92.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.784 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.06 -37.81 86.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.978 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -46.36 90.72 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.706 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.76 94.12 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.931 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -48.8 71.0 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.606 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.5 tttp -62.47 -41.51 98.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.087 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.404 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -67.83 -40.76 83.74 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.055 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.2 tm0? -70.04 -43.72 70.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.983 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -60.74 -46.76 89.21 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.314 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.95 -42.6 89.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.813 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.78 -49.77 71.65 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.84 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -46.18 88.72 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.562 0.22 . . . . 0.0 110.967 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 6.2 mtp -60.35 -45.98 91.53 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.983 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -67.98 -43.83 78.07 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.122 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.414 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.1 OUTLIER -59.88 -47.87 83.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.043 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.94 -34.08 77.18 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.114 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.92 -44.57 63.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.42 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.414 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 7.2 ptm -69.24 -33.47 73.32 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.04 -42.35 14.93 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 120.573 0.225 . . . . 0.0 110.846 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.13 -0.938 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 120.675 0.274 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -64.33 -39.36 93.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.92 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.97 -45.67 91.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.967 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -35.08 77.26 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.946 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 t -62.49 -35.84 80.62 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.231 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.7 m -58.05 -42.14 84.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.86 -34.98 78.49 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.017 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.93 -46.69 93.69 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.656 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mt -64.39 -47.37 89.77 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.772 0.32 . . . . 0.0 110.581 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mt -63.85 -35.75 81.64 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 ttpt -58.59 -30.3 67.1 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.616 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.488 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.5 -36.62 74.06 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.448 0.166 . . . . 0.0 110.983 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.471 ' HE3' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -57.92 -38.68 76.32 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.653 0.263 . . . . 0.0 110.452 179.18 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.07 3.84 39.1 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.716 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.488 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.04 16.41 12.84 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.582 0.229 . . . . 0.0 111.538 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.3 mttp 70.77 25.8 3.93 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.427 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 6.9 mttm -114.28 -32.78 5.86 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.03 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.462 ' NE2' HG11 ' A' ' 98' ' ' VAL . 4.9 m-70 -131.42 18.78 4.82 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.075 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.81 78.84 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-O 120.593 0.235 . . . . 0.0 110.938 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.41 -34.77 74.97 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.298 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -86.67 -31.0 21.3 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.699 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.9 17.2 24.56 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.42 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.08 -53.13 35.16 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.355 0.121 . . . . 0.0 110.72 179.588 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.42 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 75.2 Cg_endo -88.68 18.72 1.43 Allowed 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.732 2.288 . . . . 0.0 113.088 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -144.13 62.78 1.34 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.934 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -127.89 -55.06 1.3 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.857 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.41 157.24 75.37 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.025 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.98 -177.22 1.23 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.754 2.303 . . . . 0.0 112.732 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.62 HG11 ' CZ ' ' A' ' 39' ' ' TYR . 15.9 m -90.23 78.55 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.113 0.482 . . . . 0.0 111.418 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.579 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -60.17 97.69 0.05 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.867 179.809 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 36' ' ' LEU . 11.6 p -61.51 -39.66 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.766 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -72.25 -46.78 54.53 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.579 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -72.3 -48.2 44.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.5 -21.46 38.64 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.5 57.88 6.34 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.323 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 36' ' ' LEU . 0.5 OUTLIER -129.4 76.44 1.72 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.983 0.421 . . . . 0.0 111.406 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -75.88 -7.17 53.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.51 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.3 -19.87 57.86 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.369 0.128 . . . . 0.0 111.22 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.62 ' CZ ' HG11 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -57.8 -42.0 83.31 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.899 179.654 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.3 t -63.28 -35.69 81.19 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.908 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -73.24 -42.15 62.91 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.169 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 20.1 mt -80.79 -62.38 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.766 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 22.5 mm -97.23 125.54 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.822 0.344 . . . . 0.0 111.543 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -83.58 -34.95 25.05 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.442 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -136.81 72.88 54.77 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-O 120.808 0.337 . . . . 0.0 111.085 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.58 160.31 44.42 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.814 2.343 . . . . 0.0 112.423 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.7 mtp -150.18 163.22 38.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.319 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.43 172.24 14.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.032 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.43 ' HA ' HD12 ' A' ' 52' ' ' ILE . 16.9 ttm -54.48 -37.44 65.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.74 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.0 t -63.46 -44.25 95.02 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.82 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.2 m -64.32 -38.59 91.59 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.095 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.43 HD12 ' HA ' ' A' ' 49' ' ' MET . 15.9 mt -69.74 -44.89 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-O 120.749 0.309 . . . . 0.0 110.908 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.18 -36.32 81.52 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.277 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.2 p -57.62 -43.11 84.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.8 -49.07 77.79 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.41 ' HB2' ' HD2' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -66.18 -33.18 75.18 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.688 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -60.27 -41.44 93.31 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.468 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.03 15.17 12.08 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.04 27.35 16.26 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.62 0.248 . . . . 0.0 111.362 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -76.6 -33.67 58.42 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.667 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.41 ' HD2' ' HB2' ' A' ' 56' ' ' LEU . 2.6 m-85 -66.11 103.17 0.92 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.943 0.402 . . . . 0.0 110.622 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -32.04 63.58 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.025 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -166.92 -178.98 4.47 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.251 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.52 -15.62 61.78 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.254 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -62.84 -46.0 89.96 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.669 0.271 . . . . 0.0 110.342 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.23 -36.03 74.26 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.775 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.452 ' O ' HG23 ' A' ' 71' ' ' VAL . 19.0 t80 -59.93 -53.65 55.38 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.963 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.38 -32.15 81.91 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.615 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.38 99.41 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.199 0.2 . . . . 0.0 111.397 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.11 -35.24 73.98 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.447 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 67' ' ' PHE . 46.0 t -63.44 -48.09 88.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 120.743 0.306 . . . . 0.0 110.259 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -64.76 -39.78 94.2 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.651 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.95 -48.67 79.35 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.759 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.0 ttp -61.65 -41.7 97.88 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.136 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -41.21 81.64 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.944 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.6 m -62.79 -43.71 98.07 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.833 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -71.29 -42.29 68.87 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.98 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t -59.73 -36.66 77.03 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.028 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -60.3 -37.47 80.65 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.144 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -70.56 -39.37 73.99 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.012 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -75.07 -33.21 61.65 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.424 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.649 ' HB3' HG22 ' A' ' 89' ' ' VAL . 2.9 m-20 -88.07 111.6 43.89 Favored Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 116.754 -0.203 . . . . 0.0 111.122 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 31.8 Cg_exo -58.42 142.41 97.83 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.852 2.368 . . . . 0.0 112.543 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 32.0 Cg_exo -58.53 151.84 59.27 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.914 2.41 . . . . 0.0 112.618 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 59.29 51.39 6.86 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.709 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-160 -128.92 145.91 51.09 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.6 -40.74 75.82 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.019 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.9 m -61.99 -36.1 72.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.313 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.709 HG23 ' HB3' ' A' ' 86' ' ' HIS . 28.2 t -65.87 -46.6 88.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.769 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.84 -36.91 82.58 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.015 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -61.26 -46.36 90.69 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.26 -46.58 82.93 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtp180 -59.89 -37.28 78.92 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.839 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -59.43 -42.2 91.35 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.725 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.471 HD22 ' HE3' ' A' ' 13' ' ' MET . 20.1 mt -71.02 -32.12 68.81 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.81 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -44.23 71.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.888 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -60.69 -46.67 89.49 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.241 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.462 HG11 ' NE2' ' A' ' 18' ' ' HIS . 8.6 p -66.03 -42.95 92.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.946 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -64.14 -50.3 68.77 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.849 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.58 -46.97 83.34 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.001 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -46.1 90.81 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.867 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -43.99 78.14 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.002 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.427 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -57.48 -46.35 83.8 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.98 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.37 -36.35 83.4 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.052 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -69.14 -44.81 71.6 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.129 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.427 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 8.0 ptm -69.4 -33.31 72.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.746 -0.207 . . . . 0.0 111.408 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.81 -42.7 16.17 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.478 0.18 . . . . 0.0 111.347 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.804 -0.617 . . . . 0.0 110.737 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.69 0.281 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.52 -40.13 80.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.958 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.415 HD21 ' O ' ' A' ' 61' ' ' TYR . 78.8 mt -58.97 -33.71 70.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.911 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -72.72 -34.72 67.28 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.88 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -49.71 53.8 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.433 ' HA ' HD12 ' A' ' 9' ' ' ILE . 24.0 p -60.31 -36.81 78.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.929 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -54.56 -34.08 61.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.251 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -46.7 93.48 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.425 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.433 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.4 mt -64.53 -43.64 96.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.875 0.369 . . . . 0.0 110.303 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 mp -62.95 -35.52 80.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.452 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -58.18 -28.07 64.43 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.569 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.77 -36.83 75.03 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.527 0.203 . . . . 0.0 110.789 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.423 ' HA ' ' HB2' ' A' ' 18' ' ' HIS . 1.2 mpp? -59.83 -37.58 79.6 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.46 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -98.71 0.71 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.626 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.09 10.75 23.1 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt 75.09 21.58 1.92 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.372 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -111.13 -35.09 6.0 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.04 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.483 ' NE2' HG11 ' A' ' 98' ' ' VAL . 11.1 m-70 -124.61 18.16 8.79 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.29 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.63 -37.21 56.72 Favored 'General case' 0 N--CA 1.46 0.063 0 CA-C-O 120.652 0.263 . . . . 0.0 110.956 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.93 -38.19 76.14 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.028 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 6.6 m-85 -77.5 -32.36 54.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.248 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.454 ' HB1' ' CD1' ' A' ' 26' ' ' TYR . . . -94.39 8.08 43.23 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.435 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.9 t90 -69.92 -51.55 14.72 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.435 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.0 Cg_endo -76.39 2.13 7.63 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.308 2.005 . . . . 0.0 113.435 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -150.54 58.24 0.94 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.013 0.435 . . . . 0.0 111.011 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.454 ' CD1' ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -112.25 -54.37 2.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.665 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -72.02 153.27 92.8 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.47 -179.56 0.2 Allowed 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.894 2.396 . . . . 0.0 112.723 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.7 m -107.7 73.99 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.132 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -61.66 102.13 0.23 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.874 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.413 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.6 p -61.52 -35.62 68.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.636 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -71.79 -47.4 53.68 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.605 0.24 . . . . 0.0 111.307 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -46.38 54.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.2 mt -80.75 -21.28 41.22 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.82 58.57 8.13 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.466 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.414 HD13 ' HB2' ' A' ' 39' ' ' TYR . 0.4 OUTLIER -126.99 66.16 1.28 Allowed 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.934 0.397 . . . . 0.0 111.092 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -62.1 -21.17 64.77 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.354 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -76.46 -20.19 57.27 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.516 0.198 . . . . 0.0 111.29 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.452 ' CE1' HG13 ' A' ' 43' ' ' ILE . 1.1 t80 -59.05 -31.76 69.15 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 120.596 0.236 . . . . 0.0 110.786 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.4 t -60.15 -40.01 88.36 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.483 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -84.76 -37.95 20.22 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 121.262 -0.175 . . . . 0.0 111.2 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 12.2 mt -62.89 -33.42 60.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.452 HG13 ' CE1' ' A' ' 39' ' ' TYR . 40.0 mm -123.37 116.6 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.158 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -33.82 75.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.279 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -124.77 90.61 50.71 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.56 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.45 106.8 1.29 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.782 2.321 . . . . 0.0 112.452 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 27.0 mtp -146.46 144.7 29.84 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.298 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.74 172.09 13.45 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.606 ' HA ' HD12 ' A' ' 52' ' ' ILE . 0.4 OUTLIER -56.51 -43.28 79.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.01 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -61.99 -34.78 76.8 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.749 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 86.6 m -70.32 -41.74 72.88 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.702 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.606 HD12 ' HA ' ' A' ' 49' ' ' MET . 7.5 mt -66.64 -45.02 89.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.804 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -67.59 -34.63 77.41 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.037 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.3 t -57.55 -42.0 82.09 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.973 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -60.72 -49.6 76.84 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.814 0.34 . . . . 0.0 110.176 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.564 HD22 ' HE2' ' A' ' 67' ' ' PHE . 14.1 tp -60.99 -35.9 78.04 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -59.86 -39.58 85.7 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.119 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.4 15.18 11.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.925 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.36 28.54 16.95 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.59 0.234 . . . . 0.0 111.562 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -74.66 -37.35 62.73 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.722 0.296 . . . . 0.0 110.508 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.519 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 7.7 m-85 -73.91 100.67 3.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.819 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -69.91 -32.37 70.64 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.005 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -145.78 159.87 42.57 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.021 0.439 . . . . 0.0 111.473 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.557 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -70.66 -14.5 62.49 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.192 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -62.96 -45.52 92.04 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 120.69 0.281 . . . . 0.0 110.6 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -71.46 -32.46 68.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.794 179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.564 ' HE2' HD22 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -55.2 -53.49 55.3 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.969 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.2 -31.3 78.55 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.68 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.77 -41.36 95.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.668 0.271 . . . . 0.0 111.069 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.9 -38.96 64.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.361 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 67' ' ' PHE . 26.8 t -64.31 -46.23 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.734 0.302 . . . . 0.0 110.83 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.1 mtt-85 -59.18 -33.39 70.88 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.103 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.1 -46.63 50.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.931 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.25 -42.26 90.71 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -63.8 -38.75 92.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.9 m -66.33 -38.99 88.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.019 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.417 ' CG ' HG23 ' A' ' 43' ' ' ILE . 16.2 m-20 -70.9 -44.07 67.0 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.975 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -58.23 -34.12 70.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.101 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -56.66 -37.26 70.55 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.219 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -66.29 -47.77 72.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.205 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -72.46 -33.86 67.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.079 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.976 ' HB3' HG22 ' A' ' 89' ' ' VAL . 21.5 m-20 -65.39 114.01 13.83 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.132 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.638 ' O ' HG21 ' A' ' 89' ' ' VAL . 35.5 Cg_exo -58.43 167.59 4.76 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.902 2.401 . . . . 0.0 112.66 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.03 116.96 4.91 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.48 2.12 . . . . 0.0 112.334 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.4 t0 61.51 68.72 0.69 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.109 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.528 ' HB3' HG23 ' A' ' 89' ' ' VAL . 4.3 t-80 -125.77 158.96 33.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.04 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.15 -43.91 78.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.271 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.6 m -65.36 -34.34 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.976 HG22 ' HB3' ' A' ' 82' ' ' ASN . 28.4 t -63.93 -43.32 97.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.907 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.19 -36.98 73.89 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.978 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' MET . . . . . 0.417 ' HG2' ' CD2' ' A' ' 21' ' ' TYR . 10.3 mtt -66.85 -36.99 83.59 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.1 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.66 65.56 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.69 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.51 78.0 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.213 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.434 ' HD2' ' CE2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.96 -40.48 93.51 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.89 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.0 mt -68.98 -31.66 70.67 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.003 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.39 -49.17 62.01 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.877 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.6 -46.45 90.2 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.414 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.483 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.6 p -64.45 -42.98 96.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.315 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.04 -50.47 66.1 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.536 0.208 . . . . 0.0 110.5 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -42.66 90.59 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.103 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -47.81 84.02 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.992 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -44.15 80.11 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.103 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.557 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 1.9 t80 -65.07 -42.25 94.35 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.861 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.13 76.61 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.03 -44.6 68.91 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.168 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.6 ptm -68.77 -33.33 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.324 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.0 -41.83 15.45 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.058 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.06 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.64 0.257 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -61.66 -36.15 80.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.766 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.48 -37.82 88.76 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.191 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -72.49 -42.0 65.37 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.81 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -49.18 76.11 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.209 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.3 p -62.35 -36.71 83.08 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.017 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.6 t -54.47 -34.79 62.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.958 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.64 -40.12 96.04 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 121.064 -0.588 . . . . 0.0 112.589 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.4 mt -64.14 -39.28 84.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.518 HD13 ' CD2' ' A' ' 56' ' ' LEU . 0.5 OUTLIER -63.34 -35.48 80.54 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.643 179.114 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.2 -29.64 65.83 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.571 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG3' ' HD3' ' A' ' 17' ' ' LYS . 0.7 OUTLIER -58.63 -36.59 74.32 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.402 0.144 . . . . 0.0 111.049 179.459 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.451 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.2 mtt -58.89 -37.24 76.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.705 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -103.72 10.24 36.8 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.454 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -104.08 16.55 26.0 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.638 0.256 . . . . 0.0 111.534 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.61 28.54 9.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.26 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HD3' ' HG3' ' A' ' 12' ' ' GLU . 22.0 mttm -115.88 -35.78 4.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.129 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.619 ' CE1' HD23 ' A' ' 95' ' ' LEU . 2.6 t-80 -134.44 27.17 3.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.885 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.451 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -80.77 -32.13 35.61 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.29 94.09 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.208 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -83.24 -32.09 26.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.48 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -95.95 12.42 30.43 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.451 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -74.3 -53.72 3.55 Favored Pre-proline 0 CA--C 1.532 0.279 0 O-C-N 122.505 -0.122 . . . . 0.0 111.112 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.451 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 3.0 Cg_exo -74.51 -1.94 11.73 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.773 2.315 . . . . 0.0 113.222 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.4 50.89 2.18 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.989 0.423 . . . . 0.0 111.06 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -109.15 -47.52 3.41 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.781 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.6 156.06 56.23 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.247 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.66 -172.76 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.882 2.388 . . . . 0.0 112.74 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -111.91 76.47 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 121.112 0.482 . . . . 0.0 111.211 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.58 107.2 1.09 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.017 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 36' ' ' LEU . 9.5 p -62.31 -38.71 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.545 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.05 -45.58 60.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.587 0.232 . . . . 0.0 111.342 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.2 -48.24 52.72 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.065 0.395 . . . . 0.0 112.065 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -81.54 -21.66 38.38 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.55 58.62 5.31 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.479 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -130.61 74.27 1.59 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.227 -179.791 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -70.9 -8.06 50.22 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.013 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.33 -20.02 57.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 121.344 -0.142 . . . . 0.0 111.193 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.87 -43.66 98.1 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.937 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.3 -38.84 90.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.717 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.36 -36.6 84.67 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.695 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.405 HG22 HG13 ' A' ' 43' ' ' ILE . 13.2 mt -78.39 -52.83 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.234 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.405 HG13 HG22 ' A' ' 42' ' ' ILE . 3.2 mt -128.91 141.47 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.806 0.336 . . . . 0.0 111.503 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.53 -31.88 12.55 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.489 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -120.7 65.34 12.37 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 120.671 0.272 . . . . 0.0 111.414 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.06 164.08 30.0 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.853 2.369 . . . . 0.0 112.718 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.1 ttm -148.37 158.89 44.38 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.5 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -138.16 164.52 28.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.21 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -40.41 78.84 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 t -62.66 -41.55 99.12 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.56 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 4.9 m -64.57 -42.32 95.71 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.972 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.559 HG23 ' OH ' ' A' ' 61' ' ' TYR . 15.5 mt -69.69 -45.08 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.967 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? -66.11 -34.21 77.54 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.22 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -57.5 -40.03 77.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.877 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -48.22 82.65 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.518 ' CD2' HD13 ' A' ' 10' ' ' LEU . 13.5 tp -63.96 -35.18 79.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.729 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.92 -40.99 97.76 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.503 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.86 15.37 11.43 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 60.58 28.08 17.77 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.663 0.268 . . . . 0.0 111.401 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -74.51 -33.94 62.91 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.766 0.317 . . . . 0.0 110.528 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.559 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.2 m-85 -70.11 105.99 3.1 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.888 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttm-85 -69.62 -29.0 66.4 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.245 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.37 164.42 38.3 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.44 -23.0 64.56 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.242 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.87 -38.32 90.38 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.742 0.306 . . . . 0.0 110.482 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -70.3 -35.22 73.56 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.512 ' O ' HG23 ' A' ' 71' ' ' VAL . 16.4 t80 -59.42 -48.52 81.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.533 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.88 -33.0 81.65 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.464 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.61 -37.46 84.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.555 0.217 . . . . 0.0 111.435 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -76.43 -30.76 57.54 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.269 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 67' ' ' PHE . 39.3 t -66.3 -48.57 80.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 111.027 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -64.5 -34.68 78.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.945 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.6 tp -69.06 -46.98 66.47 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.765 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 ttp -59.6 -46.43 88.96 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.198 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.462 ' CZ ' ' HB2' ' A' ' 96' ' ' GLN . 4.5 m-85 -60.88 -39.79 90.56 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.183 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 24.7 t -59.51 -46.32 89.18 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.846 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -74.99 -41.68 59.04 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.784 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.4 m -60.97 -34.94 75.55 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.287 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -60.28 -35.03 74.6 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.653 0.263 . . . . 0.0 111.215 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -71.63 -35.85 70.55 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.85 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -82.82 -40.94 19.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.347 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.666 ' HB3' HG22 ' A' ' 89' ' ' VAL . 29.2 m-20 -69.45 116.59 44.27 Favored Pre-proline 0 N--CA 1.464 0.262 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.081 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.539 ' O ' HG21 ' A' ' 89' ' ' VAL . 50.7 Cg_exo -54.71 153.62 23.58 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.916 2.411 . . . . 0.0 112.576 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.03 136.83 28.01 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.565 2.177 . . . . 0.0 112.151 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 t70 58.19 61.24 2.37 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.03 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.689 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.4 t-80 -126.97 150.16 49.52 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.911 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -56.52 -44.12 80.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.326 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.71 -35.89 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.198 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.689 HG23 ' HB3' ' A' ' 86' ' ' HIS . 19.5 t -64.98 -45.74 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.779 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.83 78.69 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.802 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.7 mtp -61.46 -46.59 89.44 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.711 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -56.01 -50.17 71.63 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.934 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -58.87 -41.11 86.31 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -61.99 -42.02 98.69 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.996 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 92' ' ' ALA . 5.5 mt -60.51 -41.5 94.48 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.838 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.08 -41.88 73.51 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.916 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.55 -46.67 89.31 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.252 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.1 p -66.69 -42.64 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.014 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -47.04 79.57 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.825 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.62 -46.35 90.6 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.625 0.25 . . . . 0.0 110.976 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -47.7 84.65 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.95 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.0 mmt180 -67.66 -38.77 84.25 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.451 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -58.41 -50.71 72.72 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.009 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.13 -35.67 77.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.229 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.8 62.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.396 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.451 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 2.0 ptm -69.26 -34.01 74.11 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.93 -41.64 15.73 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.6 0.238 . . . . 0.0 110.911 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 117.947 -1.025 . . . . 0.0 111.044 -179.812 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 120.705 0.288 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -57.02 -37.11 71.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt -61.24 -46.61 89.7 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.822 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -67.73 -34.48 76.93 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.825 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.65 -39.61 70.24 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.831 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -65.59 -39.05 91.16 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.54 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -35.65 68.37 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.059 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.18 -47.58 90.38 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.109 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 32.4 mt -64.89 -44.25 96.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-O 120.788 0.328 . . . . 0.0 110.319 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.527 HD11 ' CZ ' ' A' ' 67' ' ' PHE . 2.8 mp -62.42 -35.79 80.35 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.737 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mtmt -58.47 -28.19 65.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.375 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 33.3 tt0 -58.48 -36.63 74.04 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.841 -0.163 . . . . 0.0 110.967 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -57.46 -37.11 72.33 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.487 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -107.67 9.96 29.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.63 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.472 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -92.04 12.06 23.21 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.8 tttm 73.03 26.97 2.12 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.528 0.331 . . . . 0.0 111.284 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 25.7 mttt -120.8 -35.39 3.37 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.346 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.703 ' CD2' HD23 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -131.77 25.7 4.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.172 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.52 -34.48 31.2 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.068 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.73 76.47 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.437 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -79.58 -32.57 42.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.381 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.14 15.29 28.75 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -61.83 4.8 Favored Pre-proline 0 CA--C 1.53 0.193 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.64 -19.76 64.94 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.258 1.972 . . . . 0.0 112.799 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.38 35.94 4.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.475 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 -40.95 10.21 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.011 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -89.87 163.44 32.38 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.288 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -81.16 -174.53 2.25 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.945 2.43 . . . . 0.0 112.758 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.0 m -113.83 75.14 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.091 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -58.6 103.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.055 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.552 HG23 ' C ' ' A' ' 36' ' ' LEU . 10.4 p -61.55 -39.19 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.633 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -72.05 -45.51 60.53 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.52 0.2 . . . . 0.0 111.536 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.95 -48.36 45.75 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 mt -81.21 -21.5 39.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.87 57.68 6.22 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.411 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.552 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -129.81 73.83 1.55 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.98 0.419 . . . . 0.0 111.21 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -71.69 -8.92 57.09 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.715 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.6 -20.1 57.13 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.461 0.172 . . . . 0.0 111.388 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.483 ' CD2' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -61.57 -41.81 97.94 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.884 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.68 -39.18 90.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.736 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.05 -39.62 94.48 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.628 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.471 HD12 ' HA ' ' A' ' 39' ' ' TYR . 5.8 mt -74.81 -51.66 21.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.843 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.458 HD13 ' HB2' ' A' ' 77' ' ' ASN . 10.0 mt -130.35 112.24 22.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -11.79 60.63 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.822 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.448 ' H ' HG22 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -126.93 71.79 75.38 Favored Pre-proline 0 CA--C 1.534 0.341 0 CA-C-O 120.71 0.291 . . . . 0.0 111.047 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.0 145.48 99.06 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 122.897 2.398 . . . . 0.0 112.539 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 mmt -147.89 139.45 23.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.232 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -145.39 165.54 28.2 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.835 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.439 ' HA ' HD12 ' A' ' 52' ' ' ILE . 3.4 ttm -57.01 -36.56 70.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.646 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.0 t -66.35 -39.34 89.11 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.812 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.2 m -67.2 -40.11 86.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.982 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.561 HG23 ' OH ' ' A' ' 61' ' ' TYR . 13.3 mt -68.46 -45.19 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.99 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -66.09 -35.22 79.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.127 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.6 t -57.64 -42.98 84.51 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.967 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.38 -47.75 84.72 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.59 -34.53 77.19 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.693 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.81 -41.31 99.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.295 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.81 15.29 11.51 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 59.91 28.45 17.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.689 0.28 . . . . 0.0 111.424 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -72.99 -34.1 66.23 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.517 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.561 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.8 m-85 -72.86 103.09 3.59 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.49 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -67.3 -29.76 69.43 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.226 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -155.65 178.1 10.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.812 0.339 . . . . 0.0 111.281 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.34 -25.25 62.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.62 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -42.07 99.62 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.774 0.321 . . . . 0.0 110.267 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.92 -37.67 88.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.802 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.527 ' CZ ' HD11 ' A' ' 10' ' ' LEU . 27.2 t80 -59.41 -51.86 68.07 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.806 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.22 -31.53 77.34 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 121.049 -0.595 . . . . 0.0 112.696 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 72' ' ' ARG . . . -58.8 -39.39 80.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.611 0.243 . . . . 0.0 111.32 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.68 -33.11 58.26 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.169 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 67' ' ' PHE . 40.7 t -67.44 -46.75 82.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.604 0.24 . . . . 0.0 110.789 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 15.5 ptt180 -59.09 -36.99 76.07 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.85 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.15 -42.09 66.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.629 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -62.17 -46.77 87.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.129 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.39 -35.57 80.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.053 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.6 t -59.78 -47.63 84.91 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.117 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.458 ' HB2' HD13 ' A' ' 43' ' ' ILE . 15.9 p30 -75.82 -30.74 59.1 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.584 0.231 . . . . 0.0 110.868 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.91 -41.88 97.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.822 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -61.19 -33.59 73.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.409 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -71.16 -44.47 65.46 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.06 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -75.25 -37.28 61.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.311 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.78 ' HB3' HG22 ' A' ' 89' ' ' VAL . 9.1 m-20 -58.28 115.11 10.26 Favored Pre-proline 0 N--CA 1.465 0.282 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.34 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.489 ' O ' HG21 ' A' ' 89' ' ' VAL . 34.4 Cg_exo -58.45 163.15 10.97 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.971 2.447 . . . . 0.0 112.629 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -73.91 126.44 10.66 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.638 2.226 . . . . 0.0 112.45 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t0 58.47 62.42 1.97 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.157 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.471 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.5 t-80 -123.06 154.09 39.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -56.81 -43.8 81.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.245 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 22.1 m -59.7 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.324 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.78 HG22 ' HB3' ' A' ' 82' ' ' ASN . 22.5 t -62.77 -44.77 99.76 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.922 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.55 -41.83 95.31 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.823 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.9 mtt -65.05 -43.61 91.72 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.606 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.497 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -60.91 -48.18 83.02 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.021 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -46.98 77.4 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.0 tttp -63.02 -38.06 89.67 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.842 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.703 HD23 ' CD2' ' A' ' 18' ' ' HIS . 12.6 mt -66.91 -36.27 81.88 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.086 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 7.5 tm0? -70.06 -47.85 60.27 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.074 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -61.3 -46.84 88.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.496 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.401 HG13 ' N ' ' A' ' 99' ' ' PHE . 14.1 p -63.36 -43.31 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.234 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.401 ' N ' HG13 ' A' ' 98' ' ' VAL . 2.2 t80 -65.32 -51.01 63.46 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.591 0.234 . . . . 0.0 110.803 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -42.77 92.82 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.89 85.88 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.873 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -65.66 -44.18 87.11 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.982 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -43.47 95.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.757 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.8 -44.22 90.64 Favored 'General case' 0 N--CA 1.46 0.065 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -64.72 -40.91 96.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.603 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -44.4 72.04 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.827 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -72.23 -42.34 65.82 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.206 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.492 -0.766 . . . . 0.0 110.839 179.848 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.628 0.251 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -61.42 -40.88 96.03 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.797 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -38.61 89.0 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.994 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -71.67 -36.1 70.53 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.806 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -50.19 61.61 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.556 ' HA ' HD12 ' A' ' 9' ' ' ILE . 29.7 p -62.25 -37.79 86.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.046 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.8 m -62.69 -36.42 82.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.915 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.11 -41.93 98.27 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.35 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.556 HD12 ' HA ' ' A' ' 6' ' ' CYS . 11.2 mt -63.97 -46.34 94.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-O 120.663 0.268 . . . . 0.0 110.657 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.9 mt -62.17 -36.25 81.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.86 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.6 mttp -58.84 -31.7 68.74 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.33 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 3.3 tt0 -58.1 -36.59 73.1 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.365 0.126 . . . . 0.0 111.016 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.0 mtt -56.87 -37.1 70.87 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.185 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.33 16.61 19.91 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.575 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -95.97 15.48 20.45 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.689 0.28 . . . . 0.0 111.53 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.31 24.03 1.13 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.595 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 48.8 mttp -116.91 -32.78 4.97 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.838 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.86 18.51 3.51 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.01 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.48 -35.71 81.37 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.494 0.183 . . . . 0.0 111.494 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.54 70.42 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.114 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.443 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 10.2 m-85 -99.71 -24.84 14.58 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.594 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.55 -16.17 35.37 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.623 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 12.2 t90 -53.45 -51.83 72.2 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.298 0.094 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.623 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 90.3 Cg_endo -82.74 -19.4 6.11 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.476 2.117 . . . . 0.0 113.189 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -97.42 36.16 1.52 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.622 0.249 . . . . 0.0 111.59 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.51 -58.15 0.99 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.858 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -66.35 138.46 95.86 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.966 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.01 160.72 32.62 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.787 2.325 . . . . 0.0 112.507 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 29' ' ' VAL . 8.7 m -88.91 87.49 2.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 121.024 0.44 . . . . 0.0 110.745 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.69 104.34 0.22 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.111 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.498 HG23 ' C ' ' A' ' 36' ' ' LEU . 12.9 p -59.73 -36.6 66.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.72 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.06 -47.03 54.57 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.29 49.95 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.77 -21.51 40.96 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.87 57.19 8.1 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.387 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.498 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -126.58 65.28 1.26 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 111.179 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -64.94 -19.71 66.09 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -76.15 -19.46 58.45 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.195 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.447 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -59.48 -41.83 90.71 Favored 'General case' 0 CA--C 1.526 0.056 0 CA-C-O 120.496 0.189 . . . . 0.0 110.786 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.51 -32.72 74.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.653 0.263 . . . . 0.0 110.948 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 m-20 -75.81 -45.77 34.19 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.03 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.617 HD12 ' CE2' ' A' ' 81' ' ' TYR . 49.3 mt -74.56 -34.45 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.461 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.447 HG13 ' CE2' ' A' ' 39' ' ' TYR . 33.0 mm -103.64 107.99 23.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.631 0.253 . . . . 0.0 111.16 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -68.52 -34.05 75.2 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.468 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -130.41 88.7 46.6 Favored Pre-proline 0 CA--C 1.532 0.253 0 CA-C-O 120.704 0.287 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.72 140.72 39.68 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.738 2.292 . . . . 0.0 112.632 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttm -160.61 153.62 21.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.018 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -147.56 162.0 39.98 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.5 tpp -54.54 -38.94 67.18 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 t -62.51 -39.71 94.39 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.449 0.166 . . . . 0.0 111.108 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.7 m -70.97 -40.62 71.82 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.982 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.4 HG22 ' CE2' ' A' ' 67' ' ' PHE . 15.4 mt -69.7 -44.83 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.546 0.213 . . . . 0.0 110.785 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.14 -35.1 79.18 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.671 -0.241 . . . . 0.0 111.1 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -44.01 84.26 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.082 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.63 -49.76 76.24 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.844 0.354 . . . . 0.0 110.109 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.6 tp -63.09 -34.29 77.28 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.716 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.37 -39.74 88.3 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.193 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.0 15.41 10.11 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 62.77 27.18 15.97 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.303 0.241 . . . . 0.0 111.585 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -75.95 -34.43 59.83 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.84 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -78.21 99.35 6.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.938 0.399 . . . . 0.0 110.588 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -58.0 -32.58 68.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -146.55 168.21 21.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 111.057 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.18 -16.9 61.42 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.363 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -45.92 90.19 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.634 0.254 . . . . 0.0 110.334 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.41 -38.93 85.38 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.53 ' O ' HG23 ' A' ' 71' ' ' VAL . 20.1 t80 -63.42 -52.65 60.65 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.603 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -64.14 -31.34 80.5 Favored Glycine 0 C--N 1.335 0.51 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.151 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.92 91.22 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.829 0.315 . . . . 0.0 111.182 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -72.2 -30.33 64.85 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.43 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 67' ' ' PHE . 43.4 t -65.46 -47.99 84.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.759 0.314 . . . . 0.0 110.498 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 56.9 mtp85 -59.63 -39.68 85.1 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.25 -46.05 74.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.815 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -59.28 -46.8 87.57 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.249 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -66.09 -35.52 80.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.773 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.0 m -59.65 -46.77 88.03 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.503 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.21 -36.43 61.39 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.507 0.194 . . . . 0.0 110.977 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -39.09 83.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.231 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -57.3 -34.65 68.91 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.15 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.7 tttt -66.37 -44.02 84.32 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.598 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.617 ' CE2' HD12 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -70.39 -37.74 74.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.24 179.757 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.736 ' HB3' HG22 ' A' ' 89' ' ' VAL . 78.1 m-20 -65.61 111.62 6.67 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.529 ' O ' HG21 ' A' ' 89' ' ' VAL . 42.8 Cg_endo -67.18 147.14 78.41 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.629 2.219 . . . . 0.0 112.356 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 50.2 Cg_exo -53.55 131.74 45.29 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.671 2.247 . . . . 0.0 112.723 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t70 63.0 64.31 0.87 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.514 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.562 ' HB3' HG23 ' A' ' 89' ' ' VAL . 5.5 t-80 -136.8 155.94 49.15 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.034 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -55.8 -44.46 77.82 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.403 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.6 m -63.52 -35.24 71.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.637 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.736 HG22 ' HB3' ' A' ' 82' ' ' ASN . 26.2 t -60.8 -46.27 96.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.88 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.33 -33.7 76.45 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.027 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 6.0 mtm -64.42 -46.56 82.69 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.861 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.45 -44.29 96.77 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.839 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -65.84 -43.09 89.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.731 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.443 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 22.3 tttp -63.37 -42.94 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.103 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -66.65 -39.07 88.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -69.11 -43.79 73.73 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.703 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -61.48 -46.88 88.16 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.33 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p -66.33 -42.95 91.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.808 -0.178 . . . . 0.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -63.85 -51.59 63.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.862 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.39 -41.31 98.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -47.56 85.21 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.658 0.266 . . . . 0.0 110.839 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -43.9 78.32 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.798 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.456 ' HD1' HD12 ' A' ' 107' ' ' LEU . 0.3 OUTLIER -60.45 -42.89 97.08 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.027 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.04 -32.62 73.11 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.007 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -70.9 -44.43 66.27 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.987 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 9.2 ptm -69.06 -33.38 73.47 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.195 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LEU . . . . . 0.456 HD12 ' HD1' ' A' ' 103' ' ' PHE . 8.8 mt -83.89 -42.24 16.57 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.041 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.842 179.758 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 . . . . . 0 N--CA 1.488 1.438 0 CA-C-O 120.683 0.278 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -69.07 -34.75 75.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.948 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.06 -46.8 76.48 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.553 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -32.29 71.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.15 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.62 -40.91 84.65 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.563 0.22 . . . . 0.0 110.799 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.3 m -63.48 -38.95 93.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.856 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.9 m -56.93 -35.7 69.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.68 97.73 Favored Glycine 0 C--N 1.337 0.612 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.628 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 16.1 mt -65.47 -47.67 85.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.705 0.288 . . . . 0.0 110.66 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.493 HD13 ' HG3' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -63.45 -35.79 81.61 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.776 179.403 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -30.75 66.69 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.333 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.491 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 52.7 tt0 -58.55 -36.66 74.25 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.004 0.19 . . . . 0.0 110.829 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -58.53 -37.17 75.09 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.679 0.276 . . . . 0.0 110.397 178.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.82 5.29 33.0 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.491 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.81 17.84 11.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.629 0.252 . . . . 0.0 111.349 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 47.6 mmtt 68.02 37.37 3.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.125 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.436 ' CD ' ' HG3' ' A' ' 12' ' ' GLU . 55.0 mttt -128.09 -39.28 1.75 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.07 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -123.73 19.09 9.47 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.374 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.01 62.76 Favored 'General case' 0 C--N 1.335 -0.052 0 CA-C-O 120.643 0.259 . . . . 0.0 111.106 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.69 -36.16 62.75 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.275 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 5.3 m-85 -81.42 -33.08 32.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.217 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.17 20.0 16.51 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.403 ' N ' ' CD ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.68 -50.88 62.16 Favored Pre-proline 0 CA--C 1.529 0.154 0 CA-C-N 116.94 -0.118 . . . . 0.0 111.049 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 23' ' ' TRP . 50.5 Cg_exo -53.88 -25.43 35.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.548 2.165 . . . . 0.0 112.934 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -118.84 37.11 4.2 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.132 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.16 -35.36 64.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.17 162.57 47.3 Favored Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.18 -177.4 0.12 Allowed 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.155 2.57 . . . . 0.0 112.768 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 m -120.91 83.78 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.252 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.03 101.85 0.31 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.7 p -61.83 -36.63 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.737 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -71.83 -47.65 51.69 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.563 0.22 . . . . 0.0 111.391 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -47.29 49.72 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.4 mt -80.91 -21.49 40.5 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.88 57.61 9.48 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.455 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.6 OUTLIER -126.05 74.5 1.44 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.051 0.453 . . . . 0.0 111.296 -179.862 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.92 -3.85 34.56 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.777 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -76.25 -20.0 57.8 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.37 0.129 . . . . 0.0 111.304 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.507 ' HA ' HD12 ' A' ' 42' ' ' ILE . 4.3 t80 -57.42 -34.06 68.53 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 116.671 -0.241 . . . . 0.0 110.969 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.48 -40.46 96.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.751 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.91 -41.02 75.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.476 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.507 HD12 ' HA ' ' A' ' 39' ' ' TYR . 12.8 mt -68.74 -51.44 45.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.305 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.96 150.5 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-O 120.941 0.401 . . . . 0.0 111.644 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.1 pttm -96.04 -32.77 12.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.677 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -110.96 83.39 3.63 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-O 120.705 0.288 . . . . 0.0 111.057 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -73.01 125.76 10.65 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.833 2.355 . . . . 0.0 112.65 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.1 mtp -148.63 141.36 24.56 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.148 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.66 168.99 13.6 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.493 ' HA ' HD12 ' A' ' 52' ' ' ILE . 26.9 mtt -56.31 -38.74 71.69 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.102 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.5 t -62.45 -35.72 80.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.833 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.3 m -73.18 -38.78 66.03 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.017 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' A' ' 49' ' ' MET . 19.7 mt -66.89 -45.13 88.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.917 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.493 ' HG3' HD13 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -69.31 -34.24 74.37 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.959 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -57.32 -42.91 82.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.729 -0.214 . . . . 0.0 110.901 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -62.02 -49.38 76.24 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.879 0.371 . . . . 0.0 110.112 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 56' ' ' LEU . 10.3 tp -63.76 -32.66 74.24 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.002 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.77 -40.6 88.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.651 0.262 . . . . 0.0 111.056 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.34 15.19 12.59 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.861 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.52 27.75 17.41 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.629 0.252 . . . . 0.0 111.599 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -70.68 -34.29 71.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.68 0.276 . . . . 0.0 110.689 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -73.63 106.55 5.44 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.608 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -80.58 -28.8 37.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.068 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -146.38 165.25 29.9 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.944 0.402 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.11 -15.67 61.48 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.55 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -63.1 -44.94 94.27 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.48 -37.98 77.49 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.848 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.1 t80 -66.53 -53.62 32.84 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.45 -38.0 84.87 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.665 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.92 -35.27 76.25 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.591 0.234 . . . . 0.0 111.22 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -76.17 -34.2 59.35 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.329 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.2 t -67.09 -48.24 79.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 120.621 0.248 . . . . 0.0 110.622 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.48 -34.03 76.88 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.082 179.656 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.25 -48.38 65.23 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -59.33 -42.72 92.12 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.3 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.11 -44.0 95.17 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.795 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -37.26 86.56 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.777 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -69.66 -47.85 61.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.832 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.24 -33.91 69.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.206 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -56.54 -39.45 73.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.149 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -75.01 -38.92 61.45 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.791 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -59.89 -31.86 70.2 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.674 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.779 ' HB2' HG22 ' A' ' 89' ' ' VAL . 21.8 p30 -92.89 148.57 36.13 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-O 120.811 0.338 . . . . 0.0 111.104 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.76 ' O ' HG21 ' A' ' 89' ' ' VAL . 97.7 Cg_endo -80.17 169.63 17.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.999 2.466 . . . . 0.0 112.653 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.22 128.67 11.49 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.513 2.142 . . . . 0.0 112.525 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 t70 62.51 69.26 0.61 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.283 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.855 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.7 t-160 -136.31 158.05 45.35 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.229 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.18 -44.68 96.06 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.326 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.3 m -64.7 -30.65 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.373 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.855 HG23 ' HB3' ' A' ' 86' ' ' HIS . 12.5 t -69.37 -40.73 80.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.893 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.58 -35.36 68.11 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.024 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' MET . . . . . 0.412 ' HG2' ' CD2' ' A' ' 21' ' ' TYR . 6.1 mtt -65.6 -44.29 87.05 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.744 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.27 -47.59 85.36 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.238 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -59.57 -43.41 93.63 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.745 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.417 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.0 tttt -68.62 -40.45 80.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.868 179.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -34.4 78.23 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.086 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -69.3 -44.0 72.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.698 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -63.54 -46.86 84.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.15 -43.09 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.198 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.0 -50.63 67.76 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.787 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -45.98 85.39 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.762 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.2 mtp -62.44 -46.29 89.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -64.73 -42.5 95.17 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.02 -45.26 95.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.815 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.68 73.18 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.9 -43.36 65.49 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.065 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.7 ptm -69.27 -33.32 73.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.214 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.46 -42.82 14.13 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.047 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.729 0.299 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -57.97 -36.94 73.3 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 mt -62.54 -34.82 77.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.024 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 -32.62 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.076 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.31 -48.22 57.58 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.068 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.661 ' HA ' HD12 ' A' ' 9' ' ' ILE . 30.1 p -66.11 -36.99 84.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.385 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 82.9 p -57.57 -34.42 69.18 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.96 -43.46 98.1 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.454 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.661 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.3 mt -63.99 -45.74 95.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.849 0.357 . . . . 0.0 110.058 179.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.582 HD21 ' HG2' ' A' ' 53' ' ' LYS . 9.3 tp -61.27 -35.46 77.36 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -36.38 73.01 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.142 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -37.82 82.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.822 -0.172 . . . . 0.0 111.18 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -37.39 75.76 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 110.273 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -108.45 17.65 21.85 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.299 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.73 0.14 57.17 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt 78.43 16.78 1.17 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.288 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.57 -36.22 6.25 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.63 179.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -113.55 -3.26 13.68 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.786 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.75 -29.47 68.18 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.447 0.165 . . . . 0.0 111.409 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.67 -46.1 83.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.649 0.262 . . . . 0.0 110.85 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.6 -34.21 71.89 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.865 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -98.15 19.55 13.93 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.572 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.505 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 42.6 t90 -59.58 -51.63 79.76 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 116.77 -0.196 . . . . 0.0 111.47 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 57.0 Cg_endo -70.35 -9.66 26.38 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.251 1.967 . . . . 0.0 113.01 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -120.13 43.16 2.77 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.044 0.45 . . . . 0.0 110.903 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.43 -37.95 11.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.683 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -107.86 160.93 25.0 Favored Pre-proline 0 N--CA 1.465 0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.055 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.35 -176.07 0.13 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.969 2.446 . . . . 0.0 112.761 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.31 79.43 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.11 0.481 . . . . 0.0 111.308 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.686 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 2.2 t0 -63.76 101.44 0.36 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.68 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.66 -39.53 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.715 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -71.92 -46.86 56.15 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.271 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -70.5 -48.75 54.16 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.51 -21.49 38.6 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.66 54.23 13.29 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.476 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 39' ' ' TYR . 0.5 OUTLIER -126.34 67.88 1.22 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.016 0.436 . . . . 0.0 111.148 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -65.41 -22.2 66.75 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.312 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.3 -19.89 57.83 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.318 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.471 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.4 t80 -60.79 -45.61 93.72 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-O 120.536 0.207 . . . . 0.0 110.964 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 26.8 t -63.48 -30.88 71.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.56 -34.39 62.93 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.882 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 mt -83.73 -34.81 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.517 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.678 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.8 mm -102.28 124.55 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -87.45 -33.27 19.1 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.392 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 75.26 68.79 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.738 0.304 . . . . 0.0 110.945 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.32 128.94 32.58 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.885 2.39 . . . . 0.0 112.692 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -152.18 141.32 21.32 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.036 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.35 162.7 31.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.789 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.407 ' HA ' HD12 ' A' ' 52' ' ' ILE . 0.0 OUTLIER -53.52 -39.89 65.01 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.716 179.628 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.7 t -64.14 -37.71 88.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.4 m -74.05 -36.49 64.37 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.297 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.65 HG23 ' OH ' ' A' ' 61' ' ' TYR . 9.6 mt -71.58 -44.3 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.859 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.582 ' HG2' HD21 ' A' ' 10' ' ' LEU . 3.9 mtpm? -64.21 -37.77 88.65 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 p -57.9 -38.76 76.41 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.372 0.13 . . . . 0.0 111.122 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -60.36 -48.25 82.55 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.5 tp -62.91 -34.98 78.57 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.468 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.17 -38.58 91.75 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.271 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.46 15.15 9.75 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 59.56 27.28 16.44 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.653 0.263 . . . . 0.0 111.504 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.67 -32.38 57.9 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.665 0.269 . . . . 0.0 110.594 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.65 ' OH ' HG23 ' A' ' 52' ' ' ILE . 4.7 m-85 -71.11 104.93 3.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.872 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -62.64 -30.77 71.61 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.96 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.99 172.48 11.43 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.764 0.316 . . . . 0.0 111.32 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.32 -17.58 64.29 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.589 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -62.82 -43.23 99.36 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.659 0.266 . . . . 0.0 110.507 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.89 -34.67 71.82 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.831 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.8 t80 -62.81 -53.38 55.12 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.073 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.21 -33.19 64.5 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.705 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.41 -44.88 86.03 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.529 0.204 . . . . 0.0 111.286 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -66.7 -30.76 71.08 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.343 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 67' ' ' PHE . 42.6 t -67.09 -47.33 82.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-O 120.692 0.282 . . . . 0.0 110.374 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -62.57 -41.29 98.83 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -47.63 83.53 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.724 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 12.8 tmm? -61.88 -45.98 91.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.893 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -61.92 -42.49 99.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.171 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.4 m -62.67 -42.8 99.81 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.147 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.678 ' HB3' HD12 ' A' ' 43' ' ' ILE . 2.6 m120 -73.86 -47.12 40.53 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.154 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.0 t -60.19 -37.39 80.06 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.243 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -60.72 -33.12 72.42 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.019 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -61.52 -35.69 78.44 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.728 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -85.53 -34.02 21.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.356 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.506 ' HB3' HG22 ' A' ' 89' ' ' VAL . 23.0 m-20 -56.76 111.67 3.59 Favored Pre-proline 0 N--CA 1.466 0.365 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.107 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.687 ' O ' HG21 ' A' ' 89' ' ' VAL . 50.0 Cg_exo -56.46 154.17 31.35 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.803 2.335 . . . . 0.0 112.654 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.0 136.22 24.49 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.569 2.179 . . . . 0.0 112.516 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.63 55.45 4.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.419 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.774 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.9 t-80 -121.79 148.62 44.44 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.7 -44.09 81.17 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.308 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.7 m -61.57 -33.17 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.384 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.774 HG23 ' HB3' ' A' ' 86' ' ' HIS . 25.4 t -65.5 -44.47 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.781 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.76 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.2 mtp -65.79 -42.37 90.81 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.73 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.5 -47.69 84.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.489 ' HD2' HG12 ' A' ' 89' ' ' VAL . 8.2 mtp180 -59.71 -44.14 93.83 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.809 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -41.97 91.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.721 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 80.3 mt -65.15 -34.43 78.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.184 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -69.12 -43.92 73.42 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.631 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.41 -47.08 83.48 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.162 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.69 -42.96 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.012 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -63.57 -50.91 67.62 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.817 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -44.29 93.57 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.019 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -48.11 83.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.023 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -42.67 86.28 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.404 ' O ' ' HG3' ' A' ' 106' ' ' MET . 0.5 OUTLIER -62.64 -46.95 85.88 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.017 179.791 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.79 81.93 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.25 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -43.58 65.44 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.368 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -69.7 -34.12 73.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.76 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.01 -42.08 15.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.615 0.245 . . . . 0.0 111.069 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 . . . . . 0 C--O 1.252 1.189 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.586 179.94 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.631 0.253 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -59.82 -36.33 76.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.931 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.459 HD22 HH21 ' A' ' 59' ' ' ARG . 13.8 mt -58.74 -46.74 86.72 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.9 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.07 -37.46 75.5 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.086 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -40.29 96.72 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.031 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.76 -37.76 79.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.914 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.6 t -58.07 -38.53 76.52 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.998 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -45.31 95.77 Favored Glycine 0 C--N 1.336 0.535 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.379 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -64.14 -42.97 97.23 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.77 0.319 . . . . 0.0 110.357 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.598 HD13 ' HE2' ' A' ' 53' ' ' LYS . 10.2 mt -62.37 -35.61 79.7 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.706 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -28.77 64.78 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.806 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.48 -37.12 74.87 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.587 0.232 . . . . 0.0 111.006 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -37.02 78.12 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.609 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.25 21.63 15.59 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -113.47 18.8 17.41 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.717 0.294 . . . . 0.0 111.506 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.47 28.59 4.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.246 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -117.21 -31.93 5.16 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.394 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.573 ' CE1' ' HG ' ' A' ' 95' ' ' LEU . 2.7 t-80 -148.58 30.49 0.82 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 110.832 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.81 -40.93 54.09 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.121 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.27 -37.13 74.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.119 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.442 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 25.4 m-85 -77.82 -34.17 52.13 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.435 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.588 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -103.34 20.91 16.9 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.413 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.93 -53.3 43.45 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-N 116.933 -0.121 . . . . 0.0 111.14 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.413 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 84.3 Cg_endo -78.36 -5.78 15.17 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.349 2.032 . . . . 0.0 112.907 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -106.36 37.79 2.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.645 0.26 . . . . 0.0 110.93 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -121.39 -58.09 1.8 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.954 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.65 145.62 92.67 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.888 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.96 -177.12 3.57 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.607 2.205 . . . . 0.0 112.679 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 29' ' ' VAL . 13.5 m -112.6 79.76 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.041 0.448 . . . . 0.0 111.172 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.588 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -58.94 104.35 0.23 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.968 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 36' ' ' LEU . 10.4 p -62.43 -39.8 85.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.548 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.26 -45.9 58.21 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.702 -0.227 . . . . 0.0 111.606 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.588 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.99 -48.48 44.56 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.318 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.0 mt -81.31 -21.48 39.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.59 58.41 5.42 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.458 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.558 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -130.92 75.93 1.69 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.898 0.38 . . . . 0.0 111.442 -179.835 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -6.16 45.15 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.741 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.28 -20.01 57.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.385 0.136 . . . . 0.0 111.291 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.18 -41.42 83.85 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.751 -0.204 . . . . 0.0 111.012 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -64.04 -40.35 96.11 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.652 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.62 -44.31 90.94 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.818 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.4 mt -71.82 -51.68 30.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.076 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 mt -128.11 104.12 11.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.915 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -59.36 -29.89 68.01 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.512 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -110.27 81.51 2.28 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 120.817 0.341 . . . . 0.0 110.615 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.21 139.03 37.73 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.668 2.246 . . . . 0.0 112.603 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.605 ' HB3' ' HE2' ' A' ' 74' ' ' MET . 8.7 tpp -149.56 138.56 21.18 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.245 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -136.75 164.42 28.31 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.722 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -52.43 -41.43 63.24 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.719 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.5 t -65.41 -38.85 91.17 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.781 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -71.43 -43.31 66.97 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.114 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.536 HG23 ' OH ' ' A' ' 61' ' ' TYR . 8.4 mt -65.14 -45.12 95.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.175 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.598 ' HE2' HD13 ' A' ' 10' ' ' LEU . 1.0 OUTLIER -65.24 -34.68 78.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -57.56 -40.25 78.53 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.983 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -60.25 -47.65 85.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.851 0.358 . . . . 0.0 110.121 179.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.5 tp -66.97 -33.42 75.54 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.595 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -64.11 -41.52 97.22 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.402 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.23 15.15 9.39 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.459 HH21 HD22 ' A' ' 3' ' ' LEU . 1.5 mmp_? 58.96 27.85 16.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.588 0.233 . . . . 0.0 111.394 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.9 -32.83 45.9 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.63 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.536 ' OH ' HG23 ' A' ' 52' ' ' ILE . 1.8 m-85 -65.4 105.7 1.22 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.933 0.397 . . . . 0.0 110.844 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -32.16 70.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -162.97 165.28 25.15 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.87 0.367 . . . . 0.0 111.596 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -20.11 64.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.267 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -62.78 -41.51 99.28 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 110.27 -0.271 . . . . 0.0 110.27 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -69.68 -34.18 73.6 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.887 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.448 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.1 t80 -59.2 -53.64 55.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.96 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.73 -35.94 90.77 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.373 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.67 -36.65 79.27 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -76.64 -38.99 53.72 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.167 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 67' ' ' PHE . 44.6 t -67.04 -47.75 81.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.948 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -59.28 -33.73 71.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.591 0.234 . . . . 0.0 110.789 179.49 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 tt -71.87 -42.1 67.26 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.473 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.605 ' HE2' ' HB3' ' A' ' 47' ' ' MET . 9.8 tpp -60.29 -46.6 89.27 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.197 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -55.71 -40.67 72.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.147 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.2 t -67.78 -41.81 82.65 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.014 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.41 -37.64 65.85 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.393 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -35.96 73.14 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.643 0.259 . . . . 0.0 111.073 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.85 -31.78 68.83 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.193 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.12 -36.03 80.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.748 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -35.94 22.27 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.06 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.838 ' HB3' HG22 ' A' ' 89' ' ' VAL . 15.8 m-20 -67.52 125.66 91.49 Favored Pre-proline 0 N--CA 1.466 0.325 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.071 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.719 ' O ' HG21 ' A' ' 89' ' ' VAL . 52.1 Cg_exo -54.92 158.5 11.04 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.981 2.454 . . . . 0.0 112.86 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -74.57 118.69 5.43 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.596 2.197 . . . . 0.0 112.478 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t0 62.57 70.58 0.56 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.071 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.733 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.0 t-160 -132.53 156.69 46.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.302 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -57.09 -44.28 83.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.186 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.9 m -64.39 -31.88 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.753 0.311 . . . . 0.0 111.141 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.838 HG22 ' HB3' ' A' ' 82' ' ' ASN . 25.8 t -65.73 -40.32 87.46 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.413 ' HA ' ' HD3' ' A' ' 93' ' ' ARG . . . -57.43 -34.42 68.92 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.918 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -33.04 73.81 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.73 66.01 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -68.1 -38.52 82.39 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.856 179.742 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.442 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -61.28 -44.98 96.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.78 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 22' ' ' ALA . 0.3 OUTLIER -66.14 -34.83 78.93 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.746 179.551 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -69.96 -41.65 74.22 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.593 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.38 -46.82 88.56 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.063 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.2 p -66.17 -42.92 92.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.898 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.88 -49.82 71.2 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.7 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.51 -40.97 98.43 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.85 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -47.75 84.54 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.68 0.276 . . . . 0.0 110.663 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -43.68 80.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.633 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -45.47 92.37 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.858 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.27 -42.56 95.65 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -70.24 -36.19 74.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.755 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -40.53 76.32 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.029 179.184 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.67 -42.55 17.99 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -178.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.45 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 . . . . . 0 N--CA 1.488 1.434 0 CA-C-O 120.706 0.289 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.8 -36.87 85.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.866 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.65 -44.14 96.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.845 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -67.86 -39.39 83.76 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.936 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.64 95.56 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.013 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.429 ' HA ' HD12 ' A' ' 9' ' ' ILE . 94.5 m -59.42 -37.24 77.55 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.786 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 m -55.05 -34.13 63.3 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.266 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.78 -47.4 91.15 Favored Glycine 0 C--N 1.337 0.614 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.399 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.1 mt -64.02 -46.64 93.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.791 0.329 . . . . 0.0 110.317 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.534 HD23 ' HG2' ' A' ' 53' ' ' LYS . 1.2 tp -63.02 -35.67 81.0 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.634 179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.47 -27.49 64.45 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.485 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.497 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -58.46 -36.54 73.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.359 0.123 . . . . 0.0 111.014 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.0 mtm -57.85 -37.23 73.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.721 0.295 . . . . 0.0 110.371 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.84 8.16 32.61 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.695 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.497 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.32 14.48 18.24 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.561 0.22 . . . . 0.0 111.48 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 68.53 32.24 4.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.984 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.2 mttm -123.17 -37.79 2.66 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -119.34 18.23 12.95 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.321 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.27 -29.98 48.28 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.278 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.61 -37.64 76.96 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.863 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.412 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 2.8 m-85 -80.16 -33.93 38.0 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.429 ' HB1' ' CE ' ' A' ' 49' ' ' MET . . . -98.07 19.38 14.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.881 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.48 -51.34 68.05 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 121.405 -0.118 . . . . 0.0 111.055 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.23 -23.2 75.2 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.614 2.209 . . . . 0.0 112.806 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -123.87 34.64 5.02 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.927 0.394 . . . . 0.0 110.542 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -76.95 -46.84 22.73 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.776 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 166.6 11.59 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.842 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.22 -171.41 0.7 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.63 2.22 . . . . 0.0 112.436 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.47 HG11 ' CE2' ' A' ' 39' ' ' TYR . 5.7 m -113.18 76.35 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.045 0.45 . . . . 0.0 111.275 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -60.1 98.56 0.06 Allowed 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.1 p -60.54 -38.65 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.833 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -72.12 -46.88 54.9 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.52 -48.34 41.18 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.5 mt -80.81 -21.5 40.83 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.15 52.13 47.04 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.35 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.47 71.66 0.85 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.05 0.452 . . . . 0.0 111.288 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -67.17 -14.85 63.3 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.477 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.17 -19.76 58.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.401 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.47 ' CE2' HG11 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -61.28 -39.07 89.04 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 116.74 -0.209 . . . . 0.0 111.056 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -37.9 86.44 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.773 0.32 . . . . 0.0 110.561 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -67.48 -41.73 84.12 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.917 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 18.0 mt -77.71 -54.77 11.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.239 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.811 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.3 mm -100.95 104.74 16.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.082 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -66.95 -27.3 67.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.486 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.67 72.38 78.14 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.698 0.285 . . . . 0.0 110.802 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -58.0 132.17 47.94 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.359 . . . . 0.0 112.489 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -158.42 127.63 5.66 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.31 170.81 9.92 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.931 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.616 ' HA ' HD12 ' A' ' 52' ' ' ILE . 18.2 ttm -55.73 -36.56 67.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.895 0.379 . . . . 0.0 110.182 179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.0 t -62.13 -38.93 90.81 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.677 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 m -73.29 -36.29 66.28 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.105 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 49' ' ' MET . 23.4 mt -66.51 -44.78 90.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.627 0.251 . . . . 0.0 110.981 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.534 ' HG2' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -66.24 -35.33 80.15 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.154 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.6 p -57.47 -41.14 80.03 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.472 0.177 . . . . 0.0 111.13 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -46.55 88.78 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.74 -34.73 78.49 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.775 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.38 -41.41 93.73 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.4 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.494 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . . . -90.66 15.28 11.3 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.31 27.55 16.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.649 0.261 . . . . 0.0 111.498 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 34.5 mt-10 -73.32 -32.74 64.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.743 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.468 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 4.6 m-85 -69.04 103.93 1.99 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.781 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -63.21 -29.39 70.74 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.476 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -166.41 179.68 5.44 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.904 0.383 . . . . 0.0 111.567 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.77 -20.94 61.08 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.409 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.86 -45.99 89.98 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.674 0.273 . . . . 0.0 110.327 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.76 -30.14 69.52 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.797 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.468 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -59.85 -49.74 76.53 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.595 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.92 -33.11 77.22 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.513 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.73 -35.87 75.44 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.567 0.222 . . . . 0.0 111.17 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.3 61.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.811 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.7 t -64.82 -48.32 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.081 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -33.75 74.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.031 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.3 tp -70.69 -47.06 61.79 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.62 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.7 ttp -60.49 -43.83 96.58 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.411 ' CE2' ' HB2' ' A' ' 96' ' ' GLN . 3.2 m-85 -58.43 -43.51 88.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 t -59.27 -45.54 90.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.735 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.811 ' HB3' HD12 ' A' ' 43' ' ' ILE . 58.9 m-20 -70.48 -39.92 73.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.724 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -42.5 91.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.106 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -58.12 -39.77 79.55 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.132 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.85 -45.65 73.99 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.978 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -72.17 -39.84 68.39 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.197 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.659 ' HB3' HG22 ' A' ' 89' ' ' VAL . 82.6 m-20 -67.9 125.25 91.15 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.187 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.684 ' O ' HG21 ' A' ' 89' ' ' VAL . 53.4 Cg_endo -69.32 164.46 34.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.714 2.276 . . . . 0.0 112.428 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.38 128.91 11.55 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.562 2.175 . . . . 0.0 112.585 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.8 t0 60.2 68.07 0.8 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.0 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.662 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-80 -131.63 157.8 42.73 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.28 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.33 -44.31 84.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.039 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.8 m -64.17 -32.87 59.13 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.163 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.684 HG21 ' O ' ' A' ' 83' ' ' PRO . 23.9 t -68.74 -44.62 82.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.31 73.2 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.884 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 42.1 mtt -66.07 -40.27 90.75 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.87 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.36 90.21 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -49.12 79.05 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.412 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.1 tttm -66.57 -39.21 88.36 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.891 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -35.16 76.47 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.411 ' HB2' ' CE2' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -68.98 -44.58 72.6 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.739 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.51 -46.71 84.83 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.28 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.616 HG23 ' NH1' ' A' ' 102' ' ' ARG . 9.3 p -62.22 -43.13 97.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.14 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -49.65 70.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.669 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -42.92 99.75 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -48.01 83.36 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.996 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.616 ' NH1' HG23 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -67.23 -44.27 79.9 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.912 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -59.83 -48.67 80.76 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.856 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.87 -37.59 84.72 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.521 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -72.1 -44.21 63.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 1.3 tmm? -67.03 -45.09 78.54 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.382 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -40.14 35.63 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.891 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.411 -179.666 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 120.744 0.307 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -59.58 -42.56 92.77 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.769 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD21 ' O ' ' A' ' 61' ' ' TYR . 5.8 mt -64.78 -46.11 83.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.813 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -33.6 74.01 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.954 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.57 -43.38 85.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.674 0.273 . . . . 0.0 110.724 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.591 ' HA ' HD12 ' A' ' 9' ' ' ILE . 93.9 m -62.55 -40.77 97.88 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.464 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -36.08 75.21 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.057 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.29 91.89 Favored Glycine 0 C--N 1.335 0.52 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.359 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mt -65.52 -47.51 86.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.705 0.288 . . . . 0.0 110.502 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.26 -35.61 80.92 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.16 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mttp -57.96 -31.14 66.58 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.229 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.433 ' CG ' ' HD3' ' A' ' 17' ' ' LYS . 4.3 tt0 -59.65 -38.07 80.42 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.502 0.192 . . . . 0.0 110.985 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.403 ' HA ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -61.67 -38.12 86.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.727 0.299 . . . . 0.0 110.484 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -96.35 -1.74 47.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.609 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.6 9.83 22.64 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 75.65 20.85 1.79 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.612 0.365 . . . . 0.0 111.335 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 9.8 mtpt -108.73 -38.94 5.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.32 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.472 ' NE2' HG11 ' A' ' 98' ' ' VAL . 6.6 m-70 -121.44 16.35 11.3 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.289 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.08 -32.42 59.25 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.336 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.75 96.03 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.738 0.304 . . . . 0.0 111.039 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -72.84 -36.32 67.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.906 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.29 24.89 10.82 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.498 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.469 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.41 -57.73 16.34 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.388 -179.647 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 24.5 Cg_endo -62.01 -17.15 54.41 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.372 2.048 . . . . 0.0 113.002 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.37 35.51 3.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 111.08 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.99 -35.61 37.2 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.633 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HB2' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -119.63 156.64 53.44 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.369 -179.759 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.426 ' HD2' ' HB2' ' A' ' 27' ' ' LYS . 29.6 Cg_endo -63.19 -178.55 0.46 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.902 2.402 . . . . 0.0 112.714 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.7 m -114.89 86.69 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.13 0.491 . . . . 0.0 111.156 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.44 103.56 0.25 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.713 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 36' ' ' LEU . 12.2 p -59.71 -40.94 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.14 -46.05 58.05 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.01 48.77 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 mt -81.91 -21.57 37.27 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.29 64.27 2.94 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.566 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.525 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -134.53 79.46 1.8 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.313 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -10.26 59.29 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.662 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -76.23 -19.64 58.18 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.418 0.151 . . . . 0.0 111.34 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.405 ' CZ ' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -57.75 -34.71 69.82 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.508 0.194 . . . . 0.0 111.141 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 35.2 t -65.21 -37.45 87.34 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.83 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -75.83 -43.41 46.08 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.213 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.7 mt -74.12 -61.6 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.279 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.405 HG13 ' CZ ' ' A' ' 39' ' ' TYR . 30.8 mm -90.96 106.62 17.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.28 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 pttp -66.14 -33.69 76.36 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -124.71 94.38 44.5 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.708 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.22 110.97 2.13 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.679 2.253 . . . . 0.0 112.364 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.7 tpp -144.21 133.32 22.88 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.68 163.57 27.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.184 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.611 ' HA ' HD12 ' A' ' 52' ' ' ILE . 67.6 mtt -54.72 -38.25 66.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.928 -179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 t -62.36 -38.15 88.42 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.604 0.24 . . . . 0.0 110.824 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 91.3 m -74.17 -39.84 62.95 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.993 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 49' ' ' MET . 9.2 mt -65.35 -45.08 94.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 120.574 0.226 . . . . 0.0 111.07 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -36.51 83.28 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.9 t -57.72 -39.43 77.26 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.917 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -49.57 77.07 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.8 tp -61.16 -34.08 74.46 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.468 179.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -65.29 -37.34 86.86 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.118 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.77 15.27 8.56 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 60.83 27.25 17.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.624 0.25 . . . . 0.0 111.546 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -34.21 53.85 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.803 0.335 . . . . 0.0 110.583 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.489 ' O ' HD21 ' A' ' 3' ' ' LEU . 6.0 m-85 -78.78 107.29 11.38 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.797 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -92.16 -27.38 17.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.222 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -139.15 164.06 30.78 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.894 0.378 . . . . 0.0 111.64 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.73 -18.63 60.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.509 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -45.2 93.73 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.593 0.235 . . . . 0.0 110.457 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -70.49 -36.81 74.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.705 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.449 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 5.6 t80 -63.98 -53.81 44.31 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.901 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.12 -31.51 77.04 Favored Glycine 0 C--N 1.334 0.461 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.661 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.77 94.65 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 111.446 0.165 . . . . 0.0 111.446 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.91 -39.12 83.63 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.401 HG21 ' CZ ' ' A' ' 99' ' ' PHE . 21.8 t -65.2 -48.22 84.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.972 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -64.83 -34.07 77.49 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.145 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -47.81 84.35 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.876 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -60.54 -41.02 93.63 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.949 179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -58.23 -46.36 86.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.93 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.7 m -63.33 -42.03 98.93 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.765 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.3 m-20 -69.27 -34.17 74.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.885 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.07 -33.77 73.86 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.262 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -60.65 -34.21 73.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.095 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.35 -41.25 73.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.853 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.55 -34.98 46.73 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.306 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -92.28 111.83 52.29 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.267 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -66.64 156.44 65.69 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.753 2.302 . . . . 0.0 112.312 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -66.95 154.66 73.89 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.58 2.187 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.67 37.75 15.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.187 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.479 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.8 OUTLIER -120.04 150.34 40.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.156 -179.82 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -44.02 85.33 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.7 p -56.76 -36.33 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.554 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.479 HG23 ' HB3' ' A' ' 86' ' ' HIS . 15.6 t -61.04 -44.48 98.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.659 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.65 -36.63 72.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.048 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.4 mtp -62.54 -44.14 97.07 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.898 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -40.66 96.9 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.319 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -47.96 82.76 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.716 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -62.83 -41.59 99.39 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.98 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -37.47 82.91 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.899 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -70.05 -41.83 73.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.656 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.67 -46.95 88.4 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.171 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.472 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.2 p -68.0 -42.92 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.195 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.401 ' CZ ' HG21 ' A' ' 71' ' ' VAL . 5.7 t80 -64.4 -51.54 62.72 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.569 0.223 . . . . 0.0 110.777 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -60.62 -44.09 96.74 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.075 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 4.7 mtp -60.09 -46.73 88.6 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.987 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.08 77.81 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.147 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -42.92 95.97 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.614 -0.267 . . . . 0.0 110.887 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.98 -32.77 73.41 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.91 -44.22 70.11 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.795 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.0 ptm -69.38 -34.67 74.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.359 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.09 -42.38 17.48 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.074 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.731 0.3 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -62.08 -43.84 97.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.901 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.41 HD22 ' O ' ' A' ' 61' ' ' TYR . 0.8 OUTLIER -58.87 -36.83 75.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.092 179.33 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -61.47 -34.79 76.05 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.956 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 47.7 t -62.38 -39.21 92.45 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.881 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.4 m -59.68 -38.57 81.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.881 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.2 t -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.75 -38.09 93.37 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.37 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.2 mt -66.68 -45.86 87.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-O 120.748 0.308 . . . . 0.0 110.38 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.52 80.32 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.802 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mtpp -58.38 -28.2 64.94 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.712 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -58.71 -36.45 74.27 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.585 0.231 . . . . 0.0 110.68 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.462 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 6.6 mtt -59.56 -37.23 77.89 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.556 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.67 1.9 38.1 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.22 19.5 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.647 0.26 . . . . 0.0 111.637 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 mmtt 68.62 28.59 5.72 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.304 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.2 mttt -116.1 -31.25 5.75 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.967 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 29.95 1.3 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.801 0.334 . . . . 0.0 110.805 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -78.15 -36.63 47.42 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.123 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.35 -31.36 69.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.264 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 23.8 m-85 -86.23 -29.81 22.86 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.584 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.646 ' HB2' HD21 ' A' ' 95' ' ' LEU . . . -113.24 23.25 13.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.584 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.5 t90 -62.77 -53.91 52.05 Favored Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 122.481 -0.137 . . . . 0.0 110.913 179.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 92.4 Cg_endo -83.94 -16.77 6.2 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.634 2.223 . . . . 0.0 113.539 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -101.8 33.54 2.97 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.634 0.254 . . . . 0.0 111.61 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -107.27 -46.07 3.96 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.054 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -85.62 161.21 51.61 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.235 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -68.73 166.47 26.03 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.837 2.358 . . . . 0.0 112.743 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.561 HG21 ' CZ ' ' A' ' 39' ' ' TYR . 9.8 m -90.43 82.41 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.152 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . 66.4 m-20 -59.74 105.1 0.34 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.053 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 36' ' ' LEU . 12.3 p -61.37 -40.34 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.744 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -72.22 -45.06 61.82 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . . . -71.27 -48.43 51.02 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.432 HD13 HD21 ' A' ' 36' ' ' LEU . 12.1 mt -80.75 -21.74 40.81 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.26 52.19 18.81 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.476 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.432 HD21 HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -128.17 75.74 1.64 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.97 0.414 . . . . 0.0 111.346 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.26 -11.47 60.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.409 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -17.42 59.45 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.458 0.169 . . . . 0.0 111.458 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.561 ' CZ ' HG21 ' A' ' 29' ' ' VAL . 11.5 t80 -55.79 -39.53 71.4 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.501 0.191 . . . . 0.0 111.129 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.37 -36.51 83.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.678 0.275 . . . . 0.0 110.65 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.78 -45.02 46.45 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.407 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.9 mt -75.4 -52.97 17.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.706 0.288 . . . . 0.0 111.427 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.412 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.1 mm -92.2 104.85 16.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.154 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -72.1 -34.15 68.4 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.365 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -114.37 92.37 27.55 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.83 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.34 128.4 18.29 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.677 2.252 . . . . 0.0 112.563 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.86 139.98 14.25 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.384 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.1 164.03 32.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.283 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.817 ' HA ' HD12 ' A' ' 52' ' ' ILE . 5.7 mtt -58.05 -36.48 72.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.909 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.0 t -61.8 -34.69 76.37 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.63 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.45 -36.47 63.35 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.175 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.817 HD12 ' HA ' ' A' ' 49' ' ' MET . 7.7 mt -68.65 -44.62 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-O 120.676 0.274 . . . . 0.0 110.828 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -62.59 -45.37 93.23 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.203 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 p -57.59 -39.12 76.08 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.806 -0.179 . . . . 0.0 110.875 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.427 ' HD3' ' CZ ' ' A' ' 61' ' ' TYR . 20.2 tttp -60.35 -48.66 80.77 Favored 'General case' 0 N--CA 1.462 0.137 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -35.5 81.34 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.318 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.32 -37.34 86.88 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.279 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.04 15.23 7.62 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.79 27.42 17.2 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.281 0.232 . . . . 0.0 111.597 -179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -80.84 -34.53 33.76 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.725 0.297 . . . . 0.0 110.674 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.427 ' CZ ' ' HD3' ' A' ' 55' ' ' LYS . 3.3 m-85 -77.4 93.37 4.06 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.489 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.0 mtt85 -65.42 -28.87 69.55 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.808 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -159.27 174.08 15.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.861 0.362 . . . . 0.0 111.366 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -10.39 59.68 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.888 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -62.99 -47.65 82.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.569 0.223 . . . . 0.0 110.614 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -72.97 -39.22 66.31 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.579 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.698 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.9 t80 -58.41 -53.7 55.31 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.27 -36.21 90.24 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.446 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.31 96.43 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.606 0.241 . . . . 0.0 110.986 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.98 -37.21 69.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.226 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 67' ' ' PHE . 22.7 t -64.11 -48.46 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.384 0.135 . . . . 0.0 111.272 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -64.7 -32.87 74.73 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.734 -0.212 . . . . 0.0 111.2 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -47.13 74.73 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.806 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttm -59.3 -44.34 92.53 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.228 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -58.01 -42.26 84.86 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.046 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.06 -45.47 90.7 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.93 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.412 ' HB3' HD12 ' A' ' 43' ' ' ILE . 46.5 m-20 -74.73 -33.09 62.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.121 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -39.29 79.69 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.985 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -64.56 -32.18 73.72 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -67.88 -36.46 80.29 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.801 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -82.39 -38.15 24.53 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.333 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.879 ' HB3' HG22 ' A' ' 89' ' ' VAL . 42.2 m-20 -63.56 111.12 4.55 Favored Pre-proline 0 N--CA 1.466 0.357 0 CA-C-N 116.64 -0.254 . . . . 0.0 111.21 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.496 ' O ' HG21 ' A' ' 89' ' ' VAL . 23.6 Cg_exo -64.62 145.91 87.94 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.941 2.427 . . . . 0.0 112.513 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 43.8 Cg_exo -56.14 135.96 72.65 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.662 2.241 . . . . 0.0 112.384 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 t70 60.27 60.04 2.15 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.754 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.3 t-80 -130.66 151.93 50.57 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.94 -43.97 86.65 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.158 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.0 m -62.51 -32.15 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.599 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.879 HG22 ' HB3' ' A' ' 82' ' ' ASN . 34.5 t -62.77 -45.36 99.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.695 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -41.2 86.69 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.603 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.2 mtt -65.74 -43.39 89.13 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.745 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.58 -47.74 78.9 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.212 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -63.01 -48.92 76.71 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.829 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.434 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 36.0 tttp -62.48 -41.52 98.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.822 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.646 HD21 ' HB2' ' A' ' 22' ' ' ALA . 1.6 mt -63.47 -36.09 82.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.695 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -70.06 -44.28 69.47 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.765 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.17 -46.81 88.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.239 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.6 p -64.73 -42.77 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.922 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -51.32 62.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.436 0.16 . . . . 0.0 110.787 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -46.25 87.83 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.998 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -46.28 90.26 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.839 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -67.07 -43.98 81.24 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.822 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.14 -42.47 94.89 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.82 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.58 -32.84 74.65 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -71.52 -44.17 65.14 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.084 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 4.7 ptm -69.28 -36.06 76.68 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.322 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.5 -41.56 21.53 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.747 -0.206 . . . . 0.0 110.863 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.987 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.744 0.307 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -61.38 -43.44 98.86 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.856 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.99 -40.54 95.1 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.725 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.04 -34.6 78.44 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.144 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.62 -38.15 86.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.737 0.303 . . . . 0.0 110.775 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.0 m -64.52 -37.37 87.31 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.314 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.0 p -58.5 -40.99 84.36 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.7 -0.227 . . . . 0.0 111.147 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -63.07 -45.87 94.58 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.073 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.2 mt -64.28 -45.56 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 120.718 0.294 . . . . 0.0 110.29 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.692 HD22 ' HE3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -63.34 -35.53 80.69 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.641 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -58.15 -27.88 64.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.443 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -58.31 -36.33 73.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.406 0.146 . . . . 0.0 110.859 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.9 mmt -57.46 -37.54 73.03 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.499 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.92 10.78 28.39 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.65 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -91.46 11.21 24.71 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 75.2 26.9 1.16 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 122.578 0.351 . . . . 0.0 111.196 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -121.51 -34.89 3.35 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.455 ' CE1' ' HG ' ' A' ' 95' ' ' LEU . 0.7 OUTLIER -132.83 22.82 4.23 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.622 0.249 . . . . 0.0 111.016 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.97 -36.2 72.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.992 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.34 -36.41 66.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.215 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -75.84 -35.36 59.98 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.39 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB2' HD21 ' A' ' 95' ' ' LEU . . . -106.57 23.49 14.15 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -54.59 5.35 Favored Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 116.923 -0.126 . . . . 0.0 111.244 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -85.59 12.6 3.0 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.621 2.214 . . . . 0.0 113.23 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -130.53 56.13 1.78 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.03 0.443 . . . . 0.0 110.785 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.19 -48.82 1.0 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.051 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -64.77 154.08 86.38 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-O 120.599 0.238 . . . . 0.0 111.07 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.72 179.12 6.81 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.851 2.368 . . . . 0.0 112.737 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.7 m -92.57 68.9 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.018 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -59.49 98.97 0.05 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.067 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.11 -37.1 77.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.749 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.11 -45.83 59.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.584 0.216 . . . . 0.0 111.584 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.61 -47.71 45.58 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -80.94 -21.56 40.35 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.65 50.35 49.26 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.385 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -121.33 63.2 0.89 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.438 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -62.25 -18.2 60.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.448 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -76.06 -19.72 58.36 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.58 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -54.81 -39.11 68.14 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.617 0.246 . . . . 0.0 110.939 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -65.04 -40.44 94.81 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.8 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.46 -43.13 91.32 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.31 -45.4 75.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.965 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.516 HD13 ' HB2' ' A' ' 77' ' ' ASN . 7.7 mt -127.45 111.7 25.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.951 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -72.25 -29.86 64.32 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.358 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -118.68 66.96 7.36 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 110.784 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.82 156.42 39.39 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.769 2.313 . . . . 0.0 112.546 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.8 tpp -158.89 160.34 36.01 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.17 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -148.21 166.06 29.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.51 -37.3 70.25 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -65.67 -41.33 92.59 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.401 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -65.04 -41.03 95.59 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.047 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.502 HG23 ' OH ' ' A' ' 61' ' ' TYR . 18.0 mt -67.57 -44.9 86.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.9 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.692 ' HE3' HD22 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -62.45 -34.85 77.62 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.979 179.673 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.5 t -57.55 -42.23 82.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.041 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.75 -48.02 83.66 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.797 0.332 . . . . 0.0 110.177 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.3 tp -64.7 -33.69 76.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.844 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.23 -41.49 98.46 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.415 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.84 15.24 10.17 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 59.11 27.39 16.35 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.651 0.263 . . . . 0.0 111.551 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.42 -32.22 58.36 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.706 0.289 . . . . 0.0 110.687 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.502 ' OH ' HG23 ' A' ' 52' ' ' ILE . 1.8 m-85 -71.02 100.19 1.95 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.3 ttp85 -63.42 -31.54 72.72 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.141 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -162.65 174.56 12.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.826 0.346 . . . . 0.0 111.42 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.53 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -69.83 -14.55 62.81 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.885 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -46.61 87.51 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.663 0.268 . . . . 0.0 110.394 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.68 -35.48 72.83 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.013 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.412 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 3.3 t80 -61.88 -52.07 65.61 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -56.41 -33.36 61.85 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.631 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.51 96.01 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.562 0.22 . . . . 0.0 111.165 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.402 ' HB3' HG12 ' A' ' 52' ' ' ILE . 1.1 m-20 -63.55 -36.68 84.58 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.423 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -63.06 -48.39 88.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 120.713 0.292 . . . . 0.0 110.789 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.1 mmp_? -64.96 -40.15 94.56 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.621 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -41.88 95.32 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.753 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.1 ttp -62.71 -46.61 87.3 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.556 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -36.21 74.15 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 38.5 m -60.57 -47.48 86.01 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.044 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.516 ' HB2' HD13 ' A' ' 43' ' ' ILE . 12.2 p30 -75.99 -31.55 59.02 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 121.096 -0.242 . . . . 0.0 111.07 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.28 -33.58 76.15 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.219 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.53 -37.29 75.35 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.534 0.207 . . . . 0.0 111.28 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -72.61 -39.71 67.07 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -78.24 -38.48 42.86 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.721 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -62.53 128.13 91.08 Favored Pre-proline 0 N--CA 1.465 0.295 0 CA-C-O 120.554 0.216 . . . . 0.0 111.073 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.461 ' O ' HG21 ' A' ' 89' ' ' VAL . 72.6 Cg_endo -76.68 135.5 16.14 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.602 2.201 . . . . 0.0 112.392 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 36.8 Cg_exo -57.39 128.16 28.4 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.741 2.294 . . . . 0.0 112.406 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.0 t0 65.53 71.7 0.43 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.154 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.74 ' HB3' HG23 ' A' ' 89' ' ' VAL . 7.6 t-160 -141.65 148.21 38.78 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.077 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -56.6 -43.08 79.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.364 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.449 HG22 ' ND1' ' A' ' 86' ' ' HIS . 26.8 m -62.06 -35.74 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.13 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.74 HG23 ' HB3' ' A' ' 86' ' ' HIS . 30.0 t -66.4 -45.15 90.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.836 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.94 -39.04 80.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.814 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 24.8 mtt -63.05 -43.29 99.04 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.728 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.52 -48.61 80.25 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.5 mpp_? -54.62 -44.07 72.82 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.679 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -37.95 89.28 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.737 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.455 ' HG ' ' CE1' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -61.7 -37.26 83.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.972 179.571 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.03 -43.98 73.64 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.034 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.64 -46.59 89.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.34 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.53 -42.77 93.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.079 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.17 -50.32 66.39 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.913 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.55 -43.53 93.5 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.986 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -47.47 85.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.777 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? -67.86 -39.29 83.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.913 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.53 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 0.2 OUTLIER -65.3 -41.61 93.92 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.103 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.28 -32.91 74.81 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.284 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.4 tttp -69.72 -44.54 70.12 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.064 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 8.5 ptm -69.13 -33.38 73.36 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.089 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 12.9 mt -83.75 -41.55 17.5 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.273 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.052 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.684 0.278 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -61.67 -37.57 84.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.846 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.652 HD21 ' O ' ' A' ' 61' ' ' TYR . 3.7 mt -63.58 -46.91 83.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.065 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.19 -42.16 96.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.91 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.54 -44.35 96.57 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.586 ' HA ' HD12 ' A' ' 9' ' ' ILE . 34.5 m -58.96 -39.51 81.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.745 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 33.1 t -57.54 -41.13 80.33 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.055 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.12 94.46 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.578 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.586 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.2 mt -64.12 -46.25 94.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.719 0.295 . . . . 0.0 110.459 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.6 HD13 ' HG2' ' A' ' 53' ' ' LYS . 5.7 mt -62.75 -35.83 81.08 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.714 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -33.45 69.31 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.333 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 1.4 tt0 -58.55 -36.65 74.24 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.212 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.45 -36.98 72.11 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.431 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.67 12.62 22.6 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.478 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -96.71 17.86 15.6 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.724 0.297 . . . . 0.0 111.307 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 72.21 25.25 2.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.372 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 15.4 mtmt -118.69 -34.33 4.01 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.09 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.449 ' NE2' HG11 ' A' ' 98' ' ' VAL . 1.3 m-70 -132.42 21.72 4.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.001 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.8 -34.69 67.06 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.448 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.05 -40.28 68.45 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.744 0.306 . . . . 0.0 111.09 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -73.51 -34.21 65.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -111.62 28.69 8.51 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.483 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -68.33 -52.16 22.28 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.19 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.4 Cg_endo -85.5 11.15 3.44 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.554 2.17 . . . . 0.0 113.02 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -129.93 55.34 1.79 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.03 0.443 . . . . 0.0 110.825 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.86 -63.95 0.56 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.004 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 0.1 OUTLIER -65.74 143.41 98.55 Favored Pre-proline 0 CA--C 1.531 0.241 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.834 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 46.5 Cg_exo -57.31 156.66 24.65 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.91 2.407 . . . . 0.0 112.864 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.1 m -95.32 84.09 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.037 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.5 106.56 0.79 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.028 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.7 p -61.46 -38.42 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.621 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.3 -44.44 62.73 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.611 0.243 . . . . 0.0 111.483 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.73 43.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.3 mt -81.12 -21.54 39.79 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 57.19 7.37 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.424 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.423 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -126.34 64.04 1.25 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.04 0.448 . . . . 0.0 111.303 -179.83 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -67.63 -13.06 61.76 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.67 179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.23 -20.08 57.77 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.404 0.145 . . . . 0.0 111.237 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.511 ' CE1' HD13 ' A' ' 43' ' ' ILE . 1.0 OUTLIER -59.66 -35.65 74.85 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.557 0.218 . . . . 0.0 110.764 179.351 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.8 t -64.51 -38.68 91.85 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.947 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -67.18 -39.57 86.42 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.571 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.474 HD12 ' CE2' ' A' ' 81' ' ' TYR . 42.8 mt -74.13 -44.58 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.991 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.511 HD13 ' CE1' ' A' ' 39' ' ' TYR . 3.5 mp -137.82 137.01 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.656 0.265 . . . . 0.0 111.457 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -93.04 -25.45 17.94 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.804 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.91 79.82 2.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.71 153.77 38.74 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.707 2.271 . . . . 0.0 112.697 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.424 ' HB3' ' HG2' ' A' ' 74' ' ' MET . 5.6 ttm -165.64 158.87 15.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.362 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -144.28 163.95 32.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.565 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.6 ttm -54.98 -35.44 64.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.849 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 t -66.88 -40.94 87.93 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.747 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.7 m -66.83 -40.77 88.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.411 HD13 HG22 ' A' ' 71' ' ' VAL . 60.5 mt -66.81 -44.06 89.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 CA-C-O 120.78 0.324 . . . . 0.0 110.395 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HG2' HD13 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -66.76 -36.61 82.84 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.326 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -42.31 82.25 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.432 0.16 . . . . 0.0 111.432 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -62.72 -49.55 74.6 Favored 'General case' 0 N--CA 1.461 0.102 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.8 -34.75 76.46 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.585 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -59.44 -40.58 87.24 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.05 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.67 15.34 11.2 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.19 28.37 14.01 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.303 0.241 . . . . 0.0 111.636 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -75.45 -37.35 60.39 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.678 0.275 . . . . 0.0 110.84 179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.652 ' O ' HD21 ' A' ' 3' ' ' LEU . 7.1 m-85 -75.88 97.46 3.95 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.542 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -78.12 -31.85 50.11 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -126.55 142.59 51.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.816 0.341 . . . . 0.0 111.105 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.03 -19.36 64.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.844 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -47.98 80.85 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.677 0.275 . . . . 0.0 110.543 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -62.31 -38.26 88.75 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.777 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.465 ' HZ ' HD11 ' A' ' 10' ' ' LEU . 30.2 t80 -59.43 -53.85 53.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.88 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.78 87.74 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.711 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.2 74.72 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.571 0.224 . . . . 0.0 111.197 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.61 -39.93 64.2 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.312 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 67' ' ' PHE . 29.7 t -63.67 -48.41 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.683 0.278 . . . . 0.0 110.646 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -64.95 -39.1 92.98 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.755 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.81 -46.07 83.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.671 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.424 ' HG2' ' HB3' ' A' ' 47' ' ' MET . 4.8 tpp -65.49 -41.73 92.93 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.353 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -55.9 -44.96 78.73 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 110.752 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.6 t -62.2 -40.69 96.9 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.733 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.418 ' HB3' HG12 ' A' ' 43' ' ' ILE . 80.6 m-20 -68.03 -46.04 72.29 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.059 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.23 -35.48 79.03 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.465 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.38 -33.46 67.85 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.883 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.468 ' HD3' HG23 ' A' ' 42' ' ' ILE . 5.4 tttp -64.87 -36.74 85.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.584 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.474 ' CE2' HD12 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -80.93 -37.41 29.59 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.162 179.524 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.451 ' HB3' HG22 ' A' ' 89' ' ' VAL . 21.9 m120 -61.14 111.16 3.78 Favored Pre-proline 0 N--CA 1.469 0.486 0 CA-C-O 120.488 0.185 . . . . 0.0 111.076 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -61.46 163.81 16.95 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.859 2.373 . . . . 0.0 112.505 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.37 151.14 65.43 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.644 2.229 . . . . 0.0 112.401 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 53.22 49.29 20.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.408 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.717 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.9 t-80 -116.25 141.31 48.32 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.828 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -41.18 75.71 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.977 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 14.1 m -59.68 -32.79 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.578 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.717 HG23 ' HB3' ' A' ' 86' ' ' HIS . 32.9 t -65.71 -44.45 93.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.702 0.287 . . . . 0.0 110.574 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.32 93.87 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.876 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 11.8 mtt -61.28 -42.95 99.51 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.959 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.64 -44.66 81.5 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.269 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.68 -47.04 87.13 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -65.85 -40.22 91.5 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.2 mt -63.69 -38.79 92.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.962 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -70.16 -41.51 73.71 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.782 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -61.36 -46.86 88.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.143 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.449 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.3 p -66.06 -43.05 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.012 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -63.68 -50.14 70.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.722 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.9 -43.21 94.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.981 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -47.86 84.15 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.635 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -43.02 87.07 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.682 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.402 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.1 OUTLIER -59.64 -41.92 91.58 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.064 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.03 -37.08 80.95 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.907 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -67.07 -44.78 79.23 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.402 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 7.4 ptm -69.53 -33.46 72.83 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.256 179.588 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 19.1 mt -81.37 -42.1 20.97 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.356 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.406 179.834 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.762 0.315 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -66.62 -35.14 79.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.877 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.478 HD21 ' O ' ' A' ' 61' ' ' TYR . 11.1 mt -61.03 -44.48 97.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.78 179.407 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -35.21 70.85 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.116 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -39.3 84.33 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.653 0.264 . . . . 0.0 110.83 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.3 m -63.1 -37.74 88.41 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.34 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.1 p -57.39 -33.72 68.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.642 -0.253 . . . . 0.0 111.129 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.44 -43.05 97.77 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.325 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 48.9 mt -64.03 -42.45 95.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.915 0.388 . . . . 0.0 110.498 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.2 mt -63.74 -35.65 81.28 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.698 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -30.8 67.19 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.748 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.61 -36.72 74.48 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.296 0.093 . . . . 0.0 111.173 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -37.63 76.29 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.651 0.262 . . . . 0.0 110.492 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.08 6.45 35.93 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.47 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.486 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -91.04 13.67 16.14 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.566 0.222 . . . . 0.0 111.515 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 72.64 23.44 3.01 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.474 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.9 mtmm -115.33 -33.69 5.22 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.945 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.454 ' O ' ' HB3' ' A' ' 22' ' ' ALA . 3.0 m-70 -126.27 20.07 7.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.131 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.14 -33.98 61.6 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.62 67.52 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.333 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.401 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 6.8 m-85 -83.5 -32.66 25.82 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.381 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 18' ' ' HIS . . . -104.45 24.06 12.25 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -56.79 13.08 Favored Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.788 -0.187 . . . . 0.0 110.87 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -78.17 -4.17 14.08 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.536 2.158 . . . . 0.0 113.167 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -113.76 45.12 1.5 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.734 0.302 . . . . 0.0 110.998 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.79 -56.84 1.19 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.947 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 3.0 pttp -77.37 130.85 73.29 Favored Pre-proline 0 C--O 1.232 0.175 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.905 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 36.7 Cg_exo -60.52 -177.56 0.17 Allowed 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.858 2.372 . . . . 0.0 112.637 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.546 ' O ' HG23 ' A' ' 29' ' ' VAL . 29.4 m -123.93 77.09 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.062 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.716 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -56.21 106.29 0.26 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.728 179.923 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 36' ' ' LEU . 11.4 p -59.28 -40.11 80.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.672 -179.466 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -72.36 -46.8 53.8 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.716 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.25 -47.66 55.8 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.4 mt -81.59 -21.33 38.45 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.74 63.82 2.76 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.373 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -114.18 70.07 0.72 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.76 0.314 . . . . 0.0 111.132 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 16.9 m170 -65.62 -12.83 56.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.417 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.87 -19.96 21.16 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.534 0.207 . . . . 0.0 111.186 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -38.34 87.0 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.102 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -31.59 72.83 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.001 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -78.43 -47.2 18.02 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.753 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.2 mt -69.88 -38.76 76.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.321 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 32.2 mm -124.85 128.28 73.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.496 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -34.96 19.78 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.289 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -128.14 77.28 77.0 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-O 120.796 0.331 . . . . 0.0 111.004 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.83 128.45 15.06 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.779 2.319 . . . . 0.0 112.562 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 44.5 mtp -145.66 139.5 26.63 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.251 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -123.71 171.05 9.89 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.189 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 mtm -57.77 -43.11 85.27 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.198 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.404 ' HB3' ' HG3' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -62.0 -39.65 92.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.788 179.594 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.2 m -64.36 -44.46 91.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.646 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.419 HG23 ' OH ' ' A' ' 61' ' ' TYR . 15.2 mt -65.32 -44.31 94.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.433 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.87 73.58 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.2 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.5 p -57.48 -41.4 80.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.124 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -60.59 -49.63 76.75 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.02 -34.57 76.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.361 178.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.26 -37.18 86.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.997 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.55 15.29 9.65 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 62.45 28.44 16.8 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -76.99 -36.95 56.05 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.647 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.478 ' O ' HD21 ' A' ' 3' ' ' LEU . 28.9 m-85 -79.42 100.62 7.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.893 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 ttt-85 -64.91 -31.62 72.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -159.54 -177.44 6.4 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.931 0.396 . . . . 0.0 111.357 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.627 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -71.29 -12.67 61.57 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.788 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -47.37 83.64 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.671 0.272 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -73.5 -37.64 65.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.717 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.521 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.9 t80 -61.35 -53.04 61.8 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.031 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.94 -33.29 78.15 Favored Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.663 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.61 91.26 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.623 0.249 . . . . 0.0 111.108 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.34 -33.9 70.03 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.364 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.9 t -63.38 -48.47 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.623 0.249 . . . . 0.0 110.906 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.3 mtt180 -61.12 -36.81 80.71 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.847 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.67 -44.68 96.49 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.764 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.2 ttm -63.68 -46.75 84.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -58.38 -43.9 88.69 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.153 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.2 t -60.55 -43.25 97.42 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.041 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -73.47 -46.72 46.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.117 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -34.0 72.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.238 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -57.12 -35.87 69.99 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.014 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -66.5 -41.97 88.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.846 179.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -76.06 -31.26 58.7 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.297 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -91.9 102.59 6.38 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.257 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 89' ' ' VAL . 55.2 Cg_endo -69.12 133.4 26.64 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.617 2.211 . . . . 0.0 112.24 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -57.52 165.38 6.05 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.725 2.283 . . . . 0.0 112.674 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.36 31.22 8.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.02 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.472 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.9 OUTLIER -127.5 142.6 51.35 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.943 -179.817 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -56.73 -37.55 71.14 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.101 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.2 p -61.8 -40.22 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.389 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.599 HG21 ' O ' ' A' ' 83' ' ' PRO . 24.0 t -67.49 -39.95 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.82 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.28 -34.34 66.35 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.81 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -47.43 83.66 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.406 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.83 -44.73 96.26 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -42.83 87.88 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.509 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.401 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 2.8 tttp -66.36 -41.91 88.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.585 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.54 -36.46 84.3 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -46.95 64.18 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.883 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -46.68 89.31 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.9 p -62.61 -43.0 98.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.51 0.195 . . . . 0.0 110.775 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -49.22 70.86 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.401 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -41.29 94.12 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.957 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.0 mtm -61.23 -47.76 84.61 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -43.82 81.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.631 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.627 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 0.7 OUTLIER -59.27 -50.98 71.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.805 179.536 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.01 -37.99 89.4 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.1 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.9 mtpt -69.48 -41.35 76.27 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.738 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.93 75.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.211 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.51 -41.69 60.23 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.725 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.108 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.789 0.328 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -60.9 -36.86 80.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.848 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.91 -43.72 91.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.93 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -67.7 -40.66 84.3 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -38.16 88.55 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.085 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.9 m -60.21 -38.93 84.84 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.935 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -60.87 -37.0 80.65 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.019 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.3 -36.92 90.92 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.54 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.431 HG23 ' CD ' ' A' ' 102' ' ' ARG . 54.4 mt -64.13 -45.91 95.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 179.31 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.635 HD22 ' HE3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -62.67 -35.35 79.39 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.839 179.225 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -57.62 -32.55 67.34 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.496 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.477 ' CG ' ' HD2' ' A' ' 17' ' ' LYS . 5.6 tt0 -60.32 -36.66 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.386 0.136 . . . . 0.0 110.954 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.52 ' HE1' HD22 ' A' ' 95' ' ' LEU . 4.8 mtt -59.27 -37.0 76.54 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.93 4.79 37.94 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -90.01 12.92 16.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 77.96 24.09 0.72 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.858 0.463 . . . . 0.0 111.43 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HD2' ' CG ' ' A' ' 12' ' ' GLU . 54.0 mttp -113.79 -32.7 6.04 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.827 179.353 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.414 ' NE2' HG11 ' A' ' 98' ' ' VAL . 0.4 OUTLIER -137.76 25.81 2.8 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.878 179.226 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.68 -40.26 23.08 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.204 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.21 81.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.237 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -77.71 -33.38 53.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.394 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -112.06 25.99 11.03 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.464 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -69.37 -56.6 8.15 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 116.929 -0.123 . . . . 0.0 110.938 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 86.4 Cg_endo -81.82 -22.96 4.98 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.473 2.115 . . . . 0.0 112.987 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.12 35.52 1.73 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.639 0.257 . . . . 0.0 111.567 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.53 -38.42 6.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.829 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.5 mmtt -74.86 156.14 86.5 Favored Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.359 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.8 -172.32 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.921 2.414 . . . . 0.0 112.682 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.854 HG21 ' CE2' ' A' ' 39' ' ' TYR . 30.8 m -120.57 68.82 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 121.12 0.486 . . . . 0.0 111.612 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.473 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . 2.0 m-20 -62.85 108.4 1.18 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.977 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 36' ' ' LEU . 9.7 p -60.84 -40.75 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.534 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.19 -44.97 62.18 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.473 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . . . -71.51 -48.87 46.09 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.4 mt -81.09 -21.67 39.78 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.52 61.78 3.73 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.447 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.624 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -133.45 78.65 1.79 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.935 0.398 . . . . 0.0 111.244 -179.884 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -7.66 46.1 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.867 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.22 -19.92 57.93 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.439 0.161 . . . . 0.0 111.284 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.854 ' CE2' HG21 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -59.89 -44.72 94.08 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.853 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 22.4 t -61.21 -39.46 90.32 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.933 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.94 -35.29 80.18 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.729 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.555 HG22 HG13 ' A' ' 43' ' ' ILE . 17.4 mt -80.71 -49.65 18.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.168 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.887 HD12 ' CE2' ' A' ' 81' ' ' TYR . 26.5 mt -147.75 132.89 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.1 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.7 pttt -86.18 -20.08 29.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.753 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.53 ' H ' HG22 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -107.46 86.03 2.54 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.044 -179.751 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.2 143.35 39.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.769 2.313 . . . . 0.0 112.691 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -151.69 122.9 7.71 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.114 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -130.99 162.75 29.08 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.146 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.5 mtm -55.78 -40.85 73.24 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.37 -41.76 98.82 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -64.08 -40.94 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.986 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.411 HG23 ' OH ' ' A' ' 61' ' ' TYR . 12.4 mt -70.58 -45.15 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.635 ' HE3' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -66.39 -38.39 87.41 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.026 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.6 t -57.32 -41.34 79.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.844 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -60.49 -48.36 82.09 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 16.3 tp -64.26 -34.46 78.16 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.48 -39.56 94.79 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.311 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.22 15.21 9.28 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.5 27.14 16.78 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -75.5 -34.09 60.81 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.724 0.297 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.484 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 5.2 m-85 -71.06 104.65 3.08 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.581 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -28.69 66.63 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.34 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -159.71 167.94 27.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.769 0.319 . . . . 0.0 111.286 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.4 63.36 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.515 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -62.78 -42.68 99.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.657 0.265 . . . . 0.0 110.558 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -70.85 -33.18 70.39 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.817 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.484 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 15.3 t80 -62.48 -48.34 80.03 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.89 -32.91 81.37 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.622 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.66 -44.2 96.71 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.613 0.244 . . . . 0.0 111.152 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.76 -33.46 75.72 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.2 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.27 -46.64 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.723 0.297 . . . . 0.0 110.575 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -63.35 -39.51 94.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.714 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.1 tt -70.67 -43.33 69.33 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.794 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 9.0 tmm? -60.42 -44.69 95.5 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.012 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 4.2 m-85 -59.15 -40.66 86.24 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.984 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.4 m -62.33 -44.6 96.12 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -71.43 -40.34 70.49 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.903 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -38.0 84.97 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.035 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.84 -40.11 95.82 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.054 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.5 ttpt -75.14 -36.11 61.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.865 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.887 ' CE2' HD12 ' A' ' 43' ' ' ILE . 3.8 m-85 -69.07 -35.3 76.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.503 ' HB3' HG22 ' A' ' 89' ' ' VAL . 28.7 m-80 -82.01 136.84 46.86 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-O 120.63 0.253 . . . . 0.0 110.909 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.453 ' O ' HG21 ' A' ' 89' ' ' VAL . 72.5 Cg_endo -76.22 131.21 12.71 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.711 2.274 . . . . 0.0 112.368 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -57.27 147.43 76.79 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.604 2.202 . . . . 0.0 112.545 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 63.22 46.43 4.56 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.375 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.637 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-80 -128.02 148.28 50.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -44.01 80.54 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.469 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.7 p -58.85 -35.19 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.49 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.637 HG23 ' HB3' ' A' ' 86' ' ' HIS . 21.7 t -61.0 -43.67 96.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.902 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.35 76.0 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.916 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.23 88.83 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.773 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.8 -42.0 97.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.131 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.519 ' HD2' HG12 ' A' ' 89' ' ' VAL . 11.1 mtt180 -59.6 -43.96 93.56 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.687 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -61.51 -42.07 98.25 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.882 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.52 HD22 ' HE1' ' A' ' 13' ' ' MET . 87.3 mt -63.6 -30.92 71.97 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.082 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.02 -42.39 73.03 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.938 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -60.71 -46.83 88.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.065 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.414 HG11 ' NE2' ' A' ' 18' ' ' HIS . 10.1 p -66.79 -43.0 90.09 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.002 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -50.98 66.81 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.881 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -41.96 79.11 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.81 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -48.16 76.85 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.029 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.431 ' CD ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.84 -44.13 81.88 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.259 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.44 -49.34 69.55 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.802 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.36 -42.48 91.67 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -66.5 -42.22 87.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.919 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.87 -44.44 77.08 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.064 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.57 -40.1 61.85 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.647 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.008 -179.725 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 120.74 0.305 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -65.87 -39.48 90.74 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.754 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.28 -46.83 87.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.199 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.3 -38.01 89.5 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.838 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.27 -46.37 89.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.994 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -60.92 -39.42 89.33 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.4 m -56.03 -38.53 70.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.09 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.43 -43.25 97.6 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.624 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.8 mt -65.81 -44.87 92.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 120.748 0.308 . . . . 0.0 110.384 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.584 HD23 ' HZ ' ' A' ' 99' ' ' PHE . 50.3 mt -63.85 -35.91 82.18 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.63 179.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.79 -28.34 65.88 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 1.7 tt0 -58.34 -36.6 73.67 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.519 0.2 . . . . 0.0 110.935 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.455 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.4 tpp -57.96 -37.16 73.66 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.567 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.76 16.53 23.52 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.415 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.455 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -102.46 12.13 36.95 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.563 0.221 . . . . 0.0 111.533 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 tptt 71.42 25.93 3.36 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.377 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.409 ' CD ' ' HG2' ' A' ' 12' ' ' GLU . 12.7 mttm -113.34 -33.43 5.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.304 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.447 ' CD2' ' HB2' ' A' ' 21' ' ' TYR . 2.4 t60 -143.55 29.61 1.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -78.38 -38.1 42.58 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.123 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.49 92.84 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.998 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 18' ' ' HIS . 10.6 m-85 -72.61 -33.55 66.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.146 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.53 17.22 23.35 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.734 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -54.25 3.48 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.64 -5.52 16.12 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.3 2.0 . . . . 0.0 113.107 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.12 40.92 3.63 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.81 0.338 . . . . 0.0 111.047 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.42 -47.85 4.54 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.014 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -80.19 155.84 74.41 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.064 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.51 -173.7 0.73 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.716 2.278 . . . . 0.0 112.647 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 29' ' ' VAL . 31.2 m -111.39 84.64 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 121.131 0.491 . . . . 0.0 111.37 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -63.34 105.05 0.68 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.081 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG23 ' C ' ' A' ' 36' ' ' LEU . 12.3 p -61.9 -37.22 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.733 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -72.13 -45.75 59.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.574 0.226 . . . . 0.0 111.416 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.04 -47.84 48.8 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -80.84 -21.57 40.66 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.62 60.28 5.12 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.424 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.3 OUTLIER -127.66 66.85 1.32 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 111.325 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -63.59 -18.09 63.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.489 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -76.21 -19.08 58.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.588 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -57.63 -41.41 81.29 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.466 0.174 . . . . 0.0 111.058 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -63.55 -34.71 78.41 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.635 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -42.93 71.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.834 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 22.0 mt -73.77 -45.42 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.28 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.3 mm -121.2 119.84 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 120.674 0.274 . . . . 0.0 111.341 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -70.89 -34.3 71.43 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.49 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -129.77 77.91 76.09 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-O 120.75 0.309 . . . . 0.0 111.066 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.49 129.14 16.34 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.753 2.302 . . . . 0.0 112.5 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 73.9 mtp -132.54 155.6 48.34 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.499 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -140.1 167.32 22.41 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.303 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.0 tpp -56.38 -41.89 76.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -39.24 92.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.665 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.0 -45.08 87.05 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.811 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 27.3 mt -69.62 -45.02 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.153 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -64.64 -34.48 78.38 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.982 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.5 t -57.54 -40.25 78.42 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.082 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -61.38 -48.95 78.89 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -62.85 -36.01 81.86 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.474 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.15 -39.85 87.78 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.228 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.01 15.2 8.98 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.74 27.54 17.3 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -76.58 -35.47 58.15 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.595 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -73.68 105.07 4.83 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.75 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -79.56 -28.34 41.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.327 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -149.59 163.61 37.39 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 111.598 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.44 -18.08 63.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.778 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -62.79 -43.03 99.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.624 0.25 . . . . 0.0 110.533 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -69.95 -37.09 75.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.83 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.609 ' O ' HG23 ' A' ' 71' ' ' VAL . 26.4 t80 -65.69 -53.04 46.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.11 -37.59 80.83 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.617 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.54 -42.81 93.18 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.671 0.272 . . . . 0.0 111.006 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.3 -38.99 71.75 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.222 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 67' ' ' PHE . 41.2 t -62.54 -48.6 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.016 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -64.09 -37.87 89.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.646 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.41 -48.49 72.64 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.638 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -64.44 -42.83 95.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.083 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -57.14 -42.8 81.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.032 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t -63.38 -43.66 96.98 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.738 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -69.96 -41.53 74.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.949 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.38 -39.71 84.22 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.216 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.55 -34.43 72.65 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.141 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -65.69 -46.88 77.36 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -74.85 -40.9 60.74 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.142 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.526 ' HB3' HG22 ' A' ' 89' ' ' VAL . 24.7 m-20 -61.08 110.78 3.3 Favored Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.107 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.434 ' O ' HG21 ' A' ' 89' ' ' VAL . 57.7 Cg_endo -70.9 123.82 10.07 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.64 2.226 . . . . 0.0 112.223 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.64 161.37 1.32 Allowed 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.952 2.435 . . . . 0.0 113.005 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 61.06 42.21 12.82 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.74 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.715 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.7 OUTLIER -134.09 147.88 50.94 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.271 -179.392 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -58.35 -41.78 85.46 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.131 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.525 HG22 ' CD2' ' A' ' 86' ' ' HIS . 27.0 m -60.55 -36.66 71.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.634 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.715 HG23 ' HB3' ' A' ' 86' ' ' HIS . 17.5 t -65.3 -47.47 87.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.68 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.61 91.53 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.967 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.8 mtp -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.01 -50.43 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.9 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -40.44 89.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.748 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -41.81 97.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.791 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.76 -34.65 77.67 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.008 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.98 -43.37 71.61 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -61.53 -46.8 88.4 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.281 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -64.87 -42.87 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.861 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.584 ' HZ ' HD23 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -64.19 -50.59 67.49 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.849 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.26 -45.52 83.93 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.058 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -47.88 84.33 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.042 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -67.49 -44.14 79.23 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.133 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.404 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 1.2 t80 -63.2 -42.74 99.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.836 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.57 74.34 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.066 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -71.65 -44.57 64.08 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.139 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 9.8 ptm -69.38 -35.78 76.16 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.76 -41.34 19.3 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.574 0.226 . . . . 0.0 111.35 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.979 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.643 0.259 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -64.92 -37.04 86.32 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.139 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.02 -40.65 98.38 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.925 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -35.23 66.41 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.821 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.54 -49.81 56.72 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.345 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.429 ' HA ' HD12 ' A' ' 9' ' ' ILE . 27.2 p -61.64 -37.1 82.76 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.781 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -56.57 -37.34 70.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.945 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.8 89.1 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.116 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 6' ' ' CYS . 5.7 mt -64.14 -39.04 84.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 CA-C-O 120.917 0.389 . . . . 0.0 110.077 179.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -35.81 80.43 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.248 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -29.96 65.91 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.401 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.403 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -58.51 -36.69 74.2 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.47 0.176 . . . . 0.0 111.075 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -36.87 71.68 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.76 11.63 19.43 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -101.16 21.86 13.28 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.684 0.278 . . . . 0.0 111.525 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.8 mttm 65.77 21.63 11.52 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.453 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -111.36 -30.11 7.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.948 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.407 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -145.33 30.16 1.14 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.683 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.03 -41.27 17.41 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.36 85.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.933 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -73.79 -31.6 63.35 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.202 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.488 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -109.83 24.64 12.77 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.545 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 28.2 t-105 -69.5 -51.49 16.44 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.964 -0.107 . . . . 0.0 111.211 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -80.21 -19.3 9.36 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.423 2.082 . . . . 0.0 113.095 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -105.55 37.41 2.23 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.833 0.349 . . . . 0.0 111.131 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -107.57 -46.25 3.87 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.901 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -81.67 152.43 69.52 Favored Pre-proline 0 CA--C 1.531 0.235 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.101 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -63.43 179.3 0.94 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.926 2.418 . . . . 0.0 112.917 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.5 m -94.64 66.19 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.974 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.15 100.08 0.05 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.967 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.2 p -62.7 -35.12 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.708 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -71.71 -47.49 53.63 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.588 0.232 . . . . 0.0 111.22 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.46 -47.01 52.25 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -81.19 -21.44 39.64 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.23 60.54 6.26 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.474 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.06 71.43 1.26 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.908 0.385 . . . . 0.0 111.422 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -65.39 -22.26 66.77 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.17 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.09 -19.92 58.14 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.447 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -57.62 -42.63 83.68 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.675 0.274 . . . . 0.0 110.912 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.1 t -60.2 -37.14 79.35 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.14 -39.61 78.74 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.99 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.8 mt -72.57 -51.7 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.174 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.434 HD13 ' HB2' ' A' ' 77' ' ' ASN . 13.8 mt -129.05 118.18 45.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.058 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.0 pttt -77.68 -30.38 51.93 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -112.45 77.43 2.29 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-O 120.807 0.337 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.27 153.57 61.72 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.755 2.303 . . . . 0.0 112.656 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.27 142.95 16.21 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -139.43 167.25 22.5 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 tpp -57.55 -42.19 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.928 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.2 t -64.24 -38.25 90.39 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.544 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -65.66 -43.99 87.69 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.73 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.577 HG23 ' OH ' ' A' ' 61' ' ' TYR . 22.9 mt -70.17 -45.15 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.076 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -34.8 78.29 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.928 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.6 t -57.47 -40.86 79.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.934 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -60.39 -46.91 88.31 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.795 0.331 . . . . 0.0 110.251 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.04 -34.39 77.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.548 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.69 -38.18 90.15 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.311 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.69 15.19 10.03 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.089 0.404 . . . . 0.0 112.089 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 58.07 27.26 14.65 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.595 0.236 . . . . 0.0 111.543 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -32.58 60.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.648 0.261 . . . . 0.0 110.556 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.577 ' OH ' HG23 ' A' ' 52' ' ' ILE . 8.4 m-85 -71.41 104.85 3.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.967 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -65.68 -30.77 71.51 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.062 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.87 172.36 18.79 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.738 0.304 . . . . 0.0 111.24 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.11 -16.7 63.15 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.615 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.87 -43.52 98.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.653 0.263 . . . . 0.0 110.417 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -69.69 -40.65 76.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.967 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.492 ' O ' HG23 ' A' ' 71' ' ' VAL . 68.2 t80 -59.36 -53.45 58.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.778 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -58.75 -31.51 67.81 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.737 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.69 91.1 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.636 0.218 . . . . 0.0 111.387 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.11 -31.76 72.81 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.192 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 67' ' ' PHE . 43.7 t -60.72 -48.32 89.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.684 0.278 . . . . 0.0 110.577 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.0 mtt-85 -64.33 -38.27 90.46 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.701 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.46 -46.35 76.67 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.668 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.453 ' HB2' HD11 ' A' ' 52' ' ' ILE . 5.7 tmm? -59.19 -46.35 88.65 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.85 -35.26 80.54 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.918 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -60.16 -47.32 86.42 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.15 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.434 ' HB2' HD13 ' A' ' 43' ' ' ILE . 16.3 p30 -75.36 -30.5 60.23 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.896 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.73 -41.44 95.31 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.75 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.26 -33.87 75.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.946 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -66.56 -47.13 73.77 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.918 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.75 -38.83 76.94 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.571 ' HB3' HG22 ' A' ' 89' ' ' VAL . 51.4 m-20 -72.2 127.29 90.55 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.768 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.506 ' O ' HG21 ' A' ' 89' ' ' VAL . 37.8 Cg_endo -65.95 161.01 41.46 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.678 2.252 . . . . 0.0 112.417 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.79 127.58 13.96 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.54 2.16 . . . . 0.0 112.559 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.1 t70 60.13 67.91 0.82 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.917 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.475 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.7 t-80 -133.89 165.11 25.77 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.314 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.66 -44.15 96.99 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.309 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -62.42 -31.35 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.571 HG22 ' HB3' ' A' ' 82' ' ' ASN . 39.1 t -64.89 -42.32 94.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.883 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.69 -35.2 75.69 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.005 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -45.97 90.52 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.951 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.44 -46.32 89.08 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.935 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -44.99 95.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.744 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.11 -37.42 87.38 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -68.35 -38.46 81.5 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.983 179.745 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.22 -42.47 75.67 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.088 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.6 -46.81 88.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.2 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.97 -42.99 89.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.235 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -64.83 -51.46 62.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.931 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.67 -43.6 93.91 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.91 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mtt -60.24 -47.11 87.35 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.975 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.16 77.65 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.99 -44.46 95.98 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.999 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.81 -32.5 73.83 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.089 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -44.18 66.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.081 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.3 ptm -69.3 -34.24 74.4 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.259 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.8 mt -84.08 -42.29 16.26 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.992 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.809 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 120.729 0.3 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -64.73 -42.72 95.0 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mt -59.96 -41.7 92.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.918 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -35.68 81.4 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.046 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.8 t -62.42 -37.62 86.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.131 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.39 -39.09 78.73 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.842 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -60.06 -38.72 83.67 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.091 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.65 -43.18 97.95 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.501 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.6 mt -64.4 -46.88 91.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-O 120.656 0.265 . . . . 0.0 110.536 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.7 -35.87 81.09 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.876 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.7 mtpp -58.49 -29.78 66.5 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.231 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.479 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -58.58 -36.43 73.96 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.348 0.118 . . . . 0.0 110.87 179.312 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.85 -37.34 73.72 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.468 179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.97 8.68 30.62 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 179.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.479 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -94.28 15.02 18.49 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.68 29.05 2.64 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.174 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.4 mttm -123.74 -31.24 3.47 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.745 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -140.69 28.63 1.96 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 111.244 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.74 -37.94 64.9 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.777 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.87 -36.39 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -73.65 -34.51 64.98 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.576 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -100.81 14.42 31.77 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -52.88 4.01 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -64.06 -12.06 30.46 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 122.612 2.208 . . . . 0.0 113.567 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -141.7 52.46 1.52 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 111.203 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -99.02 -45.41 5.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.77 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.69 160.86 25.29 Favored Pre-proline 0 N--CA 1.464 0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.218 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.79 177.06 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.28 2.653 . . . . 0.0 113.158 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.0 m -93.5 83.85 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.139 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.539 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 17.7 m-20 -61.16 93.13 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.524 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.509 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.8 p -61.1 -39.26 81.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.818 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -72.3 -46.62 54.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.6 0.238 . . . . 0.0 111.578 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.539 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.96 -48.79 42.54 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 mt -80.86 -21.33 40.81 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.14 58.13 6.37 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.431 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.509 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -128.7 60.09 1.53 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.964 0.411 . . . . 0.0 111.442 -179.758 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -61.84 -20.99 64.27 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.525 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.24 -20.26 57.58 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.344 0.116 . . . . 0.0 111.27 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.452 ' CE2' HG13 ' A' ' 43' ' ' ILE . 10.3 t80 -56.71 -42.42 79.13 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.253 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 44.5 t -66.18 -32.33 73.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.943 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.24 -34.35 61.41 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.06 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.1 mt -82.99 -41.84 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.478 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.452 HG13 ' CE2' ' A' ' 39' ' ' TYR . 36.2 mm -96.41 127.58 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.747 0.308 . . . . 0.0 111.523 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.8 -36.88 25.21 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.259 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.56 88.47 53.36 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.07 116.08 4.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.736 2.29 . . . . 0.0 112.386 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.9 mtp -140.54 149.6 42.64 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.294 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -147.73 171.52 15.53 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.227 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.514 ' HA ' HD12 ' A' ' 52' ' ' ILE . 6.4 mtt -56.04 -42.32 76.36 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.054 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t -61.93 -40.01 94.02 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.643 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.7 m -66.31 -42.53 88.15 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.951 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.514 HD12 ' HA ' ' A' ' 49' ' ' MET . 11.6 mt -65.21 -45.08 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.703 0.287 . . . . 0.0 110.78 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -36.69 84.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.04 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.8 p -57.35 -38.49 74.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.208 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -62.92 -48.67 77.93 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.5 tp -62.6 -34.48 77.11 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.529 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.61 -38.91 92.93 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.298 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.45 15.2 8.21 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 59.79 27.49 16.8 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.661 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.45 -34.36 58.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.725 0.297 . . . . 0.0 110.467 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.451 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 8.3 m-85 -79.2 92.72 5.12 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.587 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.5 mtm-85 -60.37 -34.96 74.61 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -145.28 165.64 27.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.931 0.396 . . . . 0.0 111.375 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.05 -22.28 65.87 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.836 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -41.32 99.41 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.599 0.238 . . . . 0.0 110.515 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.49 -35.34 78.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.935 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.473 ' O ' HG23 ' A' ' 71' ' ' VAL . 24.5 t80 -59.91 -47.51 85.49 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.429 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.46 -32.29 82.55 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.796 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.05 -36.87 78.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.6 0.238 . . . . 0.0 111.414 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.59 -33.21 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.177 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.7 t -64.82 -48.71 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.919 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.07 -36.07 82.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.658 179.521 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.29 -47.33 77.02 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.3 ttp -60.38 -46.87 88.41 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.343 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -63.81 -35.2 79.84 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.707 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 m -59.7 -47.24 86.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.23 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -75.39 -36.75 60.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.682 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -59.3 -40.87 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.814 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -57.66 -35.64 70.83 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.358 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -66.41 -39.57 89.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.941 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.421 ' HB2' HD11 ' A' ' 43' ' ' ILE . 3.0 t80 -81.07 -38.75 26.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.248 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.733 ' HB3' HG22 ' A' ' 89' ' ' VAL . 27.0 m-20 -57.51 110.6 2.6 Favored Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.113 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.449 ' O ' HG21 ' A' ' 89' ' ' VAL . 46.2 Cg_endo -68.59 143.66 57.65 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.666 2.244 . . . . 0.0 112.432 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 51.4 Cg_exo -54.09 132.55 50.78 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 122.69 2.26 . . . . 0.0 112.438 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.27 68.03 0.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.013 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.804 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.8 t-160 -134.82 154.66 51.53 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.111 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -44.75 81.63 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.248 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 m -65.46 -31.49 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.493 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.804 HG23 ' HB3' ' A' ' 86' ' ' HIS . 31.2 t -67.42 -47.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.74 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.43 91.05 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.857 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 7.7 mtt -64.99 -36.77 85.46 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.25 -48.22 79.4 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.44 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -48.0 83.61 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.744 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.07 -38.94 90.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.842 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -37.13 85.62 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.172 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -69.54 -46.79 65.67 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.847 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.78 -47.01 88.25 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.271 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.22 -43.3 97.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.316 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.25 -51.03 63.46 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.425 0.155 . . . . 0.0 110.948 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -43.89 88.05 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.793 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.9 mtp -61.99 -46.92 87.11 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.054 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.65 -44.41 77.96 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.134 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.403 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.5 OUTLIER -64.25 -41.85 96.78 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.877 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -36.15 83.07 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.038 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -67.91 -44.84 76.01 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.173 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.403 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 13.7 ptm -69.4 -35.36 75.7 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.401 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.62 -42.37 20.13 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.225 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.008 179.911 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.65 0.262 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -63.26 -44.98 93.6 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.783 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.86 -44.51 94.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.945 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -63.83 -38.09 89.8 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.88 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -46.04 80.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.004 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.476 ' HA ' HD12 ' A' ' 9' ' ' ILE . 22.6 m -60.44 -39.0 85.93 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.972 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.8 m -58.59 -34.51 71.18 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.079 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -47.29 91.57 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.427 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.481 HD11 ' SD ' ' A' ' 106' ' ' MET . 3.6 mt -64.06 -44.58 97.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.788 0.327 . . . . 0.0 110.259 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.776 HD11 ' HG3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -62.16 -35.79 79.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.73 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.4 -27.66 64.48 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -58.44 -36.39 73.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.922 -0.126 . . . . 0.0 111.089 179.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -56.94 -40.41 76.35 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.9 11.94 33.05 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.8 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.54 11.42 28.75 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.02 26.34 3.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.202 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 79.4 mttt -116.1 -33.51 5.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.994 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.418 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.6 OUTLIER -130.65 23.15 5.05 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.187 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.31 -30.29 60.31 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.227 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.72 -39.51 91.26 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.737 0.304 . . . . 0.0 111.02 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.448 ' CZ ' ' HD3' ' A' ' 94' ' ' LYS . 8.7 m-85 -81.61 -33.55 31.43 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -97.02 15.58 22.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.44 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.76 -54.79 26.7 Favored Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.9 Cg_endo -76.84 -20.5 13.28 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.337 2.024 . . . . 0.0 112.984 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -98.28 22.45 9.59 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.391 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.53 -43.48 39.06 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.435 ' HB3' ' HD2' ' A' ' 28' ' ' PRO . 26.3 mmtt -102.42 158.28 32.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.126 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 27' ' ' LYS . 74.0 Cg_endo -75.01 -176.34 2.83 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.805 2.337 . . . . 0.0 112.754 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.7 m -93.87 80.27 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.133 0.492 . . . . 0.0 111.241 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.517 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -60.31 103.86 0.27 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.142 -179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.423 ' HA ' HD12 ' A' ' 36' ' ' LEU . 14.5 p -61.52 -37.32 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.13 -46.42 56.63 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.488 0.185 . . . . 0.0 111.442 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.517 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.69 -46.91 57.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.504 HD13 HD21 ' A' ' 36' ' ' LEU . 15.5 mt -80.85 -21.45 40.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.62 47.88 73.08 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.425 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.504 HD21 HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -120.83 69.41 0.88 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.044 0.45 . . . . 0.0 111.222 -179.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -65.23 -18.21 65.12 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.445 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -76.3 -19.95 57.77 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.872 -0.149 . . . . 0.0 111.314 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -40.31 82.49 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.615 0.245 . . . . 0.0 110.843 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.6 t -65.58 -40.13 92.39 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.788 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -65.09 -36.14 83.36 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.861 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.4 mt -77.59 -47.83 25.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 77' ' ' ASN . 29.9 mm -99.86 103.47 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.306 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -59.66 -33.31 71.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.398 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.76 89.41 52.45 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.603 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.46 124.32 11.89 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.749 2.299 . . . . 0.0 112.72 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.9 tpt -153.47 131.26 11.61 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -129.62 167.94 17.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.948 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.3 -42.65 77.91 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.091 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.8 t -62.06 -39.94 94.11 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.838 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.5 m -64.12 -44.43 92.24 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.864 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.451 HG23 ' OH ' ' A' ' 61' ' ' TYR . 53.7 mt -69.86 -44.92 78.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.136 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.688 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.776 ' HG3' HD11 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -62.52 -35.23 78.76 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.076 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 t -57.56 -40.42 78.87 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.974 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.3 -49.41 77.7 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.469 HD22 HD13 ' A' ' 10' ' ' LEU . 6.5 tp -67.04 -33.26 75.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.503 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.14 -41.36 99.27 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.388 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.36 15.16 12.7 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.35 27.21 16.77 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -76.29 -33.67 59.09 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.706 0.289 . . . . 0.0 110.516 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.451 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.0 m-85 -70.48 110.28 5.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.76 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -81.27 -25.88 36.21 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.192 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -147.12 157.83 43.74 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.815 0.34 . . . . 0.0 111.599 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -23.17 64.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.276 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -62.6 -39.05 92.52 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.521 0.201 . . . . 0.0 110.485 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.47 -35.32 75.5 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.72 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 71' ' ' VAL . 5.1 t80 -67.53 -53.63 26.89 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.844 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.79 -36.94 81.96 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.156 -0.545 . . . . 0.0 112.806 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -58.94 -37.83 77.62 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.507 0.194 . . . . 0.0 111.219 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -76.72 -33.48 58.16 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.47 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 67' ' ' PHE . 26.7 t -64.9 -48.31 84.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.645 0.259 . . . . 0.0 110.715 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -64.62 -34.54 78.52 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.786 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.3 -44.56 71.51 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.508 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.3 -46.25 89.07 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.782 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -63.58 -35.93 82.13 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.2 p -61.25 -45.82 92.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.049 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.477 ' HB2' HD12 ' A' ' 43' ' ' ILE . 1.6 p-10 -75.92 -38.05 58.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.874 179.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 t -61.24 -41.23 96.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.374 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.55 -29.14 69.82 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -72.73 -36.47 67.76 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.696 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -78.84 -40.78 31.75 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.226 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.461 ' HB3' HG22 ' A' ' 89' ' ' VAL . 90.0 m-20 -70.23 112.15 11.71 Favored Pre-proline 0 N--CA 1.466 0.33 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.131 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.515 ' O ' HG21 ' A' ' 89' ' ' VAL . 22.0 Cg_exo -65.4 156.9 60.88 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.765 2.31 . . . . 0.0 112.219 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.15 149.48 70.85 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.42 2.08 . . . . 0.0 112.373 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 t0 60.93 43.31 11.81 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.317 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.781 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.5 t-80 -116.63 146.92 42.37 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.001 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -56.38 -43.52 79.32 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.257 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.6 m -62.13 -33.44 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.781 HG23 ' HB3' ' A' ' 86' ' ' HIS . 29.9 t -61.65 -42.44 94.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.764 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.38 81.37 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.78 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . 0.441 ' HA ' ' CE2' ' A' ' 21' ' ' TYR . 0.7 OUTLIER -69.53 -37.26 77.04 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.48 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.45 -50.74 57.91 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.394 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -62.63 -38.78 91.59 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.54 0.209 . . . . 0.0 110.689 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.448 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 2.9 tttp -64.42 -41.74 96.43 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.756 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -68.42 -37.94 80.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.952 179.456 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.29 -41.47 80.93 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.974 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -60.75 -46.75 89.26 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.27 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 p -67.02 -42.83 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -50.54 68.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.959 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -46.98 86.0 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.601 0.239 . . . . 0.0 110.887 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -45.75 91.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.02 -43.94 77.63 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.957 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.28 -52.46 65.56 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.982 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.27 -40.02 84.76 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.309 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.38 -42.29 75.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.679 0.276 . . . . 0.0 110.787 179.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.481 ' SD ' HD11 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.11 -44.67 71.95 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.966 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -42.13 66.12 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.535 -0.745 . . . . 0.0 110.703 179.69 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.747 0.308 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.95 -42.8 94.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.213 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.5 mt -62.81 -42.45 99.72 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.719 0.295 . . . . 0.0 110.853 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -69.26 -36.67 77.36 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.965 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -50.23 64.41 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.534 ' HA ' HD12 ' A' ' 9' ' ' ILE . 24.0 p -64.25 -39.37 93.81 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.167 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.17 -40.51 85.84 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.927 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.47 -44.2 96.89 Favored Glycine 0 C--N 1.336 0.537 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.303 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.534 HD12 ' HA ' ' A' ' 6' ' ' CYS . 8.2 mt -64.32 -44.41 97.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-O 120.817 0.341 . . . . 0.0 110.235 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.659 HD21 ' CZ ' ' A' ' 67' ' ' PHE . 10.0 mp -62.44 -35.83 80.5 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.554 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -58.45 -29.28 66.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 43.1 tt0 -58.62 -36.54 74.22 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.562 0.22 . . . . 0.0 110.645 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.554 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 6.6 ttm -57.66 -37.12 72.84 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.528 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 7.07 31.51 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.705 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -94.09 15.36 17.27 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.592 0.234 . . . . 0.0 111.559 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? 69.05 25.61 5.83 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HB2' ' CG ' ' A' ' 12' ' ' GLU . 32.3 mttm -115.37 -29.58 6.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.228 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.404 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 1.4 t60 -144.45 33.4 1.18 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.798 0.332 . . . . 0.0 110.796 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -89.21 -38.96 13.87 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.184 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.92 -42.66 97.34 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -76.8 -29.28 55.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.326 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.9 16.46 25.88 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.487 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -71.21 -55.83 5.92 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-O 120.346 0.117 . . . . 0.0 110.987 179.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.487 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 12.3 Cg_exo -69.74 -25.1 29.02 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.565 2.177 . . . . 0.0 112.636 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -102.23 34.57 2.68 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.287 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.1 -45.99 4.19 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.89 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -88.97 156.94 49.11 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.325 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -62.38 -171.71 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.154 2.569 . . . . 0.0 112.842 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -116.5 87.35 1.03 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -57.92 102.49 0.1 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.267 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.408 HG23 HD12 ' A' ' 36' ' ' LEU . 12.8 p -63.75 -36.68 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.643 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.93 -47.31 53.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.614 0.245 . . . . 0.0 111.498 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.569 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -72.43 -47.16 51.25 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.15 -21.51 39.71 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.17 59.99 5.92 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.615 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.418 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -124.93 72.23 1.22 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.962 0.41 . . . . 0.0 111.342 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -69.88 -12.73 61.84 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.458 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -19.41 58.5 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.4 0.143 . . . . 0.0 111.25 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -34.8 69.59 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.534 0.207 . . . . 0.0 111.019 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -66.44 -39.97 89.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.72 0.295 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.23 -37.55 69.14 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.229 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.9 mt -79.15 -52.97 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.321 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.634 HD12 ' HB3' ' A' ' 77' ' ' ASN . 28.3 mm -106.99 126.96 62.98 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.245 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 43.0 pttt -79.43 -39.13 33.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.278 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -116.37 94.25 42.14 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.725 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.79 105.13 0.89 Allowed 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.665 2.244 . . . . 0.0 112.598 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 39.3 mtp -139.12 140.63 38.0 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.967 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.53 170.66 12.93 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.128 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -32.29 69.23 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.475 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -42.33 99.05 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.727 0.299 . . . . 0.0 110.936 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.6 m -64.4 -39.93 94.8 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.861 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.465 HG22 ' CE2' ' A' ' 67' ' ' PHE . 22.1 mt -70.49 -44.74 76.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.862 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -39.61 92.99 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.113 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.3 p -57.48 -39.07 75.61 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.177 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -49.81 75.73 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.9 tp -63.23 -34.1 76.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.458 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.97 -38.25 90.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.147 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.411 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . . . -90.18 15.26 10.63 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 63.84 26.92 14.45 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.411 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 28.0 mt-10 -79.54 -35.84 39.31 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.764 0.316 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 2.4 m-85 -76.21 101.3 5.35 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.685 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -62.19 -30.19 70.9 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.38 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.23 164.86 38.23 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.866 0.365 . . . . 0.0 111.427 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.2 -15.41 63.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.458 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.77 -44.29 96.56 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.662 0.268 . . . . 0.0 110.323 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -71.08 -35.38 71.84 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.821 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.659 ' CZ ' HD21 ' A' ' 10' ' ' LEU . 34.1 t80 -61.4 -48.1 82.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.412 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.53 -32.14 80.17 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.832 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.3 96.1 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.739 0.27 . . . . 0.0 111.055 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.59 -37.48 76.95 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.033 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 67' ' ' PHE . 42.2 t -59.86 -47.74 90.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.908 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -63.01 -35.64 80.89 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.706 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.6 tt -72.2 -43.03 65.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.734 0.302 . . . . 0.0 110.808 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ttp -66.87 -45.09 79.21 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.473 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.81 -41.43 97.88 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.8 p -61.93 -44.04 97.6 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.533 0.206 . . . . 0.0 110.792 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.634 ' HB3' HD12 ' A' ' 43' ' ' ILE . 14.5 m120 -73.72 -39.58 64.19 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.383 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.93 -37.82 83.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -59.81 -35.35 74.51 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.982 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -63.23 -42.78 99.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.66 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -70.19 -35.02 73.66 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.189 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.828 ' HB3' HG22 ' A' ' 89' ' ' VAL . 34.0 m-20 -59.42 110.94 3.13 Favored Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.975 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.633 ' O ' HG21 ' A' ' 89' ' ' VAL . 32.1 Cg_exo -60.59 160.38 24.51 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.924 2.416 . . . . 0.0 112.689 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.41 120.72 7.66 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.53 2.153 . . . . 0.0 112.244 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.2 t70 62.52 71.43 0.53 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.658 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.721 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.7 t60 -137.51 152.67 49.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.358 -179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -56.33 -44.31 79.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.291 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.557 HG22 ' CD2' ' A' ' 86' ' ' HIS . 19.0 m -60.3 -32.33 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.399 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.828 HG22 ' HB3' ' A' ' 82' ' ' ASN . 23.2 t -66.07 -43.22 92.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.784 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.06 -37.81 86.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.978 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -46.36 90.72 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.706 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.76 94.12 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.931 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -48.8 71.0 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.606 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.5 tttp -62.47 -41.51 98.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.087 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.404 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -67.83 -40.76 83.74 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.055 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.2 tm0? -70.04 -43.72 70.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.983 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -60.74 -46.76 89.21 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.314 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.95 -42.6 89.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.813 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.78 -49.77 71.65 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.84 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -46.18 88.72 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.562 0.22 . . . . 0.0 110.967 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 6.2 mtp -60.35 -45.98 91.53 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.983 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -67.98 -43.83 78.07 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.122 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.414 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.1 OUTLIER -59.88 -47.87 83.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.043 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.94 -34.08 77.18 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.114 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.92 -44.57 63.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.42 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.414 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 7.2 ptm -69.24 -33.47 73.32 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.04 -42.35 14.93 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 120.573 0.225 . . . . 0.0 110.846 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.13 -0.938 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 120.675 0.274 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -64.33 -39.36 93.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.92 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.97 -45.67 91.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.967 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -35.08 77.26 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.946 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 t -62.49 -35.84 80.62 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.231 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.7 m -58.05 -42.14 84.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.86 -34.98 78.49 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.017 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.93 -46.69 93.69 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.656 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mt -64.39 -47.37 89.77 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.772 0.32 . . . . 0.0 110.581 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mt -63.85 -35.75 81.64 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 ttpt -58.59 -30.3 67.1 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.616 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.488 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.5 -36.62 74.06 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.448 0.166 . . . . 0.0 110.983 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.471 ' HE3' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -57.92 -38.68 76.32 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.653 0.263 . . . . 0.0 110.452 179.18 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.07 3.84 39.1 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.716 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.488 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.04 16.41 12.84 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.582 0.229 . . . . 0.0 111.538 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.3 mttp 70.77 25.8 3.93 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.427 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 6.9 mttm -114.28 -32.78 5.86 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.03 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.462 ' NE2' HG11 ' A' ' 98' ' ' VAL . 4.9 m-70 -131.42 18.78 4.82 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.075 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.81 78.84 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-O 120.593 0.235 . . . . 0.0 110.938 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.41 -34.77 74.97 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.298 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -86.67 -31.0 21.3 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.699 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.9 17.2 24.56 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.42 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.08 -53.13 35.16 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.355 0.121 . . . . 0.0 110.72 179.588 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.42 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 75.2 Cg_endo -88.68 18.72 1.43 Allowed 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.732 2.288 . . . . 0.0 113.088 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -144.13 62.78 1.34 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.934 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -127.89 -55.06 1.3 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.857 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.41 157.24 75.37 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.025 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.98 -177.22 1.23 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.754 2.303 . . . . 0.0 112.732 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.62 HG11 ' CZ ' ' A' ' 39' ' ' TYR . 15.9 m -90.23 78.55 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.113 0.482 . . . . 0.0 111.418 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.579 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -60.17 97.69 0.05 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.867 179.809 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 36' ' ' LEU . 11.6 p -61.51 -39.66 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.766 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -72.25 -46.78 54.53 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.579 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -72.3 -48.2 44.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.5 -21.46 38.64 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.5 57.88 6.34 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.323 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.547 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -129.4 76.44 1.72 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.983 0.421 . . . . 0.0 111.406 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -75.88 -7.17 53.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.51 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.3 -19.87 57.86 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.369 0.128 . . . . 0.0 111.22 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.62 ' CZ ' HG11 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -57.8 -42.0 83.31 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.899 179.654 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.3 t -63.28 -35.69 81.19 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.908 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -73.24 -42.15 62.91 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.169 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 20.1 mt -80.79 -62.38 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.766 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 22.5 mm -97.23 125.54 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.822 0.344 . . . . 0.0 111.543 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -83.58 -34.95 25.05 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.442 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -136.81 72.88 54.77 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-O 120.808 0.337 . . . . 0.0 111.085 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.58 160.31 44.42 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.814 2.343 . . . . 0.0 112.423 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.7 mtp -150.18 163.22 38.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.319 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.43 172.24 14.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.032 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.43 ' HA ' HD12 ' A' ' 52' ' ' ILE . 16.9 ttm -54.48 -37.44 65.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.74 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.0 t -63.46 -44.25 95.02 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.82 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.2 m -64.32 -38.59 91.59 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.095 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.43 HD12 ' HA ' ' A' ' 49' ' ' MET . 15.9 mt -69.74 -44.89 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-O 120.749 0.309 . . . . 0.0 110.908 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.18 -36.32 81.52 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.277 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.2 p -57.62 -43.11 84.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.8 -49.07 77.79 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.41 ' HB2' ' HD2' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -66.18 -33.18 75.18 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.688 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -60.27 -41.44 93.31 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.468 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.03 15.17 12.08 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.04 27.35 16.26 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.62 0.248 . . . . 0.0 111.362 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -76.6 -33.67 58.42 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.667 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.41 ' HD2' ' HB2' ' A' ' 56' ' ' LEU . 2.6 m-85 -66.11 103.17 0.92 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.943 0.402 . . . . 0.0 110.622 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -32.04 63.58 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.025 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -166.92 -178.98 4.47 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.251 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.52 -15.62 61.78 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.254 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -62.84 -46.0 89.96 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.669 0.271 . . . . 0.0 110.342 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.23 -36.03 74.26 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.775 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.452 ' O ' HG23 ' A' ' 71' ' ' VAL . 19.0 t80 -59.93 -53.65 55.38 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.963 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.38 -32.15 81.91 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.615 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.38 99.41 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.199 0.2 . . . . 0.0 111.397 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.11 -35.24 73.98 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.447 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 67' ' ' PHE . 46.0 t -63.44 -48.09 88.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 120.743 0.306 . . . . 0.0 110.259 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -64.76 -39.78 94.2 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.651 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.95 -48.67 79.35 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.759 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.0 ttp -61.65 -41.7 97.88 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.136 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -41.21 81.64 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.944 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.6 m -62.79 -43.71 98.07 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.833 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -71.29 -42.29 68.87 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.98 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t -59.73 -36.66 77.03 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.028 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -60.3 -37.47 80.65 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.144 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -70.56 -39.37 73.99 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.012 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -75.07 -33.21 61.65 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.424 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.649 ' HB3' HG22 ' A' ' 89' ' ' VAL . 2.9 m-20 -88.07 111.6 43.89 Favored Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 116.754 -0.203 . . . . 0.0 111.122 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 31.8 Cg_exo -58.42 142.41 97.83 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.852 2.368 . . . . 0.0 112.543 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 32.0 Cg_exo -58.53 151.84 59.27 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.914 2.41 . . . . 0.0 112.618 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 59.29 51.39 6.86 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.709 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-160 -128.92 145.91 51.09 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.6 -40.74 75.82 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.019 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.9 m -61.99 -36.1 72.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.313 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.709 HG23 ' HB3' ' A' ' 86' ' ' HIS . 28.2 t -65.87 -46.6 88.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.769 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.84 -36.91 82.58 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.015 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -61.26 -46.36 90.69 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.26 -46.58 82.93 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtp180 -59.89 -37.28 78.92 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.839 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -59.43 -42.2 91.35 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.725 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.471 HD22 ' HE3' ' A' ' 13' ' ' MET . 20.1 mt -71.02 -32.12 68.81 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.81 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -44.23 71.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.888 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -60.69 -46.67 89.49 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.241 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.462 HG11 ' NE2' ' A' ' 18' ' ' HIS . 8.6 p -66.03 -42.95 92.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.946 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -64.14 -50.3 68.77 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.849 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.58 -46.97 83.34 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.001 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -46.1 90.81 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.867 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -43.99 78.14 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.002 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.427 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -57.48 -46.35 83.8 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.98 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.37 -36.35 83.4 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.052 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -69.14 -44.81 71.6 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.129 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.427 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 8.0 ptm -69.4 -33.31 72.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.746 -0.207 . . . . 0.0 111.408 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.81 -42.7 16.17 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.478 0.18 . . . . 0.0 111.347 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.804 -0.617 . . . . 0.0 110.737 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.69 0.281 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.52 -40.13 80.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.958 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.415 HD21 ' O ' ' A' ' 61' ' ' TYR . 78.8 mt -58.97 -33.71 70.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.911 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -72.72 -34.72 67.28 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.88 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -49.71 53.8 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.433 ' HA ' HD12 ' A' ' 9' ' ' ILE . 24.0 p -60.31 -36.81 78.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.929 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -54.56 -34.08 61.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.251 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -46.7 93.48 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.425 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.433 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.4 mt -64.53 -43.64 96.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.875 0.369 . . . . 0.0 110.303 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 mp -62.95 -35.52 80.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.452 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -58.18 -28.07 64.43 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.569 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.77 -36.83 75.03 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.527 0.203 . . . . 0.0 110.789 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.423 ' HA ' ' HB2' ' A' ' 18' ' ' HIS . 1.2 mpp? -59.83 -37.58 79.6 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.46 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -98.71 0.71 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.626 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.09 10.75 23.1 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt 75.09 21.58 1.92 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.372 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -111.13 -35.09 6.0 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.04 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.483 ' NE2' HG11 ' A' ' 98' ' ' VAL . 11.1 m-70 -124.61 18.16 8.79 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.29 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.63 -37.21 56.72 Favored 'General case' 0 N--CA 1.46 0.063 0 CA-C-O 120.652 0.263 . . . . 0.0 110.956 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.93 -38.19 76.14 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.028 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 6.6 m-85 -77.5 -32.36 54.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.248 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.454 ' HB1' ' CD1' ' A' ' 26' ' ' TYR . . . -94.39 8.08 43.23 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.435 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.9 t90 -69.92 -51.55 14.72 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.435 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.0 Cg_endo -76.39 2.13 7.63 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.308 2.005 . . . . 0.0 113.435 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -150.54 58.24 0.94 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.013 0.435 . . . . 0.0 111.011 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.454 ' CD1' ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -112.25 -54.37 2.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.665 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -72.02 153.27 92.8 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.47 -179.56 0.2 Allowed 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.894 2.396 . . . . 0.0 112.723 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.7 m -107.7 73.99 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.132 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -61.66 102.13 0.23 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.874 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.413 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.6 p -61.52 -35.62 68.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.636 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -71.79 -47.4 53.68 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.605 0.24 . . . . 0.0 111.307 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -46.38 54.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.2 mt -80.75 -21.28 41.22 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.82 58.57 8.13 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.466 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.414 HD13 ' HB2' ' A' ' 39' ' ' TYR . 0.4 OUTLIER -126.99 66.16 1.28 Allowed 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.934 0.397 . . . . 0.0 111.092 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -62.1 -21.17 64.77 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.354 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -76.46 -20.19 57.27 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.516 0.198 . . . . 0.0 111.29 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.452 ' CE1' HG13 ' A' ' 43' ' ' ILE . 1.1 t80 -59.05 -31.76 69.15 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 120.596 0.236 . . . . 0.0 110.786 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.4 t -60.15 -40.01 88.36 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.483 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -84.76 -37.95 20.22 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 121.262 -0.175 . . . . 0.0 111.2 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 12.2 mt -62.89 -33.42 60.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.452 HG13 ' CE1' ' A' ' 39' ' ' TYR . 40.0 mm -123.37 116.6 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.158 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -33.82 75.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.279 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -124.77 90.61 50.71 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.56 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.45 106.8 1.29 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.782 2.321 . . . . 0.0 112.452 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 27.0 mtp -146.46 144.7 29.84 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.298 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.74 172.09 13.45 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.606 ' HA ' HD12 ' A' ' 52' ' ' ILE . 0.4 OUTLIER -56.51 -43.28 79.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.01 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -61.99 -34.78 76.8 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.749 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 86.6 m -70.32 -41.74 72.88 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.702 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.606 HD12 ' HA ' ' A' ' 49' ' ' MET . 7.5 mt -66.64 -45.02 89.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.804 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -67.59 -34.63 77.41 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.037 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.3 t -57.55 -42.0 82.09 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.973 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -60.72 -49.6 76.84 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.814 0.34 . . . . 0.0 110.176 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.564 HD22 ' HE2' ' A' ' 67' ' ' PHE . 14.1 tp -60.99 -35.9 78.04 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -59.86 -39.58 85.7 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.119 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.4 15.18 11.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.925 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.36 28.54 16.95 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.59 0.234 . . . . 0.0 111.562 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -74.66 -37.35 62.73 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.722 0.296 . . . . 0.0 110.508 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.519 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 7.7 m-85 -73.91 100.67 3.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.819 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -69.91 -32.37 70.64 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.005 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -145.78 159.87 42.57 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.021 0.439 . . . . 0.0 111.473 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.557 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -70.66 -14.5 62.49 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.192 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -62.96 -45.52 92.04 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 120.69 0.281 . . . . 0.0 110.6 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -71.46 -32.46 68.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.794 179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.564 ' HE2' HD22 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -55.2 -53.49 55.3 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.969 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.2 -31.3 78.55 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.68 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.77 -41.36 95.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.668 0.271 . . . . 0.0 111.069 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.9 -38.96 64.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.361 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 67' ' ' PHE . 26.8 t -64.31 -46.23 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.734 0.302 . . . . 0.0 110.83 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.1 mtt-85 -59.18 -33.39 70.88 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.103 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.1 -46.63 50.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.931 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.25 -42.26 90.71 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -63.8 -38.75 92.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.9 m -66.33 -38.99 88.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.019 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.437 ' ND2' HG23 ' A' ' 43' ' ' ILE . 3.7 m120 -70.9 -44.07 67.0 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.975 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -58.23 -34.12 70.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.101 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -56.66 -37.26 70.55 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.219 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -66.29 -47.77 72.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.205 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -72.46 -33.86 67.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.079 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.976 ' HB3' HG22 ' A' ' 89' ' ' VAL . 21.5 m-20 -65.39 114.01 13.83 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.132 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.638 ' O ' HG21 ' A' ' 89' ' ' VAL . 35.5 Cg_exo -58.43 167.59 4.76 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.902 2.401 . . . . 0.0 112.66 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.03 116.96 4.91 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.48 2.12 . . . . 0.0 112.334 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.4 t0 61.51 68.72 0.69 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.109 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.528 ' HB3' HG23 ' A' ' 89' ' ' VAL . 4.3 t-80 -125.77 158.96 33.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.04 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.15 -43.91 78.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.271 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.6 m -65.36 -34.34 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.976 HG22 ' HB3' ' A' ' 82' ' ' ASN . 28.4 t -63.93 -43.32 97.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.907 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.19 -36.98 73.89 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.978 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . 0.417 ' HG2' ' CD2' ' A' ' 21' ' ' TYR . 10.3 mtt -66.85 -36.99 83.59 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.1 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.66 65.56 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.69 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.51 78.0 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.213 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.434 ' HD2' ' CE2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.96 -40.48 93.51 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.89 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.0 mt -68.98 -31.66 70.67 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.003 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.39 -49.17 62.01 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.877 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.6 -46.45 90.2 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.414 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.483 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.6 p -64.45 -42.98 96.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.315 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.04 -50.47 66.1 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.536 0.208 . . . . 0.0 110.5 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -42.66 90.59 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.103 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -47.81 84.02 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.992 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -44.15 80.11 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.103 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.557 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 1.9 t80 -65.07 -42.25 94.35 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.861 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.13 76.61 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.03 -44.6 68.91 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.168 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.6 ptm -68.77 -33.33 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.324 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.0 -41.83 15.45 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.058 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.06 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.64 0.257 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -61.66 -36.15 80.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.766 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.48 -37.82 88.76 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.191 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -72.49 -42.0 65.37 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.81 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -49.18 76.11 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.209 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.3 p -62.35 -36.71 83.08 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.017 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.6 t -54.47 -34.79 62.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.958 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.64 -40.12 96.04 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 121.064 -0.588 . . . . 0.0 112.589 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.4 mt -64.14 -39.28 84.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.518 HD13 ' CD2' ' A' ' 56' ' ' LEU . 0.5 OUTLIER -63.34 -35.48 80.54 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.643 179.114 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.2 -29.64 65.83 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.571 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG3' ' HD3' ' A' ' 17' ' ' LYS . 0.7 OUTLIER -58.63 -36.59 74.32 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.402 0.144 . . . . 0.0 111.049 179.459 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.451 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.2 mtt -58.89 -37.24 76.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.705 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -103.72 10.24 36.8 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.454 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -104.08 16.55 26.0 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.638 0.256 . . . . 0.0 111.534 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.61 28.54 9.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.26 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HD3' ' HG3' ' A' ' 12' ' ' GLU . 22.0 mttm -115.88 -35.78 4.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.129 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.684 ' CD2' HD23 ' A' ' 95' ' ' LEU . 4.8 t60 -134.44 27.17 3.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.885 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.451 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -80.77 -32.13 35.61 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.29 94.09 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.208 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -83.24 -32.09 26.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.48 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -95.95 12.42 30.43 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.451 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -74.3 -53.72 3.55 Favored Pre-proline 0 CA--C 1.532 0.279 0 O-C-N 122.505 -0.122 . . . . 0.0 111.112 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.451 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 3.0 Cg_exo -74.51 -1.94 11.73 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.773 2.315 . . . . 0.0 113.222 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.4 50.89 2.18 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.989 0.423 . . . . 0.0 111.06 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -109.15 -47.52 3.41 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.781 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.6 156.06 56.23 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.247 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.66 -172.76 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.882 2.388 . . . . 0.0 112.74 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -111.91 76.47 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 121.112 0.482 . . . . 0.0 111.211 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.58 107.2 1.09 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.017 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 36' ' ' LEU . 9.5 p -62.31 -38.71 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.545 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.05 -45.58 60.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.587 0.232 . . . . 0.0 111.342 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.2 -48.24 52.72 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.065 0.395 . . . . 0.0 112.065 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -81.54 -21.66 38.38 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.55 58.62 5.31 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.479 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -130.61 74.27 1.59 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.227 -179.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -70.9 -8.06 50.22 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.013 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.33 -20.02 57.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 121.344 -0.142 . . . . 0.0 111.193 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.87 -43.66 98.1 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.937 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.3 -38.84 90.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.717 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.36 -36.6 84.67 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.695 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.405 HG22 HG13 ' A' ' 43' ' ' ILE . 13.2 mt -78.39 -52.83 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.234 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.405 HG13 HG22 ' A' ' 42' ' ' ILE . 3.2 mt -128.91 141.47 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.806 0.336 . . . . 0.0 111.503 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.53 -31.88 12.55 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.489 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -120.7 65.34 12.37 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 120.671 0.272 . . . . 0.0 111.414 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.06 164.08 30.0 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.853 2.369 . . . . 0.0 112.718 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.1 ttm -148.37 158.89 44.38 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.5 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -138.16 164.52 28.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.21 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -40.41 78.84 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 t -62.66 -41.55 99.12 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.56 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 4.9 m -64.57 -42.32 95.71 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.972 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.559 HG23 ' OH ' ' A' ' 61' ' ' TYR . 15.5 mt -69.69 -45.08 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.967 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? -66.11 -34.21 77.54 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.22 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -57.5 -40.03 77.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.877 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -48.22 82.65 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.518 ' CD2' HD13 ' A' ' 10' ' ' LEU . 13.5 tp -63.96 -35.18 79.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.729 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.92 -40.99 97.76 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.503 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.86 15.37 11.43 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 60.58 28.08 17.77 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.663 0.268 . . . . 0.0 111.401 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -74.51 -33.94 62.91 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.766 0.317 . . . . 0.0 110.528 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.559 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.2 m-85 -70.11 105.99 3.1 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.888 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttm-85 -69.62 -29.0 66.4 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.245 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.37 164.42 38.3 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.44 -23.0 64.56 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.242 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.87 -38.32 90.38 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.742 0.306 . . . . 0.0 110.482 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -70.3 -35.22 73.56 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.512 ' O ' HG23 ' A' ' 71' ' ' VAL . 16.4 t80 -59.42 -48.52 81.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.533 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.88 -33.0 81.65 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.464 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.61 -37.46 84.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.555 0.217 . . . . 0.0 111.435 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -76.43 -30.76 57.54 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.269 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 67' ' ' PHE . 39.3 t -66.3 -48.57 80.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 111.027 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -64.5 -34.68 78.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.945 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.6 tp -69.06 -46.98 66.47 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.765 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 ttp -59.6 -46.43 88.96 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.198 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.462 ' CZ ' ' HB2' ' A' ' 96' ' ' GLN . 4.5 m-85 -60.88 -39.79 90.56 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.183 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 24.7 t -59.51 -46.32 89.18 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.846 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -74.99 -41.68 59.04 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.784 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.4 m -60.97 -34.94 75.55 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.287 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -60.28 -35.03 74.6 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.653 0.263 . . . . 0.0 111.215 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -71.63 -35.85 70.55 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.85 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -82.82 -40.94 19.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.347 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.666 ' HB3' HG22 ' A' ' 89' ' ' VAL . 29.2 m-20 -69.45 116.59 44.27 Favored Pre-proline 0 N--CA 1.464 0.262 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.081 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.539 ' O ' HG21 ' A' ' 89' ' ' VAL . 50.7 Cg_exo -54.71 153.62 23.58 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.916 2.411 . . . . 0.0 112.576 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.03 136.83 28.01 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.565 2.177 . . . . 0.0 112.151 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 t70 58.19 61.24 2.37 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.03 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.689 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.4 t-80 -126.97 150.16 49.52 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.911 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -56.52 -44.12 80.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.326 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.71 -35.89 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.198 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.689 HG23 ' HB3' ' A' ' 86' ' ' HIS . 19.5 t -64.98 -45.74 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.779 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.83 78.69 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.802 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.7 mtp -61.46 -46.59 89.44 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.711 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -56.01 -50.17 71.63 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.934 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -58.87 -41.11 86.31 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -61.99 -42.02 98.69 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.996 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 92' ' ' ALA . 5.5 mt -60.51 -41.5 94.48 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.838 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.08 -41.88 73.51 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.916 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.55 -46.67 89.31 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.252 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.407 HG11 ' CE1' ' A' ' 18' ' ' HIS . 11.1 p -66.69 -42.64 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.014 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -47.04 79.57 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.825 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.62 -46.35 90.6 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.625 0.25 . . . . 0.0 110.976 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -47.7 84.65 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.95 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.0 mmt180 -67.66 -38.77 84.25 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.451 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -58.41 -50.71 72.72 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.009 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.13 -35.67 77.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.229 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.8 62.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.396 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.451 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 2.0 ptm -69.26 -34.01 74.11 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.93 -41.64 15.73 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.6 0.238 . . . . 0.0 110.911 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 117.947 -1.025 . . . . 0.0 111.044 -179.812 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 120.705 0.288 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -57.02 -37.11 71.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt -61.24 -46.61 89.7 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.822 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -67.73 -34.48 76.93 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.825 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.65 -39.61 70.24 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.831 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -65.59 -39.05 91.16 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.54 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -35.65 68.37 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.059 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.18 -47.58 90.38 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.109 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 32.4 mt -64.89 -44.25 96.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-O 120.788 0.328 . . . . 0.0 110.319 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.527 HD11 ' CZ ' ' A' ' 67' ' ' PHE . 2.8 mp -62.42 -35.79 80.35 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.737 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mtmt -58.47 -28.19 65.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.375 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 33.3 tt0 -58.48 -36.63 74.04 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.841 -0.163 . . . . 0.0 110.967 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -57.46 -37.11 72.33 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.487 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -107.67 9.96 29.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.63 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.472 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -92.04 12.06 23.21 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.8 tttm 73.03 26.97 2.12 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.528 0.331 . . . . 0.0 111.284 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 25.7 mttt -120.8 -35.39 3.37 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.346 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.703 ' CD2' HD23 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -131.77 25.7 4.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.172 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.52 -34.48 31.2 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.068 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.73 76.47 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.437 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -79.58 -32.57 42.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.381 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.14 15.29 28.75 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -61.83 4.8 Favored Pre-proline 0 CA--C 1.53 0.193 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.64 -19.76 64.94 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.258 1.972 . . . . 0.0 112.799 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.38 35.94 4.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.475 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 -40.95 10.21 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.011 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -89.87 163.44 32.38 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.288 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -81.16 -174.53 2.25 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.945 2.43 . . . . 0.0 112.758 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.0 m -113.83 75.14 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.091 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -58.6 103.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.055 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.552 HG23 ' C ' ' A' ' 36' ' ' LEU . 10.4 p -61.55 -39.19 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.633 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -72.05 -45.51 60.53 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.52 0.2 . . . . 0.0 111.536 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.95 -48.36 45.75 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 mt -81.21 -21.5 39.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.87 57.68 6.22 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.411 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.552 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -129.81 73.83 1.55 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.98 0.419 . . . . 0.0 111.21 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -71.69 -8.92 57.09 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.715 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.6 -20.1 57.13 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.461 0.172 . . . . 0.0 111.388 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.483 ' CD2' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -61.57 -41.81 97.94 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.884 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.68 -39.18 90.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.736 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.05 -39.62 94.48 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.628 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.471 HD12 ' HA ' ' A' ' 39' ' ' TYR . 5.8 mt -74.81 -51.66 21.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.843 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.458 HD13 ' HB2' ' A' ' 77' ' ' ASN . 10.0 mt -130.35 112.24 22.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -11.79 60.63 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.822 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.448 ' H ' HG22 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -126.93 71.79 75.38 Favored Pre-proline 0 CA--C 1.534 0.341 0 CA-C-O 120.71 0.291 . . . . 0.0 111.047 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.0 145.48 99.06 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 122.897 2.398 . . . . 0.0 112.539 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 mmt -147.89 139.45 23.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.232 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -145.39 165.54 28.2 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.835 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.439 ' HA ' HD12 ' A' ' 52' ' ' ILE . 3.4 ttm -57.01 -36.56 70.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.646 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.0 t -66.35 -39.34 89.11 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.812 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.2 m -67.2 -40.11 86.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.982 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.561 HG23 ' OH ' ' A' ' 61' ' ' TYR . 13.3 mt -68.46 -45.19 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.99 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -66.09 -35.22 79.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.127 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.6 t -57.64 -42.98 84.51 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.967 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.38 -47.75 84.72 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.59 -34.53 77.19 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.693 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.81 -41.31 99.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.295 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.81 15.29 11.51 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 59.91 28.45 17.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.689 0.28 . . . . 0.0 111.424 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -72.99 -34.1 66.23 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.517 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.561 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.8 m-85 -72.86 103.09 3.59 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.49 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -67.3 -29.76 69.43 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.226 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -155.65 178.1 10.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.812 0.339 . . . . 0.0 111.281 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.34 -25.25 62.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.62 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -42.07 99.62 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.774 0.321 . . . . 0.0 110.267 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.92 -37.67 88.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.802 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.527 ' CZ ' HD11 ' A' ' 10' ' ' LEU . 27.2 t80 -59.41 -51.86 68.07 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.806 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.22 -31.53 77.34 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 121.049 -0.595 . . . . 0.0 112.696 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 72' ' ' ARG . . . -58.8 -39.39 80.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.611 0.243 . . . . 0.0 111.32 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.68 -33.11 58.26 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.169 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 67' ' ' PHE . 40.7 t -67.44 -46.75 82.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.604 0.24 . . . . 0.0 110.789 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 15.5 ptt180 -59.09 -36.99 76.07 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.85 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.15 -42.09 66.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.629 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -62.17 -46.77 87.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.129 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.39 -35.57 80.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.053 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.6 t -59.78 -47.63 84.91 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.117 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.458 ' HB2' HD13 ' A' ' 43' ' ' ILE . 15.9 p30 -75.82 -30.74 59.1 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.584 0.231 . . . . 0.0 110.868 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.91 -41.88 97.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.822 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -61.19 -33.59 73.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.409 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -71.16 -44.47 65.46 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.06 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -75.25 -37.28 61.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.311 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.78 ' HB3' HG22 ' A' ' 89' ' ' VAL . 9.1 m-20 -58.28 115.11 10.26 Favored Pre-proline 0 N--CA 1.465 0.282 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.34 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.489 ' O ' HG21 ' A' ' 89' ' ' VAL . 34.4 Cg_exo -58.45 163.15 10.97 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.971 2.447 . . . . 0.0 112.629 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -73.91 126.44 10.66 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.638 2.226 . . . . 0.0 112.45 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t0 58.47 62.42 1.97 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.157 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.471 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.5 t-80 -123.06 154.09 39.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -56.81 -43.8 81.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.245 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 22.1 m -59.7 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.324 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.78 HG22 ' HB3' ' A' ' 82' ' ' ASN . 22.5 t -62.77 -44.77 99.76 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.922 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.55 -41.83 95.31 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.823 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.9 mtt -65.05 -43.61 91.72 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.606 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.497 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -60.91 -48.18 83.02 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.021 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -46.98 77.4 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.0 tttp -63.02 -38.06 89.67 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.842 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.703 HD23 ' CD2' ' A' ' 18' ' ' HIS . 12.6 mt -66.91 -36.27 81.88 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.086 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 7.5 tm0? -70.06 -47.85 60.27 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.074 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -61.3 -46.84 88.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.496 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.401 HG13 ' N ' ' A' ' 99' ' ' PHE . 14.1 p -63.36 -43.31 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.234 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.401 ' N ' HG13 ' A' ' 98' ' ' VAL . 2.2 t80 -65.32 -51.01 63.46 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.591 0.234 . . . . 0.0 110.803 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -42.77 92.82 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.89 85.88 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.873 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -65.66 -44.18 87.11 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.982 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -43.47 95.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.757 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.8 -44.22 90.64 Favored 'General case' 0 N--CA 1.46 0.065 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -64.72 -40.91 96.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.603 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -44.4 72.04 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.827 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -72.23 -42.34 65.82 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.206 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.492 -0.766 . . . . 0.0 110.839 179.848 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.628 0.251 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -61.42 -40.88 96.03 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.797 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -38.61 89.0 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.994 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -71.67 -36.1 70.53 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.806 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -50.19 61.61 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.556 ' HA ' HD12 ' A' ' 9' ' ' ILE . 29.7 p -62.25 -37.79 86.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.046 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.8 m -62.69 -36.42 82.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.915 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.11 -41.93 98.27 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.35 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.556 HD12 ' HA ' ' A' ' 6' ' ' CYS . 11.2 mt -63.97 -46.34 94.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-O 120.663 0.268 . . . . 0.0 110.657 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.9 mt -62.17 -36.25 81.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.86 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.6 mttp -58.84 -31.7 68.74 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.33 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 3.3 tt0 -58.1 -36.59 73.1 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.365 0.126 . . . . 0.0 111.016 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.0 mtt -56.87 -37.1 70.87 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.185 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.33 16.61 19.91 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.575 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -95.97 15.48 20.45 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.689 0.28 . . . . 0.0 111.53 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.31 24.03 1.13 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.595 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 48.8 mttp -116.91 -32.78 4.97 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.838 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.86 18.51 3.51 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.01 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.48 -35.71 81.37 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.494 0.183 . . . . 0.0 111.494 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.54 70.42 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.114 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.443 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 10.2 m-85 -99.71 -24.84 14.58 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.594 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.55 -16.17 35.37 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.623 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 12.2 t90 -53.45 -51.83 72.2 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.298 0.094 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.623 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 90.3 Cg_endo -82.74 -19.4 6.11 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.476 2.117 . . . . 0.0 113.189 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -97.42 36.16 1.52 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.622 0.249 . . . . 0.0 111.59 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.51 -58.15 0.99 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.858 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -66.35 138.46 95.86 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.966 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.01 160.72 32.62 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.787 2.325 . . . . 0.0 112.507 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 29' ' ' VAL . 8.7 m -88.91 87.49 2.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 121.024 0.44 . . . . 0.0 110.745 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.69 104.34 0.22 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.111 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.498 HG23 ' C ' ' A' ' 36' ' ' LEU . 12.9 p -59.73 -36.6 66.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.72 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.06 -47.03 54.57 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.29 49.95 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.77 -21.51 40.96 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.87 57.19 8.1 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.387 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.498 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -126.58 65.28 1.26 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 111.179 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -64.94 -19.71 66.09 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -76.15 -19.46 58.45 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.195 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.447 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -59.48 -41.83 90.71 Favored 'General case' 0 CA--C 1.526 0.056 0 CA-C-O 120.496 0.189 . . . . 0.0 110.786 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.51 -32.72 74.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.653 0.263 . . . . 0.0 110.948 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 m-20 -75.81 -45.77 34.19 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.03 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.617 HD12 ' CE2' ' A' ' 81' ' ' TYR . 49.3 mt -74.56 -34.45 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.461 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.447 HG13 ' CE2' ' A' ' 39' ' ' TYR . 33.0 mm -103.64 107.99 23.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.631 0.253 . . . . 0.0 111.16 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -68.52 -34.05 75.2 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.468 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -130.41 88.7 46.6 Favored Pre-proline 0 CA--C 1.532 0.253 0 CA-C-O 120.704 0.287 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.72 140.72 39.68 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.738 2.292 . . . . 0.0 112.632 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttm -160.61 153.62 21.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.018 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -147.56 162.0 39.98 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.5 tpp -54.54 -38.94 67.18 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 t -62.51 -39.71 94.39 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.449 0.166 . . . . 0.0 111.108 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.7 m -70.97 -40.62 71.82 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.982 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.4 HG22 ' CE2' ' A' ' 67' ' ' PHE . 15.4 mt -69.7 -44.83 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.546 0.213 . . . . 0.0 110.785 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.14 -35.1 79.18 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.671 -0.241 . . . . 0.0 111.1 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -44.01 84.26 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.082 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.63 -49.76 76.24 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.844 0.354 . . . . 0.0 110.109 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.6 tp -63.09 -34.29 77.28 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.716 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.37 -39.74 88.3 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.193 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.0 15.41 10.11 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 62.77 27.18 15.97 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.303 0.241 . . . . 0.0 111.585 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -75.95 -34.43 59.83 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.84 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -78.21 99.35 6.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.938 0.399 . . . . 0.0 110.588 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -58.0 -32.58 68.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -146.55 168.21 21.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 111.057 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.18 -16.9 61.42 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.363 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -45.92 90.19 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.634 0.254 . . . . 0.0 110.334 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.41 -38.93 85.38 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.53 ' O ' HG23 ' A' ' 71' ' ' VAL . 20.1 t80 -63.42 -52.65 60.65 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.603 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -64.14 -31.34 80.5 Favored Glycine 0 C--N 1.335 0.51 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.151 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.92 91.22 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.829 0.315 . . . . 0.0 111.182 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -72.2 -30.33 64.85 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.43 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 67' ' ' PHE . 43.4 t -65.46 -47.99 84.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.759 0.314 . . . . 0.0 110.498 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 56.9 mtp85 -59.63 -39.68 85.1 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.25 -46.05 74.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.815 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -59.28 -46.8 87.57 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.249 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -66.09 -35.52 80.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.773 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.0 m -59.65 -46.77 88.03 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.503 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.21 -36.43 61.39 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.507 0.194 . . . . 0.0 110.977 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -39.09 83.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.231 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -57.3 -34.65 68.91 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.15 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.7 tttt -66.37 -44.02 84.32 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.598 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.617 ' CE2' HD12 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -70.39 -37.74 74.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.24 179.757 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.736 ' HB3' HG22 ' A' ' 89' ' ' VAL . 17.3 m120 -65.61 111.62 6.67 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.529 ' O ' HG21 ' A' ' 89' ' ' VAL . 42.8 Cg_endo -67.18 147.14 78.41 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.629 2.219 . . . . 0.0 112.356 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 50.2 Cg_exo -53.55 131.74 45.29 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.671 2.247 . . . . 0.0 112.723 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t70 63.0 64.31 0.87 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.514 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.562 ' HB3' HG23 ' A' ' 89' ' ' VAL . 5.5 t-80 -136.8 155.94 49.15 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.034 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -55.8 -44.46 77.82 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.403 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.6 m -63.52 -35.24 71.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.637 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.736 HG22 ' HB3' ' A' ' 82' ' ' ASN . 26.2 t -60.8 -46.27 96.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.88 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.33 -33.7 76.45 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.027 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 6.0 mtm -64.42 -46.56 82.69 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.861 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.45 -44.29 96.77 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.839 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -65.84 -43.09 89.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.731 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.443 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 22.3 tttp -63.37 -42.94 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.103 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -66.65 -39.07 88.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -69.11 -43.79 73.73 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.703 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -61.48 -46.88 88.16 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.33 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p -66.33 -42.95 91.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.808 -0.178 . . . . 0.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -63.85 -51.59 63.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.862 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.39 -41.31 98.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -47.56 85.21 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.658 0.266 . . . . 0.0 110.839 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -43.9 78.32 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.798 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.456 ' HD1' HD12 ' A' ' 107' ' ' LEU . 0.3 OUTLIER -60.45 -42.89 97.08 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.027 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.04 -32.62 73.11 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.007 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -70.9 -44.43 66.27 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.987 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 9.2 ptm -69.06 -33.38 73.47 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.195 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . 0.456 HD12 ' HD1' ' A' ' 103' ' ' PHE . 8.8 mt -83.89 -42.24 16.57 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.041 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.842 179.758 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 . . . . . 0 N--CA 1.488 1.438 0 CA-C-O 120.683 0.278 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -69.07 -34.75 75.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.948 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.06 -46.8 76.48 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.553 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -32.29 71.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.15 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.62 -40.91 84.65 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.563 0.22 . . . . 0.0 110.799 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.3 m -63.48 -38.95 93.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.856 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.9 m -56.93 -35.7 69.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.68 97.73 Favored Glycine 0 C--N 1.337 0.612 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.628 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 16.1 mt -65.47 -47.67 85.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.705 0.288 . . . . 0.0 110.66 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.493 HD13 ' HG3' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -63.45 -35.79 81.61 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.776 179.403 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -30.75 66.69 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.333 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.491 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 52.7 tt0 -58.55 -36.66 74.25 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.004 0.19 . . . . 0.0 110.829 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -58.53 -37.17 75.09 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.679 0.276 . . . . 0.0 110.397 178.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.82 5.29 33.0 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.491 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.81 17.84 11.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.629 0.252 . . . . 0.0 111.349 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 47.6 mmtt 68.02 37.37 3.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.125 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.436 ' CD ' ' HG3' ' A' ' 12' ' ' GLU . 55.0 mttt -128.09 -39.28 1.75 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.07 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -123.73 19.09 9.47 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.374 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.01 62.76 Favored 'General case' 0 C--N 1.335 -0.052 0 CA-C-O 120.643 0.259 . . . . 0.0 111.106 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.69 -36.16 62.75 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.275 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 5.3 m-85 -81.42 -33.08 32.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.217 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.17 20.0 16.51 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.403 ' N ' ' CD ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.68 -50.88 62.16 Favored Pre-proline 0 CA--C 1.529 0.154 0 CA-C-N 116.94 -0.118 . . . . 0.0 111.049 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 23' ' ' TRP . 50.5 Cg_exo -53.88 -25.43 35.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.548 2.165 . . . . 0.0 112.934 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -118.84 37.11 4.2 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.132 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.16 -35.36 64.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.17 162.57 47.3 Favored Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.18 -177.4 0.12 Allowed 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.155 2.57 . . . . 0.0 112.768 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 m -120.91 83.78 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.252 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.03 101.85 0.31 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.7 p -61.83 -36.63 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.737 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -71.83 -47.65 51.69 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.563 0.22 . . . . 0.0 111.391 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -47.29 49.72 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.4 mt -80.91 -21.49 40.5 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.88 57.61 9.48 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.455 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.6 OUTLIER -126.05 74.5 1.44 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.051 0.453 . . . . 0.0 111.296 -179.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.92 -3.85 34.56 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.777 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -76.25 -20.0 57.8 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.37 0.129 . . . . 0.0 111.304 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.507 ' HA ' HD12 ' A' ' 42' ' ' ILE . 4.3 t80 -57.42 -34.06 68.53 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 116.671 -0.241 . . . . 0.0 110.969 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.48 -40.46 96.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.751 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.91 -41.02 75.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.476 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.507 HD12 ' HA ' ' A' ' 39' ' ' TYR . 12.8 mt -68.74 -51.44 45.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.305 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.96 150.5 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-O 120.941 0.401 . . . . 0.0 111.644 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.1 pttm -96.04 -32.77 12.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.677 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -110.96 83.39 3.63 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-O 120.705 0.288 . . . . 0.0 111.057 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -73.01 125.76 10.65 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.833 2.355 . . . . 0.0 112.65 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.1 mtp -148.63 141.36 24.56 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.148 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.66 168.99 13.6 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.493 ' HA ' HD12 ' A' ' 52' ' ' ILE . 26.9 mtt -56.31 -38.74 71.69 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.102 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.5 t -62.45 -35.72 80.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.833 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.3 m -73.18 -38.78 66.03 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.017 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' A' ' 49' ' ' MET . 19.7 mt -66.89 -45.13 88.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.917 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.493 ' HG3' HD13 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -69.31 -34.24 74.37 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.959 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -57.32 -42.91 82.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.729 -0.214 . . . . 0.0 110.901 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -62.02 -49.38 76.24 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.879 0.371 . . . . 0.0 110.112 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 56' ' ' LEU . 10.3 tp -63.76 -32.66 74.24 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.002 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.77 -40.6 88.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.651 0.262 . . . . 0.0 111.056 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.34 15.19 12.59 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.861 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.52 27.75 17.41 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.629 0.252 . . . . 0.0 111.599 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -70.68 -34.29 71.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.68 0.276 . . . . 0.0 110.689 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -73.63 106.55 5.44 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.608 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -80.58 -28.8 37.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.068 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -146.38 165.25 29.9 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.944 0.402 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.11 -15.67 61.48 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.55 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -63.1 -44.94 94.27 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.48 -37.98 77.49 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.848 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.1 t80 -66.53 -53.62 32.84 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.45 -38.0 84.87 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.665 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.92 -35.27 76.25 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.591 0.234 . . . . 0.0 111.22 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -76.17 -34.2 59.35 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.329 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.2 t -67.09 -48.24 79.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 120.621 0.248 . . . . 0.0 110.622 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.48 -34.03 76.88 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.082 179.656 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.25 -48.38 65.23 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -59.33 -42.72 92.12 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.3 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.11 -44.0 95.17 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.795 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -37.26 86.56 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.777 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -69.66 -47.85 61.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.832 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.24 -33.91 69.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.206 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -56.54 -39.45 73.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.149 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -75.01 -38.92 61.45 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.791 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -59.89 -31.86 70.2 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.674 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.779 ' HB2' HG22 ' A' ' 89' ' ' VAL . 21.8 p30 -92.89 148.57 36.13 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-O 120.811 0.338 . . . . 0.0 111.104 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.76 ' O ' HG21 ' A' ' 89' ' ' VAL . 97.7 Cg_endo -80.17 169.63 17.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.999 2.466 . . . . 0.0 112.653 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.22 128.67 11.49 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.513 2.142 . . . . 0.0 112.525 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 t70 62.51 69.26 0.61 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.283 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.855 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.5 t60 -136.31 158.05 45.35 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.229 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.18 -44.68 96.06 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.326 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.475 HG22 ' CD2' ' A' ' 86' ' ' HIS . 5.3 m -64.7 -30.65 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.373 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.855 HG23 ' HB3' ' A' ' 86' ' ' HIS . 12.5 t -69.37 -40.73 80.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.893 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.58 -35.36 68.11 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.024 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . 0.412 ' HG2' ' CD2' ' A' ' 21' ' ' TYR . 6.1 mtt -65.6 -44.29 87.05 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.744 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.27 -47.59 85.36 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.238 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -59.57 -43.41 93.63 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.745 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.417 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.0 tttt -68.62 -40.45 80.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.868 179.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -34.4 78.23 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.086 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -69.3 -44.0 72.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.698 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -63.54 -46.86 84.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.15 -43.09 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.198 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.0 -50.63 67.76 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.787 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -45.98 85.39 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.762 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.2 mtp -62.44 -46.29 89.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -64.73 -42.5 95.17 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.02 -45.26 95.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.815 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.68 73.18 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.9 -43.36 65.49 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.065 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.7 ptm -69.27 -33.32 73.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.214 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.46 -42.82 14.13 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.047 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.729 0.299 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -57.97 -36.94 73.3 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 mt -62.54 -34.82 77.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.024 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 -32.62 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.076 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.31 -48.22 57.58 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.068 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.661 ' HA ' HD12 ' A' ' 9' ' ' ILE . 30.1 p -66.11 -36.99 84.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.385 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 82.9 p -57.57 -34.42 69.18 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.96 -43.46 98.1 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.454 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.661 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.3 mt -63.99 -45.74 95.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.849 0.357 . . . . 0.0 110.058 179.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.582 HD21 ' HG2' ' A' ' 53' ' ' LYS . 9.3 tp -61.27 -35.46 77.36 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -36.38 73.01 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.142 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -37.82 82.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.822 -0.172 . . . . 0.0 111.18 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -37.39 75.76 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 110.273 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -108.45 17.65 21.85 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.299 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.73 0.14 57.17 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt 78.43 16.78 1.17 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.288 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.57 -36.22 6.25 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.63 179.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -113.55 -3.26 13.68 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.786 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.75 -29.47 68.18 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.447 0.165 . . . . 0.0 111.409 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.67 -46.1 83.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.649 0.262 . . . . 0.0 110.85 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.6 -34.21 71.89 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.865 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -98.15 19.55 13.93 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.572 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.505 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 42.6 t90 -59.58 -51.63 79.76 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 116.77 -0.196 . . . . 0.0 111.47 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 57.0 Cg_endo -70.35 -9.66 26.38 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.251 1.967 . . . . 0.0 113.01 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -120.13 43.16 2.77 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.044 0.45 . . . . 0.0 110.903 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.43 -37.95 11.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.683 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -107.86 160.93 25.0 Favored Pre-proline 0 N--CA 1.465 0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.055 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.35 -176.07 0.13 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.969 2.446 . . . . 0.0 112.761 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.31 79.43 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.11 0.481 . . . . 0.0 111.308 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.686 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 2.2 t0 -63.76 101.44 0.36 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.68 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.66 -39.53 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.715 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -71.92 -46.86 56.15 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.271 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -70.5 -48.75 54.16 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.51 -21.49 38.6 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.66 54.23 13.29 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.476 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 39' ' ' TYR . 0.5 OUTLIER -126.34 67.88 1.22 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.016 0.436 . . . . 0.0 111.148 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -65.41 -22.2 66.75 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.312 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.3 -19.89 57.83 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.318 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.471 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.4 t80 -60.79 -45.61 93.72 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-O 120.536 0.207 . . . . 0.0 110.964 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 26.8 t -63.48 -30.88 71.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.56 -34.39 62.93 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.882 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 mt -83.73 -34.81 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.517 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.678 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.8 mm -102.28 124.55 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -87.45 -33.27 19.1 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.392 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 75.26 68.79 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.738 0.304 . . . . 0.0 110.945 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.32 128.94 32.58 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.885 2.39 . . . . 0.0 112.692 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -152.18 141.32 21.32 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.036 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.35 162.7 31.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.789 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.407 ' HA ' HD12 ' A' ' 52' ' ' ILE . 0.0 OUTLIER -53.52 -39.89 65.01 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.716 179.628 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.7 t -64.14 -37.71 88.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.4 m -74.05 -36.49 64.37 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.297 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.65 HG23 ' OH ' ' A' ' 61' ' ' TYR . 9.6 mt -71.58 -44.3 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.859 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.582 ' HG2' HD21 ' A' ' 10' ' ' LEU . 3.9 mtpm? -64.21 -37.77 88.65 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 p -57.9 -38.76 76.41 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.372 0.13 . . . . 0.0 111.122 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -60.36 -48.25 82.55 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.5 tp -62.91 -34.98 78.57 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.468 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.17 -38.58 91.75 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.271 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.46 15.15 9.75 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 59.56 27.28 16.44 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.653 0.263 . . . . 0.0 111.504 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.67 -32.38 57.9 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.665 0.269 . . . . 0.0 110.594 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.65 ' OH ' HG23 ' A' ' 52' ' ' ILE . 4.7 m-85 -71.11 104.93 3.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.872 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -62.64 -30.77 71.61 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.96 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.99 172.48 11.43 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.764 0.316 . . . . 0.0 111.32 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.32 -17.58 64.29 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.589 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -62.82 -43.23 99.36 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.659 0.266 . . . . 0.0 110.507 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.89 -34.67 71.82 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.831 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.8 t80 -62.81 -53.38 55.12 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.073 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.21 -33.19 64.5 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.705 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.41 -44.88 86.03 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.529 0.204 . . . . 0.0 111.286 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -66.7 -30.76 71.08 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.343 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 67' ' ' PHE . 42.6 t -67.09 -47.33 82.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-O 120.692 0.282 . . . . 0.0 110.374 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -62.57 -41.29 98.83 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -47.63 83.53 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.724 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 12.8 tmm? -61.88 -45.98 91.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.893 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -61.92 -42.49 99.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.171 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.4 m -62.67 -42.8 99.81 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.147 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.678 ' HB3' HD12 ' A' ' 43' ' ' ILE . 2.6 m120 -73.86 -47.12 40.53 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.154 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.0 t -60.19 -37.39 80.06 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.243 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -60.72 -33.12 72.42 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.019 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -61.52 -35.69 78.44 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.728 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -85.53 -34.02 21.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.356 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.506 ' HB3' HG22 ' A' ' 89' ' ' VAL . 23.0 m-20 -56.76 111.67 3.59 Favored Pre-proline 0 N--CA 1.466 0.365 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.107 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.687 ' O ' HG21 ' A' ' 89' ' ' VAL . 50.0 Cg_exo -56.46 154.17 31.35 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.803 2.335 . . . . 0.0 112.654 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.0 136.22 24.49 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.569 2.179 . . . . 0.0 112.516 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.63 55.45 4.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.419 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.774 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.9 t-80 -121.79 148.62 44.44 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.7 -44.09 81.17 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.308 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.7 m -61.57 -33.17 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.384 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.774 HG23 ' HB3' ' A' ' 86' ' ' HIS . 25.4 t -65.5 -44.47 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.781 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.76 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.2 mtp -65.79 -42.37 90.81 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.73 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.5 -47.69 84.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.489 ' HD2' HG12 ' A' ' 89' ' ' VAL . 8.2 mtp180 -59.71 -44.14 93.83 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.809 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -41.97 91.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.721 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 80.3 mt -65.15 -34.43 78.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.184 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -69.12 -43.92 73.42 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.631 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.41 -47.08 83.48 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.162 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.69 -42.96 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.012 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -63.57 -50.91 67.62 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.817 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -44.29 93.57 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.019 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -48.11 83.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.023 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -42.67 86.28 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.404 ' O ' ' HG3' ' A' ' 106' ' ' MET . 0.5 OUTLIER -62.64 -46.95 85.88 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.017 179.791 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.79 81.93 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.25 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -43.58 65.44 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.368 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -69.7 -34.12 73.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.76 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.01 -42.08 15.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.615 0.245 . . . . 0.0 111.069 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 . . . . . 0 C--O 1.252 1.189 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.586 179.94 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.631 0.253 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -59.82 -36.33 76.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.931 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.459 HD22 HH21 ' A' ' 59' ' ' ARG . 13.8 mt -58.74 -46.74 86.72 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.9 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.07 -37.46 75.5 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.086 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -40.29 96.72 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.031 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.76 -37.76 79.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.914 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.6 t -58.07 -38.53 76.52 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.998 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -45.31 95.77 Favored Glycine 0 C--N 1.336 0.535 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.379 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -64.14 -42.97 97.23 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.77 0.319 . . . . 0.0 110.357 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.598 HD13 ' HE2' ' A' ' 53' ' ' LYS . 10.2 mt -62.37 -35.61 79.7 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.706 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -28.77 64.78 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.806 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.48 -37.12 74.87 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.587 0.232 . . . . 0.0 111.006 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -37.02 78.12 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.609 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.25 21.63 15.59 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -113.47 18.8 17.41 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.717 0.294 . . . . 0.0 111.506 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.47 28.59 4.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.246 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -117.21 -31.93 5.16 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.394 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.482 ' CE1' HG11 ' A' ' 98' ' ' VAL . 1.7 t60 -148.58 30.49 0.82 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 110.832 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.81 -40.93 54.09 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.121 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.27 -37.13 74.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.119 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.442 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 25.4 m-85 -77.82 -34.17 52.13 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.435 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.588 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -103.34 20.91 16.9 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.413 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.93 -53.3 43.45 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-N 116.933 -0.121 . . . . 0.0 111.14 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.413 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 84.3 Cg_endo -78.36 -5.78 15.17 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.349 2.032 . . . . 0.0 112.907 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -106.36 37.79 2.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.645 0.26 . . . . 0.0 110.93 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -121.39 -58.09 1.8 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.954 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.65 145.62 92.67 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.888 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.96 -177.12 3.57 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.607 2.205 . . . . 0.0 112.679 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.421 ' O ' HG23 ' A' ' 29' ' ' VAL . 13.5 m -112.6 79.76 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.041 0.448 . . . . 0.0 111.172 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.588 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -58.94 104.35 0.23 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.968 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 36' ' ' LEU . 10.4 p -62.43 -39.8 85.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.548 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.26 -45.9 58.21 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.702 -0.227 . . . . 0.0 111.606 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.588 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.99 -48.48 44.56 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.318 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.0 mt -81.31 -21.48 39.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.59 58.41 5.42 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.458 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.558 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -130.92 75.93 1.69 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.898 0.38 . . . . 0.0 111.442 -179.835 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -6.16 45.15 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.741 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.28 -20.01 57.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.385 0.136 . . . . 0.0 111.291 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.18 -41.42 83.85 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.751 -0.204 . . . . 0.0 111.012 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -64.04 -40.35 96.11 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.652 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.62 -44.31 90.94 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.818 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.4 mt -71.82 -51.68 30.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.076 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 mt -128.11 104.12 11.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.915 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -59.36 -29.89 68.01 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.512 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -110.27 81.51 2.28 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 120.817 0.341 . . . . 0.0 110.615 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.21 139.03 37.73 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.668 2.246 . . . . 0.0 112.603 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.605 ' HB3' ' HE2' ' A' ' 74' ' ' MET . 8.7 tpp -149.56 138.56 21.18 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.245 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -136.75 164.42 28.31 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.722 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -52.43 -41.43 63.24 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.719 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.5 t -65.41 -38.85 91.17 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.781 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -71.43 -43.31 66.97 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.114 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.536 HG23 ' OH ' ' A' ' 61' ' ' TYR . 8.4 mt -65.14 -45.12 95.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.175 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.598 ' HE2' HD13 ' A' ' 10' ' ' LEU . 1.0 OUTLIER -65.24 -34.68 78.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -57.56 -40.25 78.53 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.983 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -60.25 -47.65 85.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.851 0.358 . . . . 0.0 110.121 179.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.5 tp -66.97 -33.42 75.54 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.595 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -64.11 -41.52 97.22 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.402 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.23 15.15 9.39 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.459 HH21 HD22 ' A' ' 3' ' ' LEU . 1.5 mmp_? 58.96 27.85 16.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.588 0.233 . . . . 0.0 111.394 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.9 -32.83 45.9 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.63 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.536 ' OH ' HG23 ' A' ' 52' ' ' ILE . 1.8 m-85 -65.4 105.7 1.22 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.933 0.397 . . . . 0.0 110.844 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -32.16 70.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -162.97 165.28 25.15 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.87 0.367 . . . . 0.0 111.596 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -20.11 64.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.267 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 110.27 -0.271 . . . . 0.0 110.27 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -69.68 -34.18 73.6 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.887 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.448 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.1 t80 -59.2 -53.64 55.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.96 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.73 -35.94 90.77 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.373 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.67 -36.65 79.27 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -76.64 -38.99 53.72 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.167 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 67' ' ' PHE . 44.6 t -67.04 -47.75 81.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.948 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -59.28 -33.73 71.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.591 0.234 . . . . 0.0 110.789 179.49 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 tt -71.87 -42.1 67.26 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.473 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.605 ' HE2' ' HB3' ' A' ' 47' ' ' MET . 9.8 tpp -60.29 -46.6 89.27 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.197 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -55.71 -40.67 72.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.147 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.2 t -67.78 -41.81 82.65 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.014 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.41 -37.64 65.85 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.393 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -35.96 73.14 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.643 0.259 . . . . 0.0 111.073 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.85 -31.78 68.83 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.193 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.12 -36.03 80.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.748 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -35.94 22.27 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.06 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.838 ' HB3' HG22 ' A' ' 89' ' ' VAL . 15.8 m-20 -67.52 125.66 91.49 Favored Pre-proline 0 N--CA 1.466 0.325 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.071 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.719 ' O ' HG21 ' A' ' 89' ' ' VAL . 52.1 Cg_exo -54.92 158.5 11.04 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.981 2.454 . . . . 0.0 112.86 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -74.57 118.69 5.43 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.596 2.197 . . . . 0.0 112.478 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t0 62.57 70.58 0.56 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.071 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.733 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.0 t-160 -132.53 156.69 46.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.302 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -57.09 -44.28 83.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.186 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.9 m -64.39 -31.88 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.753 0.311 . . . . 0.0 111.141 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.838 HG22 ' HB3' ' A' ' 82' ' ' ASN . 25.8 t -65.73 -40.32 87.46 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.413 ' HA ' ' HD3' ' A' ' 93' ' ' ARG . . . -57.43 -34.42 68.92 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.918 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -33.04 73.81 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.73 66.01 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -68.1 -38.52 82.39 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.856 179.742 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.442 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -61.28 -44.98 96.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.78 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 22' ' ' ALA . 0.3 OUTLIER -66.14 -34.83 78.93 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.746 179.551 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -69.96 -41.65 74.22 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.593 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.38 -46.82 88.56 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.063 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.482 HG11 ' CE1' ' A' ' 18' ' ' HIS . 8.2 p -66.17 -42.92 92.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.898 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.88 -49.82 71.2 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.7 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.51 -40.97 98.43 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.85 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -47.75 84.54 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.68 0.276 . . . . 0.0 110.663 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -43.68 80.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.633 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -45.47 92.37 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.858 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.27 -42.56 95.65 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -70.24 -36.19 74.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.755 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -40.53 76.32 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.029 179.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.67 -42.55 17.99 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -178.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.45 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 . . . . . 0 N--CA 1.488 1.434 0 CA-C-O 120.706 0.289 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.8 -36.87 85.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.866 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.65 -44.14 96.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.845 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -67.86 -39.39 83.76 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.936 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.64 95.56 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.013 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.429 ' HA ' HD12 ' A' ' 9' ' ' ILE . 94.5 m -59.42 -37.24 77.55 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.786 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 m -55.05 -34.13 63.3 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.266 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.78 -47.4 91.15 Favored Glycine 0 C--N 1.337 0.614 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.399 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.1 mt -64.02 -46.64 93.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.791 0.329 . . . . 0.0 110.317 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.534 HD23 ' HG2' ' A' ' 53' ' ' LYS . 1.2 tp -63.02 -35.67 81.0 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.634 179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.47 -27.49 64.45 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.485 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.497 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -58.46 -36.54 73.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.359 0.123 . . . . 0.0 111.014 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.0 mtm -57.85 -37.23 73.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.721 0.295 . . . . 0.0 110.371 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.84 8.16 32.61 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.695 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.497 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.32 14.48 18.24 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.561 0.22 . . . . 0.0 111.48 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 68.53 32.24 4.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.984 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.2 mttm -123.17 -37.79 2.66 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -119.34 18.23 12.95 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.321 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.27 -29.98 48.28 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.278 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.61 -37.64 76.96 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.863 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.412 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 2.8 m-85 -80.16 -33.93 38.0 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.429 ' HB1' ' CE ' ' A' ' 49' ' ' MET . . . -98.07 19.38 14.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.881 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.48 -51.34 68.05 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 121.405 -0.118 . . . . 0.0 111.055 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.23 -23.2 75.2 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.614 2.209 . . . . 0.0 112.806 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -123.87 34.64 5.02 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.927 0.394 . . . . 0.0 110.542 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -76.95 -46.84 22.73 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.776 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 166.6 11.59 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.842 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.22 -171.41 0.7 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.63 2.22 . . . . 0.0 112.436 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.47 HG11 ' CE2' ' A' ' 39' ' ' TYR . 5.7 m -113.18 76.35 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.045 0.45 . . . . 0.0 111.275 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -60.1 98.56 0.06 Allowed 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.1 p -60.54 -38.65 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.833 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -72.12 -46.88 54.9 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.52 -48.34 41.18 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.5 mt -80.81 -21.5 40.83 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.15 52.13 47.04 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.35 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.47 71.66 0.85 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.05 0.452 . . . . 0.0 111.288 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -67.17 -14.85 63.3 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.477 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.17 -19.76 58.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.401 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.47 ' CE2' HG11 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -61.28 -39.07 89.04 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 116.74 -0.209 . . . . 0.0 111.056 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -37.9 86.44 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.773 0.32 . . . . 0.0 110.561 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -67.48 -41.73 84.12 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.917 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 18.0 mt -77.71 -54.77 11.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.239 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.811 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.3 mm -100.95 104.74 16.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.082 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -66.95 -27.3 67.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.486 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.67 72.38 78.14 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.698 0.285 . . . . 0.0 110.802 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -58.0 132.17 47.94 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.359 . . . . 0.0 112.489 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -158.42 127.63 5.66 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.31 170.81 9.92 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.931 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.616 ' HA ' HD12 ' A' ' 52' ' ' ILE . 18.2 ttm -55.73 -36.56 67.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.895 0.379 . . . . 0.0 110.182 179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.0 t -62.13 -38.93 90.81 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.677 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 m -73.29 -36.29 66.28 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.105 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 49' ' ' MET . 23.4 mt -66.51 -44.78 90.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.627 0.251 . . . . 0.0 110.981 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.534 ' HG2' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -66.24 -35.33 80.15 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.154 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.6 p -57.47 -41.14 80.03 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.472 0.177 . . . . 0.0 111.13 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -46.55 88.78 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.74 -34.73 78.49 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.775 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.38 -41.41 93.73 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.4 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.494 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . . . -90.66 15.28 11.3 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.31 27.55 16.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.649 0.261 . . . . 0.0 111.498 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 34.5 mt-10 -73.32 -32.74 64.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.743 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.468 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 4.6 m-85 -69.04 103.93 1.99 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.781 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -63.21 -29.39 70.74 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.476 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -166.41 179.68 5.44 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.904 0.383 . . . . 0.0 111.567 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.77 -20.94 61.08 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.409 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.86 -45.99 89.98 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.674 0.273 . . . . 0.0 110.327 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.76 -30.14 69.52 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.797 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.468 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -59.85 -49.74 76.53 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.595 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.92 -33.11 77.22 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.513 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.73 -35.87 75.44 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.567 0.222 . . . . 0.0 111.17 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.3 61.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.811 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.7 t -64.82 -48.32 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.081 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -33.75 74.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.031 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.3 tp -70.69 -47.06 61.79 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.62 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.7 ttp -60.49 -43.83 96.58 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.411 ' CE2' ' HB2' ' A' ' 96' ' ' GLN . 3.2 m-85 -58.43 -43.51 88.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 t -59.27 -45.54 90.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.735 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.811 ' HB3' HD12 ' A' ' 43' ' ' ILE . 58.9 m-20 -70.48 -39.92 73.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.724 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -42.5 91.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.106 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -58.12 -39.77 79.55 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.132 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.85 -45.65 73.99 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.978 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -72.17 -39.84 68.39 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.197 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.659 ' HB3' HG22 ' A' ' 89' ' ' VAL . 82.6 m-20 -67.9 125.25 91.15 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.187 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.684 ' O ' HG21 ' A' ' 89' ' ' VAL . 53.4 Cg_endo -69.32 164.46 34.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.714 2.276 . . . . 0.0 112.428 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.38 128.91 11.55 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.562 2.175 . . . . 0.0 112.585 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.8 t0 60.2 68.07 0.8 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.0 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.662 ' HB3' HG23 ' A' ' 89' ' ' VAL . 5.2 t60 -131.63 157.8 42.73 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.28 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.33 -44.31 84.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.039 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.41 HG22 ' HD2' ' A' ' 86' ' ' HIS . 29.8 m -64.17 -32.87 59.13 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.163 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.684 HG21 ' O ' ' A' ' 83' ' ' PRO . 23.9 t -68.74 -44.62 82.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.31 73.2 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.884 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 42.1 mtt -66.07 -40.27 90.75 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.87 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.36 90.21 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -49.12 79.05 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.412 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.1 tttm -66.57 -39.21 88.36 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.891 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -35.16 76.47 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.411 ' HB2' ' CE2' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -68.98 -44.58 72.6 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.739 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.51 -46.71 84.83 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.28 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.616 HG23 ' NH1' ' A' ' 102' ' ' ARG . 9.3 p -62.22 -43.13 97.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.14 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -49.65 70.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.669 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -42.92 99.75 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -48.01 83.36 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.996 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.616 ' NH1' HG23 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -67.23 -44.27 79.9 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.912 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -59.83 -48.67 80.76 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.856 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.87 -37.59 84.72 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.521 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -72.1 -44.21 63.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 1.3 tmm? -67.03 -45.09 78.54 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.382 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -40.14 35.63 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.891 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.411 -179.666 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 120.744 0.307 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -59.58 -42.56 92.77 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.769 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.489 HD21 ' O ' ' A' ' 61' ' ' TYR . 5.8 mt -64.78 -46.11 83.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.813 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -33.6 74.01 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.954 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.57 -43.38 85.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.674 0.273 . . . . 0.0 110.724 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.591 ' HA ' HD12 ' A' ' 9' ' ' ILE . 93.9 m -62.55 -40.77 97.88 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.464 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -36.08 75.21 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.057 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.29 91.89 Favored Glycine 0 C--N 1.335 0.52 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.359 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mt -65.52 -47.51 86.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.705 0.288 . . . . 0.0 110.502 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.26 -35.61 80.92 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.16 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mttp -57.96 -31.14 66.58 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.229 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.433 ' CG ' ' HD3' ' A' ' 17' ' ' LYS . 4.3 tt0 -59.65 -38.07 80.42 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.502 0.192 . . . . 0.0 110.985 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.403 ' HA ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -61.67 -38.12 86.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.727 0.299 . . . . 0.0 110.484 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -96.35 -1.74 47.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.609 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.6 9.83 22.64 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 75.65 20.85 1.79 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.612 0.365 . . . . 0.0 111.335 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 9.8 mtpt -108.73 -38.94 5.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.32 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.472 ' NE2' HG11 ' A' ' 98' ' ' VAL . 6.6 m-70 -121.44 16.35 11.3 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.289 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.08 -32.42 59.25 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.336 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.75 96.03 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.738 0.304 . . . . 0.0 111.039 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -72.84 -36.32 67.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.906 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.29 24.89 10.82 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.498 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.469 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.41 -57.73 16.34 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.388 -179.647 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 24.5 Cg_endo -62.01 -17.15 54.41 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.372 2.048 . . . . 0.0 113.002 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.37 35.51 3.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 111.08 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.99 -35.61 37.2 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.633 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HB2' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -119.63 156.64 53.44 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.369 -179.759 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.426 ' HD2' ' HB2' ' A' ' 27' ' ' LYS . 29.6 Cg_endo -63.19 -178.55 0.46 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.902 2.402 . . . . 0.0 112.714 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.7 m -114.89 86.69 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.13 0.491 . . . . 0.0 111.156 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.44 103.56 0.25 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.713 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 36' ' ' LEU . 12.2 p -59.71 -40.94 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.14 -46.05 58.05 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.01 48.77 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 mt -81.91 -21.57 37.27 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.29 64.27 2.94 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.566 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.525 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -134.53 79.46 1.8 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.313 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -10.26 59.29 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.662 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -76.23 -19.64 58.18 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.418 0.151 . . . . 0.0 111.34 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.405 ' CZ ' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -57.75 -34.71 69.82 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.508 0.194 . . . . 0.0 111.141 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 35.2 t -65.21 -37.45 87.34 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.83 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -75.83 -43.41 46.08 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.213 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.7 mt -74.12 -61.6 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.279 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.405 HG13 ' CZ ' ' A' ' 39' ' ' TYR . 30.8 mm -90.96 106.62 17.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.28 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 pttp -66.14 -33.69 76.36 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -124.71 94.38 44.5 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.708 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.22 110.97 2.13 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.679 2.253 . . . . 0.0 112.364 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.7 tpp -144.21 133.32 22.88 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.68 163.57 27.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.184 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.611 ' HA ' HD12 ' A' ' 52' ' ' ILE . 67.6 mtt -54.72 -38.25 66.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.928 -179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 t -62.36 -38.15 88.42 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.604 0.24 . . . . 0.0 110.824 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 91.3 m -74.17 -39.84 62.95 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.993 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 49' ' ' MET . 9.2 mt -65.35 -45.08 94.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 120.574 0.226 . . . . 0.0 111.07 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -36.51 83.28 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.9 t -57.72 -39.43 77.26 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.917 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -49.57 77.07 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.8 tp -61.16 -34.08 74.46 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.468 179.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -65.29 -37.34 86.86 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.118 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.77 15.27 8.56 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 60.83 27.25 17.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.624 0.25 . . . . 0.0 111.546 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -34.21 53.85 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.803 0.335 . . . . 0.0 110.583 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.489 ' O ' HD21 ' A' ' 3' ' ' LEU . 6.0 m-85 -78.78 107.29 11.38 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.797 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -92.16 -27.38 17.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.222 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -139.15 164.06 30.78 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.894 0.378 . . . . 0.0 111.64 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.73 -18.63 60.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.509 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -45.2 93.73 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.593 0.235 . . . . 0.0 110.457 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -70.49 -36.81 74.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.705 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.449 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 5.6 t80 -63.98 -53.81 44.31 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.901 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.12 -31.51 77.04 Favored Glycine 0 C--N 1.334 0.461 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.661 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.77 94.65 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 111.446 0.165 . . . . 0.0 111.446 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.91 -39.12 83.63 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.401 HG21 ' CZ ' ' A' ' 99' ' ' PHE . 21.8 t -65.2 -48.22 84.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.972 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -64.83 -34.07 77.49 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.145 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -47.81 84.35 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.876 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -60.54 -41.02 93.63 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.949 179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -58.23 -46.36 86.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.93 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.7 m -63.33 -42.03 98.93 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.765 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.3 m-20 -69.27 -34.17 74.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.885 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.07 -33.77 73.86 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.262 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -60.65 -34.21 73.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.095 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.35 -41.25 73.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.853 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.55 -34.98 46.73 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.306 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.406 ' ND2' HG22 ' A' ' 88' ' ' VAL . 51.1 m-20 -92.28 111.83 52.29 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.267 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.432 ' HG2' ' CD2' ' A' ' 86' ' ' HIS . 41.7 Cg_endo -66.64 156.44 65.69 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.753 2.302 . . . . 0.0 112.312 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -66.95 154.66 73.89 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.58 2.187 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.67 37.75 15.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.187 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.479 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.5 t-80 -120.04 150.34 40.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.156 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -44.02 85.33 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.406 HG22 ' ND2' ' A' ' 82' ' ' ASN . 10.7 p -56.76 -36.33 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.554 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.479 HG23 ' HB3' ' A' ' 86' ' ' HIS . 15.6 t -61.04 -44.48 98.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.659 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.65 -36.63 72.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.048 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.4 mtp -62.54 -44.14 97.07 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.898 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -40.66 96.9 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.319 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -47.96 82.76 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.716 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -62.83 -41.59 99.39 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.98 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -37.47 82.91 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.899 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -70.05 -41.83 73.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.656 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.67 -46.95 88.4 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.171 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.472 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.2 p -68.0 -42.92 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.195 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.401 ' CZ ' HG21 ' A' ' 71' ' ' VAL . 5.7 t80 -64.4 -51.54 62.72 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.569 0.223 . . . . 0.0 110.777 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -60.62 -44.09 96.74 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.075 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 4.7 mtp -60.09 -46.73 88.6 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.987 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.08 77.81 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.147 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -42.92 95.97 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.614 -0.267 . . . . 0.0 110.887 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.98 -32.77 73.41 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.91 -44.22 70.11 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.795 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.0 ptm -69.38 -34.67 74.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.359 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.09 -42.38 17.48 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.074 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.731 0.3 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -62.08 -43.84 97.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.901 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.41 HD22 ' O ' ' A' ' 61' ' ' TYR . 0.8 OUTLIER -58.87 -36.83 75.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.092 179.33 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -61.47 -34.79 76.05 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.956 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 47.7 t -62.38 -39.21 92.45 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.881 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.4 m -59.68 -38.57 81.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.881 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.2 t -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.75 -38.09 93.37 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.37 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.2 mt -66.68 -45.86 87.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-O 120.748 0.308 . . . . 0.0 110.38 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.52 80.32 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.802 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mtpp -58.38 -28.2 64.94 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.712 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -58.71 -36.45 74.27 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.585 0.231 . . . . 0.0 110.68 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.462 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 6.6 mtt -59.56 -37.23 77.89 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.556 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.67 1.9 38.1 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.22 19.5 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.647 0.26 . . . . 0.0 111.637 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 mmtt 68.62 28.59 5.72 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.304 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.2 mttt -116.1 -31.25 5.75 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.967 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 29.95 1.3 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.801 0.334 . . . . 0.0 110.805 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -78.15 -36.63 47.42 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.123 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.35 -31.36 69.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.264 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 23.8 m-85 -86.23 -29.81 22.86 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.584 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.646 ' HB2' HD21 ' A' ' 95' ' ' LEU . . . -113.24 23.25 13.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.584 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.5 t90 -62.77 -53.91 52.05 Favored Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 122.481 -0.137 . . . . 0.0 110.913 179.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 92.4 Cg_endo -83.94 -16.77 6.2 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.634 2.223 . . . . 0.0 113.539 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -101.8 33.54 2.97 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.634 0.254 . . . . 0.0 111.61 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -107.27 -46.07 3.96 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.054 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -85.62 161.21 51.61 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.235 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -68.73 166.47 26.03 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.837 2.358 . . . . 0.0 112.743 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.561 HG21 ' CZ ' ' A' ' 39' ' ' TYR . 9.8 m -90.43 82.41 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.152 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . 66.4 m-20 -59.74 105.1 0.34 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.053 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 36' ' ' LEU . 12.3 p -61.37 -40.34 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.744 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -72.22 -45.06 61.82 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . . . -71.27 -48.43 51.02 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.432 HD13 HD21 ' A' ' 36' ' ' LEU . 12.1 mt -80.75 -21.74 40.81 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.26 52.19 18.81 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.476 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.432 HD21 HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -128.17 75.74 1.64 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.97 0.414 . . . . 0.0 111.346 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.26 -11.47 60.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.409 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -17.42 59.45 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.458 0.169 . . . . 0.0 111.458 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.561 ' CZ ' HG21 ' A' ' 29' ' ' VAL . 11.5 t80 -55.79 -39.53 71.4 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.501 0.191 . . . . 0.0 111.129 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.37 -36.51 83.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.678 0.275 . . . . 0.0 110.65 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.78 -45.02 46.45 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.407 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.9 mt -75.4 -52.97 17.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.706 0.288 . . . . 0.0 111.427 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.412 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.1 mm -92.2 104.85 16.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.154 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -72.1 -34.15 68.4 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.365 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -114.37 92.37 27.55 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.83 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.34 128.4 18.29 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.677 2.252 . . . . 0.0 112.563 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.86 139.98 14.25 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.384 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.1 164.03 32.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.283 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.817 ' HA ' HD12 ' A' ' 52' ' ' ILE . 5.7 mtt -58.05 -36.48 72.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.909 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.0 t -61.8 -34.69 76.37 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.63 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.45 -36.47 63.35 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.175 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.817 HD12 ' HA ' ' A' ' 49' ' ' MET . 7.7 mt -68.65 -44.62 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-O 120.676 0.274 . . . . 0.0 110.828 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -62.59 -45.37 93.23 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.203 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 p -57.59 -39.12 76.08 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.806 -0.179 . . . . 0.0 110.875 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.427 ' HD3' ' CZ ' ' A' ' 61' ' ' TYR . 20.2 tttp -60.35 -48.66 80.77 Favored 'General case' 0 N--CA 1.462 0.137 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -35.5 81.34 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.318 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.32 -37.34 86.88 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.279 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.04 15.23 7.62 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.79 27.42 17.2 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.281 0.232 . . . . 0.0 111.597 -179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -80.84 -34.53 33.76 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.725 0.297 . . . . 0.0 110.674 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.427 ' CZ ' ' HD3' ' A' ' 55' ' ' LYS . 3.3 m-85 -77.4 93.37 4.06 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.489 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.0 mtt85 -65.42 -28.87 69.55 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.808 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -159.27 174.08 15.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.861 0.362 . . . . 0.0 111.366 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -10.39 59.68 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.888 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -62.99 -47.65 82.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.569 0.223 . . . . 0.0 110.614 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -72.97 -39.22 66.31 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.579 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.698 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.9 t80 -58.41 -53.7 55.31 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.27 -36.21 90.24 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.446 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.31 96.43 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.606 0.241 . . . . 0.0 110.986 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.98 -37.21 69.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.226 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 67' ' ' PHE . 22.7 t -64.11 -48.46 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.384 0.135 . . . . 0.0 111.272 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -64.7 -32.87 74.73 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.734 -0.212 . . . . 0.0 111.2 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -47.13 74.73 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.806 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttm -59.3 -44.34 92.53 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.228 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -58.01 -42.26 84.86 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.046 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.06 -45.47 90.7 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.93 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.412 ' HB3' HD12 ' A' ' 43' ' ' ILE . 46.5 m-20 -74.73 -33.09 62.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.121 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -39.29 79.69 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.985 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -64.56 -32.18 73.72 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -67.88 -36.46 80.29 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.801 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -82.39 -38.15 24.53 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.333 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.879 ' HB3' HG22 ' A' ' 89' ' ' VAL . 42.2 m-20 -63.56 111.12 4.55 Favored Pre-proline 0 N--CA 1.466 0.357 0 CA-C-N 116.64 -0.254 . . . . 0.0 111.21 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.496 ' O ' HG21 ' A' ' 89' ' ' VAL . 23.6 Cg_exo -64.62 145.91 87.94 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.941 2.427 . . . . 0.0 112.513 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 43.8 Cg_exo -56.14 135.96 72.65 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.662 2.241 . . . . 0.0 112.384 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 t70 60.27 60.04 2.15 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.754 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.7 t60 -130.66 151.93 50.57 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.94 -43.97 86.65 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.158 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.613 HG22 ' HD2' ' A' ' 86' ' ' HIS . 27.0 m -62.51 -32.15 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.599 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.879 HG22 ' HB3' ' A' ' 82' ' ' ASN . 34.5 t -62.77 -45.36 99.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.695 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -41.2 86.69 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.603 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.2 mtt -65.74 -43.39 89.13 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.745 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.58 -47.74 78.9 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.212 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -63.01 -48.92 76.71 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.829 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.434 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 36.0 tttp -62.48 -41.52 98.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.822 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.646 HD21 ' HB2' ' A' ' 22' ' ' ALA . 1.6 mt -63.47 -36.09 82.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.695 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -70.06 -44.28 69.47 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.765 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.17 -46.81 88.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.239 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.6 p -64.73 -42.77 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.922 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -51.32 62.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.436 0.16 . . . . 0.0 110.787 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -46.25 87.83 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.998 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -46.28 90.26 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.839 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -67.07 -43.98 81.24 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.822 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.14 -42.47 94.89 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.82 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.58 -32.84 74.65 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -71.52 -44.17 65.14 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.084 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 4.7 ptm -69.28 -36.06 76.68 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.322 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.5 -41.56 21.53 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.747 -0.206 . . . . 0.0 110.863 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.987 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.744 0.307 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -61.38 -43.44 98.86 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.856 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.99 -40.54 95.1 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.725 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.04 -34.6 78.44 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.144 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.62 -38.15 86.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.737 0.303 . . . . 0.0 110.775 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.0 m -64.52 -37.37 87.31 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.314 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.0 p -58.5 -40.99 84.36 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.7 -0.227 . . . . 0.0 111.147 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -63.07 -45.87 94.58 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.073 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.2 mt -64.28 -45.56 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 120.718 0.294 . . . . 0.0 110.29 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.692 HD22 ' HE3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -63.34 -35.53 80.69 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.641 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -58.15 -27.88 64.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.443 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -58.31 -36.33 73.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.406 0.146 . . . . 0.0 110.859 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.9 mmt -57.46 -37.54 73.03 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.499 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.92 10.78 28.39 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.65 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -91.46 11.21 24.71 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 75.2 26.9 1.16 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 122.578 0.351 . . . . 0.0 111.196 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -121.51 -34.89 3.35 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.41 ' CD2' ' HB2' ' A' ' 21' ' ' TYR . 0.8 OUTLIER -132.83 22.82 4.23 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.622 0.249 . . . . 0.0 111.016 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.97 -36.2 72.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.992 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.34 -36.41 66.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.215 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.41 ' HB2' ' CD2' ' A' ' 18' ' ' HIS . 8.8 m-85 -75.84 -35.36 59.98 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.39 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB2' HD21 ' A' ' 95' ' ' LEU . . . -106.57 23.49 14.15 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -54.59 5.35 Favored Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 116.923 -0.126 . . . . 0.0 111.244 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -85.59 12.6 3.0 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.621 2.214 . . . . 0.0 113.23 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -130.53 56.13 1.78 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.03 0.443 . . . . 0.0 110.785 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.19 -48.82 1.0 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.051 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -64.77 154.08 86.38 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-O 120.599 0.238 . . . . 0.0 111.07 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.72 179.12 6.81 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.851 2.368 . . . . 0.0 112.737 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.7 m -92.57 68.9 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.018 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -59.49 98.97 0.05 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.067 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.11 -37.1 77.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.749 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.11 -45.83 59.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.584 0.216 . . . . 0.0 111.584 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.61 -47.71 45.58 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -80.94 -21.56 40.35 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.65 50.35 49.26 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.385 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -121.33 63.2 0.89 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.438 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -62.25 -18.2 60.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.448 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -76.06 -19.72 58.36 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.58 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -54.81 -39.11 68.14 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.617 0.246 . . . . 0.0 110.939 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -65.04 -40.44 94.81 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.8 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.46 -43.13 91.32 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.31 -45.4 75.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.965 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.516 HD13 ' HB2' ' A' ' 77' ' ' ASN . 7.7 mt -127.45 111.7 25.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.951 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -72.25 -29.86 64.32 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.358 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -118.68 66.96 7.36 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 110.784 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.82 156.42 39.39 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.769 2.313 . . . . 0.0 112.546 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.8 tpp -158.89 160.34 36.01 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.17 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -148.21 166.06 29.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.51 -37.3 70.25 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -65.67 -41.33 92.59 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.401 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -65.04 -41.03 95.59 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.047 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.502 HG23 ' OH ' ' A' ' 61' ' ' TYR . 18.0 mt -67.57 -44.9 86.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.9 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.692 ' HE3' HD22 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -62.45 -34.85 77.62 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.979 179.673 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.5 t -57.55 -42.23 82.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.041 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.75 -48.02 83.66 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.797 0.332 . . . . 0.0 110.177 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.3 tp -64.7 -33.69 76.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.844 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.23 -41.49 98.46 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.415 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.84 15.24 10.17 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 59.11 27.39 16.35 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.651 0.263 . . . . 0.0 111.551 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.42 -32.22 58.36 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.706 0.289 . . . . 0.0 110.687 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.502 ' OH ' HG23 ' A' ' 52' ' ' ILE . 1.8 m-85 -71.02 100.19 1.95 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.3 ttp85 -63.42 -31.54 72.72 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.141 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -162.65 174.56 12.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.826 0.346 . . . . 0.0 111.42 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.53 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -69.83 -14.55 62.81 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.885 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -46.61 87.51 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.663 0.268 . . . . 0.0 110.394 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.68 -35.48 72.83 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.013 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.412 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 3.3 t80 -61.88 -52.07 65.61 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -56.41 -33.36 61.85 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.631 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.51 96.01 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.562 0.22 . . . . 0.0 111.165 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.402 ' HB3' HG12 ' A' ' 52' ' ' ILE . 1.1 m-20 -63.55 -36.68 84.58 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.423 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -63.06 -48.39 88.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 120.713 0.292 . . . . 0.0 110.789 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.1 mmp_? -64.96 -40.15 94.56 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.621 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -41.88 95.32 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.753 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.1 ttp -62.71 -46.61 87.3 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.556 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -36.21 74.15 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 38.5 m -60.57 -47.48 86.01 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.044 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.516 ' HB2' HD13 ' A' ' 43' ' ' ILE . 12.2 p30 -75.99 -31.55 59.02 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 121.096 -0.242 . . . . 0.0 111.07 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.28 -33.58 76.15 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.219 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.53 -37.29 75.35 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.534 0.207 . . . . 0.0 111.28 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -72.61 -39.71 67.07 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -78.24 -38.48 42.86 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.721 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -62.53 128.13 91.08 Favored Pre-proline 0 N--CA 1.465 0.295 0 CA-C-O 120.554 0.216 . . . . 0.0 111.073 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.461 ' O ' HG21 ' A' ' 89' ' ' VAL . 72.6 Cg_endo -76.68 135.5 16.14 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.602 2.201 . . . . 0.0 112.392 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 36.8 Cg_exo -57.39 128.16 28.4 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.741 2.294 . . . . 0.0 112.406 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.0 t0 65.53 71.7 0.43 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.154 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.74 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.8 t60 -141.65 148.21 38.78 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.077 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -56.6 -43.08 79.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.364 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.649 HG22 ' CD2' ' A' ' 86' ' ' HIS . 26.8 m -62.06 -35.74 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.13 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.74 HG23 ' HB3' ' A' ' 86' ' ' HIS . 30.0 t -66.4 -45.15 90.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.836 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.94 -39.04 80.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.814 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 24.8 mtt -63.05 -43.29 99.04 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.728 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.52 -48.61 80.25 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.5 mpp_? -54.62 -44.07 72.82 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.679 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -37.95 89.28 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.737 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.424 HD21 ' HB2' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -61.7 -37.26 83.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.972 179.571 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.03 -43.98 73.64 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.034 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.64 -46.59 89.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.34 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.53 -42.77 93.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.079 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.17 -50.32 66.39 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.913 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.55 -43.53 93.5 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.986 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -47.47 85.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.777 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? -67.86 -39.29 83.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.913 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.53 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 0.2 OUTLIER -65.3 -41.61 93.92 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.103 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.28 -32.91 74.81 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.284 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.4 tttp -69.72 -44.54 70.12 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.064 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 8.5 ptm -69.13 -33.38 73.36 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.089 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 12.9 mt -83.75 -41.55 17.5 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.273 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.052 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.684 0.278 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -61.67 -37.57 84.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.846 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.652 HD21 ' O ' ' A' ' 61' ' ' TYR . 3.7 mt -63.58 -46.91 83.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.065 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.19 -42.16 96.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.91 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.54 -44.35 96.57 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.586 ' HA ' HD12 ' A' ' 9' ' ' ILE . 34.5 m -58.96 -39.51 81.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.745 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 33.1 t -57.54 -41.13 80.33 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.055 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.12 94.46 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.578 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.586 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.2 mt -64.12 -46.25 94.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.719 0.295 . . . . 0.0 110.459 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.6 HD13 ' HG2' ' A' ' 53' ' ' LYS . 5.7 mt -62.75 -35.83 81.08 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.714 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -33.45 69.31 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.333 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 1.4 tt0 -58.55 -36.65 74.24 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.212 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.45 -36.98 72.11 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.431 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.67 12.62 22.6 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.478 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -96.71 17.86 15.6 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.724 0.297 . . . . 0.0 111.307 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 72.21 25.25 2.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.372 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 15.4 mtmt -118.69 -34.33 4.01 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.09 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.449 ' NE2' HG11 ' A' ' 98' ' ' VAL . 1.3 m-70 -132.42 21.72 4.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.001 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.8 -34.69 67.06 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.448 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.05 -40.28 68.45 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.744 0.306 . . . . 0.0 111.09 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -73.51 -34.21 65.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -111.62 28.69 8.51 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.483 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -68.33 -52.16 22.28 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.19 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.4 Cg_endo -85.5 11.15 3.44 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.554 2.17 . . . . 0.0 113.02 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -129.93 55.34 1.79 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.03 0.443 . . . . 0.0 110.825 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.86 -63.95 0.56 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.004 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 0.1 OUTLIER -65.74 143.41 98.55 Favored Pre-proline 0 CA--C 1.531 0.241 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.834 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 46.5 Cg_exo -57.31 156.66 24.65 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.91 2.407 . . . . 0.0 112.864 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.1 m -95.32 84.09 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.037 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.5 106.56 0.79 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.028 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.7 p -61.46 -38.42 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.621 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.3 -44.44 62.73 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.611 0.243 . . . . 0.0 111.483 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.73 43.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.3 mt -81.12 -21.54 39.79 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 57.19 7.37 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.424 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.423 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -126.34 64.04 1.25 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.04 0.448 . . . . 0.0 111.303 -179.83 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -67.63 -13.06 61.76 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.67 179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.23 -20.08 57.77 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.404 0.145 . . . . 0.0 111.237 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.511 ' CE1' HD13 ' A' ' 43' ' ' ILE . 1.0 OUTLIER -59.66 -35.65 74.85 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.557 0.218 . . . . 0.0 110.764 179.351 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.8 t -64.51 -38.68 91.85 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.947 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -67.18 -39.57 86.42 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.571 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.474 HD12 ' CE2' ' A' ' 81' ' ' TYR . 42.8 mt -74.13 -44.58 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.991 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.511 HD13 ' CE1' ' A' ' 39' ' ' TYR . 3.5 mp -137.82 137.01 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.656 0.265 . . . . 0.0 111.457 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -93.04 -25.45 17.94 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.804 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.91 79.82 2.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.71 153.77 38.74 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.707 2.271 . . . . 0.0 112.697 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.424 ' HB3' ' HG2' ' A' ' 74' ' ' MET . 5.6 ttm -165.64 158.87 15.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.362 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -144.28 163.95 32.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.565 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.6 ttm -54.98 -35.44 64.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.849 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 t -66.88 -40.94 87.93 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.747 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.7 m -66.83 -40.77 88.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.411 HD13 HG22 ' A' ' 71' ' ' VAL . 60.5 mt -66.81 -44.06 89.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 CA-C-O 120.78 0.324 . . . . 0.0 110.395 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HG2' HD13 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -66.76 -36.61 82.84 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.326 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -42.31 82.25 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.432 0.16 . . . . 0.0 111.432 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -62.72 -49.55 74.6 Favored 'General case' 0 N--CA 1.461 0.102 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.8 -34.75 76.46 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.585 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -59.44 -40.58 87.24 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.05 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.67 15.34 11.2 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.19 28.37 14.01 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.303 0.241 . . . . 0.0 111.636 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -75.45 -37.35 60.39 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.678 0.275 . . . . 0.0 110.84 179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.652 ' O ' HD21 ' A' ' 3' ' ' LEU . 7.1 m-85 -75.88 97.46 3.95 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.542 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -78.12 -31.85 50.11 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -126.55 142.59 51.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.816 0.341 . . . . 0.0 111.105 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.03 -19.36 64.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.844 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -47.98 80.85 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.677 0.275 . . . . 0.0 110.543 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -62.31 -38.26 88.75 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.777 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.465 ' HZ ' HD11 ' A' ' 10' ' ' LEU . 30.2 t80 -59.43 -53.85 53.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.88 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.78 87.74 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.711 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.2 74.72 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.571 0.224 . . . . 0.0 111.197 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.61 -39.93 64.2 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.312 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 67' ' ' PHE . 29.7 t -63.67 -48.41 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.683 0.278 . . . . 0.0 110.646 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -64.95 -39.1 92.98 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.755 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.81 -46.07 83.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.671 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.424 ' HG2' ' HB3' ' A' ' 47' ' ' MET . 4.8 tpp -65.49 -41.73 92.93 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.353 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -55.9 -44.96 78.73 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 110.752 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.6 t -62.2 -40.69 96.9 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.733 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.418 ' HB3' HG12 ' A' ' 43' ' ' ILE . 80.6 m-20 -68.03 -46.04 72.29 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.059 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.23 -35.48 79.03 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.465 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.38 -33.46 67.85 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.883 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.468 ' HD3' HG23 ' A' ' 42' ' ' ILE . 5.4 tttp -64.87 -36.74 85.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.584 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.474 ' CE2' HD12 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -80.93 -37.41 29.59 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.162 179.524 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.451 ' HB3' HG22 ' A' ' 89' ' ' VAL . 21.9 m120 -61.14 111.16 3.78 Favored Pre-proline 0 N--CA 1.469 0.486 0 CA-C-O 120.488 0.185 . . . . 0.0 111.076 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -61.46 163.81 16.95 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.859 2.373 . . . . 0.0 112.505 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.37 151.14 65.43 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.644 2.229 . . . . 0.0 112.401 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 53.22 49.29 20.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.408 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.717 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.9 t-80 -116.25 141.31 48.32 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.828 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -41.18 75.71 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.977 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 14.1 m -59.68 -32.79 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.578 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.717 HG23 ' HB3' ' A' ' 86' ' ' HIS . 32.9 t -65.71 -44.45 93.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.702 0.287 . . . . 0.0 110.574 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.32 93.87 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.876 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 11.8 mtt -61.28 -42.95 99.51 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.959 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.64 -44.66 81.5 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.269 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.68 -47.04 87.13 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -65.85 -40.22 91.5 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.2 mt -63.69 -38.79 92.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.962 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -70.16 -41.51 73.71 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.782 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -61.36 -46.86 88.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.143 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.449 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.3 p -66.06 -43.05 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.012 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -63.68 -50.14 70.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.722 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.9 -43.21 94.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.981 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -47.86 84.15 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.635 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -43.02 87.07 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.682 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.402 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.1 OUTLIER -59.64 -41.92 91.58 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.064 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.03 -37.08 80.95 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.907 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -67.07 -44.78 79.23 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.402 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 7.4 ptm -69.53 -33.46 72.83 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.256 179.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 19.1 mt -81.37 -42.1 20.97 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.356 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.406 179.834 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.762 0.315 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -66.62 -35.14 79.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.877 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.478 HD21 ' O ' ' A' ' 61' ' ' TYR . 11.1 mt -61.03 -44.48 97.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.78 179.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -35.21 70.85 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.116 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -39.3 84.33 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.653 0.264 . . . . 0.0 110.83 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.3 m -63.1 -37.74 88.41 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.34 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.1 p -57.39 -33.72 68.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.642 -0.253 . . . . 0.0 111.129 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.44 -43.05 97.77 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.325 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 48.9 mt -64.03 -42.45 95.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.915 0.388 . . . . 0.0 110.498 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.2 mt -63.74 -35.65 81.28 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.698 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -30.8 67.19 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.748 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.61 -36.72 74.48 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.296 0.093 . . . . 0.0 111.173 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -37.63 76.29 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.651 0.262 . . . . 0.0 110.492 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.08 6.45 35.93 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.47 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.486 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -91.04 13.67 16.14 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.566 0.222 . . . . 0.0 111.515 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 72.64 23.44 3.01 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.474 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.9 mtmm -115.33 -33.69 5.22 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.945 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.454 ' O ' ' HB3' ' A' ' 22' ' ' ALA . 3.0 m-70 -126.27 20.07 7.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.131 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.14 -33.98 61.6 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.62 67.52 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.333 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.401 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 6.8 m-85 -83.5 -32.66 25.82 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.381 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 18' ' ' HIS . . . -104.45 24.06 12.25 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -56.79 13.08 Favored Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.788 -0.187 . . . . 0.0 110.87 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -78.17 -4.17 14.08 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.536 2.158 . . . . 0.0 113.167 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -113.76 45.12 1.5 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.734 0.302 . . . . 0.0 110.998 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.79 -56.84 1.19 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.947 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 3.0 pttp -77.37 130.85 73.29 Favored Pre-proline 0 C--O 1.232 0.175 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.905 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 36.7 Cg_exo -60.52 -177.56 0.17 Allowed 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.858 2.372 . . . . 0.0 112.637 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 29' ' ' VAL . 29.4 m -123.93 77.09 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.062 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.716 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -56.21 106.29 0.26 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.728 179.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 36' ' ' LEU . 11.4 p -59.28 -40.11 80.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.672 -179.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -72.36 -46.8 53.8 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.716 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.25 -47.66 55.8 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.4 mt -81.59 -21.33 38.45 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.74 63.82 2.76 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.373 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -114.18 70.07 0.72 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.76 0.314 . . . . 0.0 111.132 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 16.9 m170 -65.62 -12.83 56.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.417 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.87 -19.96 21.16 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.534 0.207 . . . . 0.0 111.186 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -38.34 87.0 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.102 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -31.59 72.83 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.001 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -78.43 -47.2 18.02 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.753 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.2 mt -69.88 -38.76 76.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.321 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.534 HG23 HD22 ' A' ' 77' ' ' ASN . 32.2 mm -124.85 128.28 73.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.496 -179.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -34.96 19.78 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.289 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -128.14 77.28 77.0 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-O 120.796 0.331 . . . . 0.0 111.004 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.83 128.45 15.06 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.779 2.319 . . . . 0.0 112.562 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 44.5 mtp -145.66 139.5 26.63 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.251 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -123.71 171.05 9.89 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.189 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 mtm -57.77 -43.11 85.27 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.198 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.404 ' HB3' ' HG3' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -62.0 -39.65 92.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.788 179.594 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.2 m -64.36 -44.46 91.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.646 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.419 HG23 ' OH ' ' A' ' 61' ' ' TYR . 15.2 mt -65.32 -44.31 94.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.433 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.87 73.58 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.2 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.5 p -57.48 -41.4 80.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.124 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -60.59 -49.63 76.75 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.02 -34.57 76.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.361 178.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.26 -37.18 86.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.997 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.55 15.29 9.65 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 62.45 28.44 16.8 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -76.99 -36.95 56.05 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.647 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.478 ' O ' HD21 ' A' ' 3' ' ' LEU . 28.9 m-85 -79.42 100.62 7.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.893 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 ttt-85 -64.91 -31.62 72.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -159.54 -177.44 6.4 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.931 0.396 . . . . 0.0 111.357 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.627 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -71.29 -12.67 61.57 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.788 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -47.37 83.64 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.671 0.272 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -73.5 -37.64 65.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.717 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.521 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.9 t80 -61.35 -53.04 61.8 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.031 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.94 -33.29 78.15 Favored Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.663 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.61 91.26 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.623 0.249 . . . . 0.0 111.108 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.34 -33.9 70.03 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.364 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.9 t -63.38 -48.47 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.623 0.249 . . . . 0.0 110.906 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.3 mtt180 -61.12 -36.81 80.71 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.847 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.67 -44.68 96.49 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.764 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.2 ttm -63.68 -46.75 84.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -58.38 -43.9 88.69 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.153 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.2 t -60.55 -43.25 97.42 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.041 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.534 HD22 HG23 ' A' ' 43' ' ' ILE . 6.2 m120 -73.47 -46.72 46.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.117 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -34.0 72.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.238 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -57.12 -35.87 69.99 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.014 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -66.5 -41.97 88.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.846 179.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -76.06 -31.26 58.7 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.297 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -91.9 102.59 6.38 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.257 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 89' ' ' VAL . 55.2 Cg_endo -69.12 133.4 26.64 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.617 2.211 . . . . 0.0 112.24 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -57.52 165.38 6.05 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.725 2.283 . . . . 0.0 112.674 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.36 31.22 8.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.02 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.472 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.9 OUTLIER -127.5 142.6 51.35 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.943 -179.817 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -56.73 -37.55 71.14 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.101 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.2 p -61.8 -40.22 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.389 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.599 HG21 ' O ' ' A' ' 83' ' ' PRO . 24.0 t -67.49 -39.95 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.82 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.28 -34.34 66.35 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.81 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -47.43 83.66 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.406 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.83 -44.73 96.26 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -42.83 87.88 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.509 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.401 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 2.8 tttp -66.36 -41.91 88.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.585 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.54 -36.46 84.3 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -46.95 64.18 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.883 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -46.68 89.31 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.9 p -62.61 -43.0 98.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.51 0.195 . . . . 0.0 110.775 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -49.22 70.86 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.401 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -41.29 94.12 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.957 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.0 mtm -61.23 -47.76 84.61 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -43.82 81.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.631 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.627 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 0.7 OUTLIER -59.27 -50.98 71.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.805 179.536 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.01 -37.99 89.4 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.1 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.9 mtpt -69.48 -41.35 76.27 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.738 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.93 75.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.211 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.51 -41.69 60.23 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.725 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.108 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.789 0.328 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -60.9 -36.86 80.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.848 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.91 -43.72 91.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.93 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -67.7 -40.66 84.3 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -38.16 88.55 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.085 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.9 m -60.21 -38.93 84.84 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.935 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -60.87 -37.0 80.65 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.019 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.3 -36.92 90.92 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.54 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.431 HG23 ' CD ' ' A' ' 102' ' ' ARG . 54.4 mt -64.13 -45.91 95.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 179.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.635 HD22 ' HE3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -62.67 -35.35 79.39 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.839 179.225 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -57.62 -32.55 67.34 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.496 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.477 ' CG ' ' HD2' ' A' ' 17' ' ' LYS . 5.6 tt0 -60.32 -36.66 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.386 0.136 . . . . 0.0 110.954 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.52 ' HE1' HD22 ' A' ' 95' ' ' LEU . 4.8 mtt -59.27 -37.0 76.54 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.93 4.79 37.94 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -90.01 12.92 16.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 77.96 24.09 0.72 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.858 0.463 . . . . 0.0 111.43 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HD2' ' CG ' ' A' ' 12' ' ' GLU . 54.0 mttp -113.79 -32.7 6.04 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.827 179.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.414 ' NE2' HG11 ' A' ' 98' ' ' VAL . 0.4 OUTLIER -137.76 25.81 2.8 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.878 179.226 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.68 -40.26 23.08 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.204 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.21 81.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.237 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -77.71 -33.38 53.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.394 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -112.06 25.99 11.03 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.464 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -69.37 -56.6 8.15 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 116.929 -0.123 . . . . 0.0 110.938 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 86.4 Cg_endo -81.82 -22.96 4.98 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.473 2.115 . . . . 0.0 112.987 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.12 35.52 1.73 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.639 0.257 . . . . 0.0 111.567 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.53 -38.42 6.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.829 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.5 mmtt -74.86 156.14 86.5 Favored Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.359 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.8 -172.32 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.921 2.414 . . . . 0.0 112.682 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.854 HG21 ' CE2' ' A' ' 39' ' ' TYR . 30.8 m -120.57 68.82 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 121.12 0.486 . . . . 0.0 111.612 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.473 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . 2.0 m-20 -62.85 108.4 1.18 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.977 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 36' ' ' LEU . 9.7 p -60.84 -40.75 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.534 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.19 -44.97 62.18 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.473 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . . . -71.51 -48.87 46.09 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.4 mt -81.09 -21.67 39.78 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.52 61.78 3.73 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.447 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.624 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -133.45 78.65 1.79 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.935 0.398 . . . . 0.0 111.244 -179.884 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -7.66 46.1 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.867 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.22 -19.92 57.93 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.439 0.161 . . . . 0.0 111.284 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.854 ' CE2' HG21 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -59.89 -44.72 94.08 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.853 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 22.4 t -61.21 -39.46 90.32 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.933 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.94 -35.29 80.18 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.729 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.555 HG22 HG13 ' A' ' 43' ' ' ILE . 17.4 mt -80.71 -49.65 18.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.168 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.887 HD12 ' CE2' ' A' ' 81' ' ' TYR . 26.5 mt -147.75 132.89 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.1 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.7 pttt -86.18 -20.08 29.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.753 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.53 ' H ' HG22 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -107.46 86.03 2.54 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.044 -179.751 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.2 143.35 39.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.769 2.313 . . . . 0.0 112.691 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -151.69 122.9 7.71 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.114 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -130.99 162.75 29.08 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.146 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.5 mtm -55.78 -40.85 73.24 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.37 -41.76 98.82 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -64.08 -40.94 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.986 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.411 HG23 ' OH ' ' A' ' 61' ' ' TYR . 12.4 mt -70.58 -45.15 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.635 ' HE3' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -66.39 -38.39 87.41 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.026 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.6 t -57.32 -41.34 79.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.844 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -60.49 -48.36 82.09 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 16.3 tp -64.26 -34.46 78.16 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.48 -39.56 94.79 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.311 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.22 15.21 9.28 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.5 27.14 16.78 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -75.5 -34.09 60.81 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.724 0.297 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.484 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 5.2 m-85 -71.06 104.65 3.08 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.581 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -28.69 66.63 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.34 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -159.71 167.94 27.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.769 0.319 . . . . 0.0 111.286 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.4 63.36 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.515 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -62.78 -42.68 99.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.657 0.265 . . . . 0.0 110.558 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -70.85 -33.18 70.39 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.817 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.484 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 15.3 t80 -62.48 -48.34 80.03 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.89 -32.91 81.37 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.622 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.66 -44.2 96.71 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.613 0.244 . . . . 0.0 111.152 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.76 -33.46 75.72 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.2 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.27 -46.64 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.723 0.297 . . . . 0.0 110.575 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -63.35 -39.51 94.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.714 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.1 tt -70.67 -43.33 69.33 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.794 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 9.0 tmm? -60.42 -44.69 95.5 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.012 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 4.2 m-85 -59.15 -40.66 86.24 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.984 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.4 m -62.33 -44.6 96.12 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -71.43 -40.34 70.49 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.903 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -38.0 84.97 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.035 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.84 -40.11 95.82 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.054 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.5 ttpt -75.14 -36.11 61.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.865 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.887 ' CE2' HD12 ' A' ' 43' ' ' ILE . 3.8 m-85 -69.07 -35.3 76.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.503 ' HB3' HG22 ' A' ' 89' ' ' VAL . 8.5 m120 -82.01 136.84 46.86 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-O 120.63 0.253 . . . . 0.0 110.909 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.453 ' O ' HG21 ' A' ' 89' ' ' VAL . 72.5 Cg_endo -76.22 131.21 12.71 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.711 2.274 . . . . 0.0 112.368 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -57.27 147.43 76.79 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.604 2.202 . . . . 0.0 112.545 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 63.22 46.43 4.56 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.375 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.637 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-80 -128.02 148.28 50.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -44.01 80.54 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.469 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.7 p -58.85 -35.19 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.49 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.637 HG23 ' HB3' ' A' ' 86' ' ' HIS . 21.7 t -61.0 -43.67 96.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.902 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.35 76.0 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.916 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.23 88.83 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.773 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.8 -42.0 97.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.131 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.519 ' HD2' HG12 ' A' ' 89' ' ' VAL . 11.1 mtt180 -59.6 -43.96 93.56 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.687 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -61.51 -42.07 98.25 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.882 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.52 HD22 ' HE1' ' A' ' 13' ' ' MET . 87.3 mt -63.6 -30.92 71.97 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.082 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.02 -42.39 73.03 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.938 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -60.71 -46.83 88.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.065 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.414 HG11 ' NE2' ' A' ' 18' ' ' HIS . 10.1 p -66.79 -43.0 90.09 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.002 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -50.98 66.81 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.881 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -41.96 79.11 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.81 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -48.16 76.85 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.029 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.431 ' CD ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.84 -44.13 81.88 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.259 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.44 -49.34 69.55 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.802 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.36 -42.48 91.67 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -66.5 -42.22 87.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.919 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.87 -44.44 77.08 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.064 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.57 -40.1 61.85 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.647 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.008 -179.725 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 120.74 0.305 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -65.87 -39.48 90.74 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.754 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.28 -46.83 87.04 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.199 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.3 -38.01 89.5 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.838 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.27 -46.37 89.09 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.994 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -60.92 -39.42 89.33 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.4 m -56.03 -38.53 70.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.09 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.43 -43.25 97.6 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.624 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.8 mt -65.81 -44.87 92.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 120.748 0.308 . . . . 0.0 110.384 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.584 HD23 ' HZ ' ' A' ' 99' ' ' PHE . 50.3 mt -63.85 -35.91 82.18 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.63 179.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.79 -28.34 65.88 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.419 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 1.7 tt0 -58.34 -36.6 73.67 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.519 0.2 . . . . 0.0 110.935 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.455 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.4 tpp -57.96 -37.16 73.66 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.567 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.76 16.53 23.52 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.415 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.455 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -102.46 12.13 36.95 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.563 0.221 . . . . 0.0 111.533 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.8 tptt 71.42 25.93 3.36 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.377 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.409 ' CD ' ' HG2' ' A' ' 12' ' ' GLU . 12.7 mttm -113.34 -33.43 5.94 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.304 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.447 ' CD2' ' HB2' ' A' ' 21' ' ' TYR . 2.4 t60 -143.55 29.61 1.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.832 0.349 . . . . 0.0 110.745 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -78.38 -38.1 42.58 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.123 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.49 92.84 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.998 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 18' ' ' HIS . 10.6 m-85 -72.61 -33.55 66.75 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.146 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.53 17.22 23.35 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.734 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.15 -54.25 3.48 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.316 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.64 -5.52 16.12 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.3 2.0 . . . . 0.0 113.107 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.12 40.92 3.63 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.81 0.338 . . . . 0.0 111.047 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.42 -47.85 4.54 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.014 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -80.19 155.84 74.41 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.064 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.51 -173.7 0.73 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.716 2.278 . . . . 0.0 112.647 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 29' ' ' VAL . 31.2 m -111.39 84.64 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 121.131 0.491 . . . . 0.0 111.37 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -63.34 105.05 0.68 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.081 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG23 ' C ' ' A' ' 36' ' ' LEU . 12.3 p -61.9 -37.22 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.733 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -72.13 -45.75 59.3 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.574 0.226 . . . . 0.0 111.416 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.04 -47.84 48.8 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -80.84 -21.57 40.66 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.62 60.28 5.12 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.424 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.3 OUTLIER -127.66 66.85 1.32 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 111.325 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -63.59 -18.09 63.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.489 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -76.21 -19.08 58.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.588 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -57.63 -41.41 81.29 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.466 0.174 . . . . 0.0 111.058 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 t -63.55 -34.71 78.41 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.635 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.38 -42.93 71.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.834 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 22.0 mt -73.77 -45.42 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.28 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 25.3 mm -121.2 119.84 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 120.674 0.274 . . . . 0.0 111.341 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -70.89 -34.3 71.43 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.49 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -129.77 77.91 76.09 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-O 120.75 0.309 . . . . 0.0 111.066 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.49 129.14 16.34 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.753 2.302 . . . . 0.0 112.5 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 73.9 mtp -132.54 155.6 48.34 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.499 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -140.1 167.32 22.41 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.303 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.0 tpp -56.38 -41.89 76.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.891 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -39.24 92.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.665 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.0 -45.08 87.05 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.811 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 27.3 mt -69.62 -45.02 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.153 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.8 mttp -64.64 -34.48 78.38 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.982 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.5 t -57.54 -40.25 78.42 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.082 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -61.38 -48.95 78.89 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.277 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -62.85 -36.01 81.86 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.474 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -60.15 -39.85 87.78 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.228 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.01 15.2 8.98 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 60.74 27.54 17.3 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -76.58 -35.47 58.15 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.595 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -73.68 105.07 4.83 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.75 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -79.56 -28.34 41.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.327 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -149.59 163.61 37.39 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.849 0.357 . . . . 0.0 111.598 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.44 -18.08 63.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.778 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -62.79 -43.03 99.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.624 0.25 . . . . 0.0 110.533 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -69.95 -37.09 75.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.83 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.609 ' O ' HG23 ' A' ' 71' ' ' VAL . 26.4 t80 -65.69 -53.04 46.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.11 -37.59 80.83 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.617 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.54 -42.81 93.18 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.671 0.272 . . . . 0.0 111.006 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.3 -38.99 71.75 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.222 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 67' ' ' PHE . 41.2 t -62.54 -48.6 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.146 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.016 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -64.09 -37.87 89.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.646 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 tt -65.41 -48.49 72.64 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.638 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.1 tmm? -64.44 -42.83 95.77 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.083 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -57.14 -42.8 81.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.032 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t -63.38 -43.66 96.98 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.738 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -69.96 -41.53 74.37 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.949 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.38 -39.71 84.22 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.216 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -59.55 -34.43 72.65 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.141 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -65.69 -46.88 77.36 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -74.85 -40.9 60.74 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.142 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.526 ' HB3' HG22 ' A' ' 89' ' ' VAL . 24.7 m-20 -61.08 110.78 3.3 Favored Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.107 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.434 ' O ' HG21 ' A' ' 89' ' ' VAL . 57.7 Cg_endo -70.9 123.82 10.07 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.64 2.226 . . . . 0.0 112.223 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.64 161.37 1.32 Allowed 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.952 2.435 . . . . 0.0 113.005 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 61.06 42.21 12.82 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.74 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.715 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.7 OUTLIER -134.09 147.88 50.94 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.271 -179.392 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -58.35 -41.78 85.46 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.131 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.525 HG22 ' CD2' ' A' ' 86' ' ' HIS . 27.0 m -60.55 -36.66 71.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.634 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.715 HG23 ' HB3' ' A' ' 86' ' ' HIS . 17.5 t -65.3 -47.47 87.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.68 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.61 91.53 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.967 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.8 mtp -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.034 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.01 -50.43 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.9 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.95 -40.44 89.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.748 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.97 -41.81 97.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.791 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.76 -34.65 77.67 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.008 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.98 -43.37 71.61 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.905 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -61.53 -46.8 88.4 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.281 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -64.87 -42.87 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.861 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.584 ' HZ ' HD23 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -64.19 -50.59 67.49 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.849 179.443 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.26 -45.52 83.93 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.058 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -47.88 84.33 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.042 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -67.49 -44.14 79.23 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.133 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.404 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 1.2 t80 -63.2 -42.74 99.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.836 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.57 74.34 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.066 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.3 tttm -71.65 -44.57 64.08 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.139 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 9.8 ptm -69.38 -35.78 76.16 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.76 -41.34 19.3 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.574 0.226 . . . . 0.0 111.35 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.979 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.643 0.259 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -64.92 -37.04 86.32 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.139 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.02 -40.65 98.38 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.925 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -35.23 66.41 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.821 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.54 -49.81 56.72 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.345 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.429 ' HA ' HD12 ' A' ' 9' ' ' ILE . 27.2 p -61.64 -37.1 82.76 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.781 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -56.57 -37.34 70.44 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.945 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.8 89.1 Favored Glycine 0 C--N 1.336 0.541 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.116 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 6' ' ' CYS . 5.7 mt -64.14 -39.04 84.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.102 0 CA-C-O 120.917 0.389 . . . . 0.0 110.077 179.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -35.81 80.43 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.248 178.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -29.96 65.91 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.401 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.403 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -58.51 -36.69 74.2 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.47 0.176 . . . . 0.0 111.075 179.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -36.87 71.68 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.76 11.63 19.43 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -101.16 21.86 13.28 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.684 0.278 . . . . 0.0 111.525 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.8 mttm 65.77 21.63 11.52 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.453 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -111.36 -30.11 7.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.948 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.407 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -145.33 30.16 1.14 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.683 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.03 -41.27 17.41 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.228 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.39 -40.36 85.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.933 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -73.79 -31.6 63.35 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.202 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.488 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -109.83 24.64 12.77 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.545 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 28.2 t-105 -69.5 -51.49 16.44 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.964 -0.107 . . . . 0.0 111.211 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.2 Cg_endo -80.21 -19.3 9.36 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.423 2.082 . . . . 0.0 113.095 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -105.55 37.41 2.23 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.833 0.349 . . . . 0.0 111.131 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -107.57 -46.25 3.87 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.901 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -81.67 152.43 69.52 Favored Pre-proline 0 CA--C 1.531 0.235 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.101 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -63.43 179.3 0.94 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.926 2.418 . . . . 0.0 112.917 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.5 m -94.64 66.19 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.974 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.15 100.08 0.05 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.967 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.2 p -62.7 -35.12 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.708 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -71.71 -47.49 53.63 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.588 0.232 . . . . 0.0 111.22 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.46 -47.01 52.25 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -179.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -81.19 -21.44 39.64 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.23 60.54 6.26 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.474 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.06 71.43 1.26 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.908 0.385 . . . . 0.0 111.422 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -65.39 -22.26 66.77 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.17 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.09 -19.92 58.14 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.447 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -57.62 -42.63 83.68 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.675 0.274 . . . . 0.0 110.912 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.1 t -60.2 -37.14 79.35 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.932 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.14 -39.61 78.74 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.99 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.8 mt -72.57 -51.7 27.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.174 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.434 HD13 ' HB2' ' A' ' 77' ' ' ASN . 13.8 mt -129.05 118.18 45.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.058 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.0 pttt -77.68 -30.38 51.93 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.405 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -112.45 77.43 2.29 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-O 120.807 0.337 . . . . 0.0 110.856 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.27 153.57 61.72 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.755 2.303 . . . . 0.0 112.656 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.27 142.95 16.21 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.189 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -139.43 167.25 22.5 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 tpp -57.55 -42.19 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.928 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.2 t -64.24 -38.25 90.39 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.544 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -65.66 -43.99 87.69 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.73 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.577 HG23 ' OH ' ' A' ' 61' ' ' TYR . 22.9 mt -70.17 -45.15 76.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.076 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -34.8 78.29 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.928 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.6 t -57.47 -40.86 79.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.934 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.2 mtmt -60.39 -46.91 88.31 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.795 0.331 . . . . 0.0 110.251 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.04 -34.39 77.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.548 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.69 -38.18 90.15 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.311 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.69 15.19 10.03 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.089 0.404 . . . . 0.0 112.089 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 58.07 27.26 14.65 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.595 0.236 . . . . 0.0 111.543 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -75.54 -32.58 60.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.648 0.261 . . . . 0.0 110.556 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.577 ' OH ' HG23 ' A' ' 52' ' ' ILE . 8.4 m-85 -71.41 104.85 3.34 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.967 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.0 mtt180 -65.68 -30.77 71.51 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.062 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -156.87 172.36 18.79 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.738 0.304 . . . . 0.0 111.24 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.11 -16.7 63.15 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.615 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.87 -43.52 98.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.653 0.263 . . . . 0.0 110.417 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -69.69 -40.65 76.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.967 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.492 ' O ' HG23 ' A' ' 71' ' ' VAL . 68.2 t80 -59.36 -53.45 58.1 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.778 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -58.75 -31.51 67.81 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.737 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.69 91.1 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.636 0.218 . . . . 0.0 111.387 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.11 -31.76 72.81 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.192 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 67' ' ' PHE . 43.7 t -60.72 -48.32 89.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.684 0.278 . . . . 0.0 110.577 179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.0 mtt-85 -64.33 -38.27 90.46 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.701 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.6 tp -66.46 -46.35 76.67 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.668 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.453 ' HB2' HD11 ' A' ' 52' ' ' ILE . 5.7 tmm? -59.19 -46.35 88.65 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -64.85 -35.26 80.54 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.918 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -60.16 -47.32 86.42 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.15 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.434 ' HB2' HD13 ' A' ' 43' ' ' ILE . 16.3 p30 -75.36 -30.5 60.23 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.896 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.73 -41.44 95.31 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.75 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.26 -33.87 75.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.946 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.9 tttp -66.56 -47.13 73.77 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.918 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.75 -38.83 76.94 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.571 ' HB3' HG22 ' A' ' 89' ' ' VAL . 51.4 m-20 -72.2 127.29 90.55 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.768 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.506 ' O ' HG21 ' A' ' 89' ' ' VAL . 37.8 Cg_endo -65.95 161.01 41.46 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.678 2.252 . . . . 0.0 112.417 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.79 127.58 13.96 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.54 2.16 . . . . 0.0 112.559 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.1 t70 60.13 67.91 0.82 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.917 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.475 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.7 t-80 -133.89 165.11 25.77 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.314 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -62.66 -44.15 96.99 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.309 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -62.42 -31.35 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.571 HG22 ' HB3' ' A' ' 82' ' ' ASN . 39.1 t -64.89 -42.32 94.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.883 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.69 -35.2 75.69 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.005 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -62.55 -45.97 90.52 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.951 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.44 -46.32 89.08 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.935 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.3 -44.99 95.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.744 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.11 -37.42 87.38 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.785 179.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -68.35 -38.46 81.5 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.983 179.745 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.22 -42.47 75.67 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.088 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.6 -46.81 88.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.2 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.97 -42.99 89.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.235 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -64.83 -51.46 62.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.931 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.67 -43.6 93.91 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.91 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mtt -60.24 -47.11 87.35 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.975 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.16 77.65 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.99 -44.46 95.98 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.999 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.81 -32.5 73.83 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.089 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -44.18 66.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.081 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 12.3 ptm -69.3 -34.24 74.4 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.259 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 2.8 mt -84.08 -42.29 16.26 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.992 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.809 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 120.729 0.3 . . . . 0.0 111.345 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -64.73 -42.72 95.0 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mt -59.96 -41.7 92.49 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.918 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -35.68 81.4 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.046 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.8 t -62.42 -37.62 86.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.131 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.39 -39.09 78.73 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.842 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -60.06 -38.72 83.67 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.091 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.65 -43.18 97.95 Favored Glycine 0 C--N 1.337 0.586 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.501 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.6 mt -64.4 -46.88 91.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-O 120.656 0.265 . . . . 0.0 110.536 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.7 -35.87 81.09 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.876 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.7 mtpp -58.49 -29.78 66.5 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.231 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.479 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -58.58 -36.43 73.96 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.348 0.118 . . . . 0.0 110.87 179.312 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.85 -37.34 73.72 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.468 179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.97 8.68 30.62 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 111.744 0.276 . . . . 0.0 111.744 179.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.479 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -94.28 15.02 18.49 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.68 29.05 2.64 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.174 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.4 mttm -123.74 -31.24 3.47 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.745 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -140.69 28.63 1.96 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.799 0.333 . . . . 0.0 111.244 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.74 -37.94 64.9 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.777 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.87 -36.39 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -73.65 -34.51 64.98 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.576 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -100.81 14.42 31.77 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.19 -52.88 4.01 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -64.06 -12.06 30.46 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 122.612 2.208 . . . . 0.0 113.567 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -141.7 52.46 1.52 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 111.203 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -99.02 -45.41 5.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.77 179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.69 160.86 25.29 Favored Pre-proline 0 N--CA 1.464 0.255 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.218 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.79 177.06 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.28 2.653 . . . . 0.0 113.158 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.0 m -93.5 83.85 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.139 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.539 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 17.7 m-20 -61.16 93.13 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.524 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.509 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.8 p -61.1 -39.26 81.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.818 -179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -72.3 -46.62 54.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.6 0.238 . . . . 0.0 111.578 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.539 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.96 -48.79 42.54 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.2 mt -80.86 -21.33 40.81 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.14 58.13 6.37 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.431 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.509 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -128.7 60.09 1.53 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.964 0.411 . . . . 0.0 111.442 -179.758 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -61.84 -20.99 64.27 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.525 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.24 -20.26 57.58 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.344 0.116 . . . . 0.0 111.27 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.452 ' CE2' HG13 ' A' ' 43' ' ' ILE . 10.3 t80 -56.71 -42.42 79.13 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.253 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 44.5 t -66.18 -32.33 73.7 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.943 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.24 -34.35 61.41 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.06 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.1 mt -82.99 -41.84 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.478 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.452 HG13 ' CE2' ' A' ' 39' ' ' TYR . 36.2 mm -96.41 127.58 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.747 0.308 . . . . 0.0 111.523 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.8 -36.88 25.21 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.259 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.56 88.47 53.36 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.07 116.08 4.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.736 2.29 . . . . 0.0 112.386 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.9 mtp -140.54 149.6 42.64 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.294 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -147.73 171.52 15.53 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.227 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.514 ' HA ' HD12 ' A' ' 52' ' ' ILE . 6.4 mtt -56.04 -42.32 76.36 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.054 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t -61.93 -40.01 94.02 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.643 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 32.7 m -66.31 -42.53 88.15 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.951 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.514 HD12 ' HA ' ' A' ' 49' ' ' MET . 11.6 mt -65.21 -45.08 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.703 0.287 . . . . 0.0 110.78 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.2 -36.69 84.97 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.04 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.8 p -57.35 -38.49 74.23 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.208 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -62.92 -48.67 77.93 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.5 tp -62.6 -34.48 77.11 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.529 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.61 -38.91 92.93 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.298 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.45 15.2 8.21 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 59.79 27.49 16.8 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.704 0.288 . . . . 0.0 111.661 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.45 -34.36 58.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.725 0.297 . . . . 0.0 110.467 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.451 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 8.3 m-85 -79.2 92.72 5.12 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.587 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.5 mtm-85 -60.37 -34.96 74.61 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.091 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -145.28 165.64 27.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.931 0.396 . . . . 0.0 111.375 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.05 -22.28 65.87 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.836 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.91 -41.32 99.41 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.599 0.238 . . . . 0.0 110.515 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.49 -35.34 78.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.935 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.473 ' O ' HG23 ' A' ' 71' ' ' VAL . 24.5 t80 -59.91 -47.51 85.49 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.429 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.46 -32.29 82.55 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.796 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.05 -36.87 78.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.6 0.238 . . . . 0.0 111.414 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.59 -33.21 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.177 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.7 t -64.82 -48.71 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.919 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.07 -36.07 82.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.658 179.521 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.29 -47.33 77.02 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.3 ttp -60.38 -46.87 88.41 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.343 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -63.81 -35.2 79.84 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.707 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 m -59.7 -47.24 86.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.23 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -75.39 -36.75 60.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 121.133 -0.227 . . . . 0.0 110.682 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -59.3 -40.87 87.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.814 179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -57.66 -35.64 70.83 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.358 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -66.41 -39.57 89.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.941 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.421 ' HB2' HD11 ' A' ' 43' ' ' ILE . 3.0 t80 -81.07 -38.75 26.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.248 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.733 ' HB3' HG22 ' A' ' 89' ' ' VAL . 27.0 m-20 -57.51 110.6 2.6 Favored Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.113 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.449 ' O ' HG21 ' A' ' 89' ' ' VAL . 46.2 Cg_endo -68.59 143.66 57.65 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.666 2.244 . . . . 0.0 112.432 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 51.4 Cg_exo -54.09 132.55 50.78 Favored 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 122.69 2.26 . . . . 0.0 112.438 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 62.27 68.03 0.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.013 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.804 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.8 t-160 -134.82 154.66 51.53 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.111 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -44.75 81.63 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.248 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 m -65.46 -31.49 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.493 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.804 HG23 ' HB3' ' A' ' 86' ' ' HIS . 31.2 t -67.42 -47.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.74 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.43 91.05 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.857 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 7.7 mtt -64.99 -36.77 85.46 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.074 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.25 -48.22 79.4 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.44 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -48.0 83.61 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.744 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -62.07 -38.94 90.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.842 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -37.13 85.62 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.172 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -69.54 -46.79 65.67 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.847 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.78 -47.01 88.25 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.271 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.22 -43.3 97.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.316 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -65.25 -51.03 63.46 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.425 0.155 . . . . 0.0 110.948 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.25 -43.89 88.05 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.793 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.9 mtp -61.99 -46.92 87.11 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.054 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.65 -44.41 77.96 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.134 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.403 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.5 OUTLIER -64.25 -41.85 96.78 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.554 -0.293 . . . . 0.0 110.877 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -36.15 83.07 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.038 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -67.91 -44.84 76.01 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.8 -0.182 . . . . 0.0 111.173 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.403 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 13.7 ptm -69.4 -35.36 75.7 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.813 -0.176 . . . . 0.0 111.401 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.62 -42.37 20.13 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.225 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.008 179.911 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.65 0.262 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -63.26 -44.98 93.6 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.783 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.86 -44.51 94.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.945 179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -63.83 -38.09 89.8 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.88 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -46.04 80.88 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.004 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.476 ' HA ' HD12 ' A' ' 9' ' ' ILE . 22.6 m -60.44 -39.0 85.93 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.972 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.8 m -58.59 -34.51 71.18 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.079 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -47.29 91.57 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.427 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.481 HD11 ' SD ' ' A' ' 106' ' ' MET . 3.6 mt -64.06 -44.58 97.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.788 0.327 . . . . 0.0 110.259 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.776 HD11 ' HG3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -62.16 -35.79 79.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.73 179.186 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.4 -27.66 64.48 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.471 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -58.44 -36.39 73.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.922 -0.126 . . . . 0.0 111.089 179.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtm -56.94 -40.41 76.35 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.9 11.94 33.05 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.8 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.54 11.42 28.75 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.02 26.34 3.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.202 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 79.4 mttt -116.1 -33.51 5.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.994 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.418 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 0.6 OUTLIER -130.65 23.15 5.05 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.187 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.31 -30.29 60.31 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.227 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.72 -39.51 91.26 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.737 0.304 . . . . 0.0 111.02 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.448 ' CZ ' ' HD3' ' A' ' 94' ' ' LYS . 8.7 m-85 -81.61 -33.55 31.43 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.249 179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -97.02 15.58 22.01 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.44 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -65.76 -54.79 26.7 Favored Pre-proline 0 CA--C 1.531 0.245 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.9 Cg_endo -76.84 -20.5 13.28 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.337 2.024 . . . . 0.0 112.984 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -98.28 22.45 9.59 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.391 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.53 -43.48 39.06 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.717 0.294 . . . . 0.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.435 ' HB3' ' HD2' ' A' ' 28' ' ' PRO . 26.3 mmtt -102.42 158.28 32.07 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.126 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 27' ' ' LYS . 74.0 Cg_endo -75.01 -176.34 2.83 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.805 2.337 . . . . 0.0 112.754 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.7 m -93.87 80.27 1.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-O 121.133 0.492 . . . . 0.0 111.241 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.517 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -60.31 103.86 0.27 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.142 -179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.423 ' HA ' HD12 ' A' ' 36' ' ' LEU . 14.5 p -61.52 -37.32 77.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.13 -46.42 56.63 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.488 0.185 . . . . 0.0 111.442 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.517 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.69 -46.91 57.32 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.504 HD13 HD21 ' A' ' 36' ' ' LEU . 15.5 mt -80.85 -21.45 40.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.62 47.88 73.08 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.425 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.504 HD21 HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -120.83 69.41 0.88 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.044 0.45 . . . . 0.0 111.222 -179.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -65.23 -18.21 65.12 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.445 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -76.3 -19.95 57.77 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.872 -0.149 . . . . 0.0 111.314 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.5 -40.31 82.49 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.615 0.245 . . . . 0.0 110.843 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.6 t -65.58 -40.13 92.39 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.788 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -65.09 -36.14 83.36 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.861 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.4 mt -77.59 -47.83 25.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 77' ' ' ASN . 29.9 mm -99.86 103.47 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.306 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -59.66 -33.31 71.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.398 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.76 89.41 52.45 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.603 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.46 124.32 11.89 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.749 2.299 . . . . 0.0 112.72 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.9 tpt -153.47 131.26 11.61 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.922 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -129.62 167.94 17.19 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.948 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.3 -42.65 77.91 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.091 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.8 t -62.06 -39.94 94.11 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.838 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.5 m -64.12 -44.43 92.24 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.864 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.451 HG23 ' OH ' ' A' ' 61' ' ' TYR . 53.7 mt -69.86 -44.92 78.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.136 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.688 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.776 ' HG3' HD11 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -62.52 -35.23 78.76 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.076 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.2 t -57.56 -40.42 78.87 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.974 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -60.3 -49.41 77.7 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.469 HD22 HD13 ' A' ' 10' ' ' LEU . 6.5 tp -67.04 -33.26 75.14 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.503 178.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -63.14 -41.36 99.27 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.388 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.36 15.16 12.7 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.35 27.21 16.77 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -76.29 -33.67 59.09 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.706 0.289 . . . . 0.0 110.516 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.451 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.0 m-85 -70.48 110.28 5.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.76 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -81.27 -25.88 36.21 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.192 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -147.12 157.83 43.74 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.815 0.34 . . . . 0.0 111.599 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.01 -23.17 64.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.276 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -62.6 -39.05 92.52 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.521 0.201 . . . . 0.0 110.485 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -69.47 -35.32 75.5 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.72 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 71' ' ' VAL . 5.1 t80 -67.53 -53.63 26.89 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.844 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.79 -36.94 81.96 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 121.156 -0.545 . . . . 0.0 112.806 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -58.94 -37.83 77.62 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.507 0.194 . . . . 0.0 111.219 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -76.72 -33.48 58.16 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.47 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 67' ' ' PHE . 26.7 t -64.9 -48.31 84.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 120.645 0.259 . . . . 0.0 110.715 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -64.62 -34.54 78.52 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.786 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.3 -44.56 71.51 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.508 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.3 -46.25 89.07 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.782 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -63.58 -35.93 82.13 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.439 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.2 p -61.25 -45.82 92.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.049 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.477 ' HB2' HD12 ' A' ' 43' ' ' ILE . 1.6 p-10 -75.92 -38.05 58.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.874 179.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.7 t -61.24 -41.23 96.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.374 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.55 -29.14 69.82 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.284 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 53.0 tttp -72.73 -36.47 67.76 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.696 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -78.84 -40.78 31.75 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.226 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.461 ' HB3' HG22 ' A' ' 89' ' ' VAL . 90.0 m-20 -70.23 112.15 11.71 Favored Pre-proline 0 N--CA 1.466 0.33 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.131 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.515 ' O ' HG21 ' A' ' 89' ' ' VAL . 22.0 Cg_exo -65.4 156.9 60.88 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.765 2.31 . . . . 0.0 112.219 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -69.15 149.48 70.85 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.42 2.08 . . . . 0.0 112.373 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 t0 60.93 43.31 11.81 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.317 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.781 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.5 t-80 -116.63 146.92 42.37 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.001 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -56.38 -43.52 79.32 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.257 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.6 m -62.13 -33.44 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.781 HG23 ' HB3' ' A' ' 86' ' ' HIS . 29.9 t -61.65 -42.44 94.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.764 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -39.38 81.37 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.78 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . 0.441 ' HA ' ' CE2' ' A' ' 21' ' ' TYR . 0.7 OUTLIER -69.53 -37.26 77.04 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.907 179.48 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.45 -50.74 57.91 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.394 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -62.63 -38.78 91.59 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.54 0.209 . . . . 0.0 110.689 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.448 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 2.9 tttp -64.42 -41.74 96.43 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.756 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -68.42 -37.94 80.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.952 179.456 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -68.29 -41.47 80.93 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.974 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -60.75 -46.75 89.26 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.27 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.6 p -67.02 -42.83 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.04 -50.54 68.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.959 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.67 -46.98 86.0 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.601 0.239 . . . . 0.0 110.887 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -45.75 91.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.935 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -68.02 -43.94 77.63 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.957 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -59.28 -52.46 65.56 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.982 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.27 -40.02 84.76 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.309 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.38 -42.29 75.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.679 0.276 . . . . 0.0 110.787 179.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.481 ' SD ' HD11 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.11 -44.67 71.95 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.966 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -42.13 66.12 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.986 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.535 -0.745 . . . . 0.0 110.703 179.69 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.747 0.308 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -64.95 -42.8 94.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.213 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.5 mt -62.81 -42.45 99.72 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.719 0.295 . . . . 0.0 110.853 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -69.26 -36.67 77.36 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.965 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -50.23 64.41 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.534 ' HA ' HD12 ' A' ' 9' ' ' ILE . 24.0 p -64.25 -39.37 93.81 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.167 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.17 -40.51 85.84 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.927 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.47 -44.2 96.89 Favored Glycine 0 C--N 1.336 0.537 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.303 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.534 HD12 ' HA ' ' A' ' 6' ' ' CYS . 8.2 mt -64.32 -44.41 97.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-O 120.817 0.341 . . . . 0.0 110.235 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.659 HD21 ' CZ ' ' A' ' 67' ' ' PHE . 10.0 mp -62.44 -35.83 80.5 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.554 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.9 tttt -58.45 -29.28 66.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.323 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 43.1 tt0 -58.62 -36.54 74.22 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.562 0.22 . . . . 0.0 110.645 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.554 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 6.6 ttm -57.66 -37.12 72.84 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.528 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 7.07 31.51 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.705 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.454 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -94.09 15.36 17.27 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.592 0.234 . . . . 0.0 111.559 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? 69.05 25.61 5.83 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.45 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HB2' ' CG ' ' A' ' 12' ' ' GLU . 32.3 mttm -115.37 -29.58 6.51 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.228 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.404 ' CD2' ' HG ' ' A' ' 95' ' ' LEU . 1.4 t60 -144.45 33.4 1.18 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.798 0.332 . . . . 0.0 110.796 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -89.21 -38.96 13.87 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.184 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.92 -42.66 97.34 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.2 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -76.8 -29.28 55.94 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.326 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.9 16.46 25.88 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.487 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -71.21 -55.83 5.92 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-O 120.346 0.117 . . . . 0.0 110.987 179.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.487 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 12.3 Cg_exo -69.74 -25.1 29.02 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.565 2.177 . . . . 0.0 112.636 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -102.23 34.57 2.68 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.287 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -106.1 -45.99 4.19 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.89 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -88.97 156.94 49.11 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.325 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -62.38 -171.71 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.154 2.569 . . . . 0.0 112.842 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -116.5 87.35 1.03 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.569 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -57.92 102.49 0.1 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.267 -179.803 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.408 HG23 HD12 ' A' ' 36' ' ' LEU . 12.8 p -63.75 -36.68 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.643 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.93 -47.31 53.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.614 0.245 . . . . 0.0 111.498 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.569 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -72.43 -47.16 51.25 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.15 -21.51 39.71 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 -179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.17 59.99 5.92 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.615 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.418 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -124.93 72.23 1.22 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.962 0.41 . . . . 0.0 111.342 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -69.88 -12.73 61.84 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.458 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.15 -19.41 58.5 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.4 0.143 . . . . 0.0 111.25 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -34.8 69.59 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.534 0.207 . . . . 0.0 111.019 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.5 t -66.44 -39.97 89.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.72 0.295 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.23 -37.55 69.14 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.229 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.9 mt -79.15 -52.97 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.321 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.634 HD12 ' HB3' ' A' ' 77' ' ' ASN . 28.3 mm -106.99 126.96 62.98 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.245 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 43.0 pttt -79.43 -39.13 33.06 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.278 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -116.37 94.25 42.14 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.725 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.79 105.13 0.89 Allowed 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.665 2.244 . . . . 0.0 112.598 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 39.3 mtp -139.12 140.63 38.0 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.967 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.53 170.66 12.93 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.128 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -32.29 69.23 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.475 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -42.33 99.05 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.727 0.299 . . . . 0.0 110.936 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.6 m -64.4 -39.93 94.8 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.861 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.465 HG22 ' CE2' ' A' ' 67' ' ' PHE . 22.1 mt -70.49 -44.74 76.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.862 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -39.61 92.99 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.113 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.3 p -57.48 -39.07 75.61 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.177 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -49.81 75.73 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.9 tp -63.23 -34.1 76.94 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.458 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -63.97 -38.25 90.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.147 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.411 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . . . -90.18 15.26 10.63 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 63.84 26.92 14.45 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.411 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 28.0 mt-10 -79.54 -35.84 39.31 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.764 0.316 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 2.4 m-85 -76.21 101.3 5.35 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.685 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -62.19 -30.19 70.9 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.38 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -155.23 164.86 38.23 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.866 0.365 . . . . 0.0 111.427 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.2 -15.41 63.38 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.458 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.77 -44.29 96.56 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.662 0.268 . . . . 0.0 110.323 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -71.08 -35.38 71.84 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.821 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.659 ' CZ ' HD21 ' A' ' 10' ' ' LEU . 34.1 t80 -61.4 -48.1 82.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.412 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.53 -32.14 80.17 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.832 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.3 96.1 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.739 0.27 . . . . 0.0 111.055 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -69.59 -37.48 76.95 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.033 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 67' ' ' PHE . 42.2 t -59.86 -47.74 90.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.908 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -63.01 -35.64 80.89 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.706 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.6 tt -72.2 -43.03 65.12 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.734 0.302 . . . . 0.0 110.808 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ttp -66.87 -45.09 79.21 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.473 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.81 -41.43 97.88 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.8 p -61.93 -44.04 97.6 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.533 0.206 . . . . 0.0 110.792 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.634 ' HB3' HD12 ' A' ' 43' ' ' ILE . 14.5 m120 -73.72 -39.58 64.19 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.383 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 m -60.93 -37.82 83.64 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.02 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -59.81 -35.35 74.51 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.982 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -63.23 -42.78 99.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.66 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -70.19 -35.02 73.66 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.189 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.828 ' HB3' HG22 ' A' ' 89' ' ' VAL . 34.0 m-20 -59.42 110.94 3.13 Favored Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.975 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.633 ' O ' HG21 ' A' ' 89' ' ' VAL . 32.1 Cg_exo -60.59 160.38 24.51 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.924 2.416 . . . . 0.0 112.689 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.41 120.72 7.66 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.53 2.153 . . . . 0.0 112.244 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.2 t70 62.52 71.43 0.53 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.658 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.721 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.7 t60 -137.51 152.67 49.75 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.358 -179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -56.33 -44.31 79.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.291 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.557 HG22 ' CD2' ' A' ' 86' ' ' HIS . 19.0 m -60.3 -32.33 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.399 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.828 HG22 ' HB3' ' A' ' 82' ' ' ASN . 23.2 t -66.07 -43.22 92.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.784 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.06 -37.81 86.39 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.978 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -46.36 90.72 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.706 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.32 -39.76 94.12 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.931 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -48.8 71.0 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.606 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 35.5 tttp -62.47 -41.51 98.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.087 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.404 ' HG ' ' CD2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -67.83 -40.76 83.74 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.055 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 17.2 tm0? -70.04 -43.72 70.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.983 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -60.74 -46.76 89.21 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.314 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.4 p -66.95 -42.6 89.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.625 -0.262 . . . . 0.0 110.813 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -63.78 -49.77 71.65 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.84 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -46.18 88.72 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.562 0.22 . . . . 0.0 110.967 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 6.2 mtp -60.35 -45.98 91.53 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.983 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -67.98 -43.83 78.07 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.122 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.414 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.1 OUTLIER -59.88 -47.87 83.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.043 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.94 -34.08 77.18 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.114 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.92 -44.57 63.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.42 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.414 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 7.2 ptm -69.24 -33.47 73.32 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.04 -42.35 14.93 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-O 120.573 0.225 . . . . 0.0 110.846 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.13 -0.938 . . . . 0.0 110.902 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 120.675 0.274 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -64.33 -39.36 93.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.92 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.97 -45.67 91.91 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.967 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -35.08 77.26 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.946 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 t -62.49 -35.84 80.62 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.231 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 54.7 m -58.05 -42.14 84.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.73 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.86 -34.98 78.49 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.017 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.93 -46.69 93.69 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.656 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mt -64.39 -47.37 89.77 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-O 120.772 0.32 . . . . 0.0 110.581 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mt -63.85 -35.75 81.64 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 ttpt -58.59 -30.3 67.1 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.616 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.488 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.5 -36.62 74.06 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.448 0.166 . . . . 0.0 110.983 179.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.471 ' HE3' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -57.92 -38.68 76.32 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.653 0.263 . . . . 0.0 110.452 179.18 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.07 3.84 39.1 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.716 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.488 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.04 16.41 12.84 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.582 0.229 . . . . 0.0 111.538 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.3 mttp 70.77 25.8 3.93 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.427 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 6.9 mttm -114.28 -32.78 5.86 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.03 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.462 ' NE2' HG11 ' A' ' 98' ' ' VAL . 4.9 m-70 -131.42 18.78 4.82 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.075 179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.81 78.84 Favored 'General case' 0 CA--C 1.524 -0.055 0 CA-C-O 120.593 0.235 . . . . 0.0 110.938 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.41 -34.77 74.97 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.298 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -86.67 -31.0 21.3 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.699 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.9 17.2 24.56 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.42 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -66.08 -53.13 35.16 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.355 0.121 . . . . 0.0 110.72 179.588 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.42 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 75.2 Cg_endo -88.68 18.72 1.43 Allowed 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.732 2.288 . . . . 0.0 113.088 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -144.13 62.78 1.34 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.934 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -127.89 -55.06 1.3 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.857 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -79.41 157.24 75.37 Favored Pre-proline 0 CA--C 1.532 0.259 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.025 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.98 -177.22 1.23 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.754 2.303 . . . . 0.0 112.732 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.62 HG11 ' CZ ' ' A' ' 39' ' ' TYR . 15.9 m -90.23 78.55 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.113 0.482 . . . . 0.0 111.418 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.579 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -60.17 97.69 0.05 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.867 179.809 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 36' ' ' LEU . 11.6 p -61.51 -39.66 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.766 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -72.25 -46.78 54.53 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.579 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -72.3 -48.2 44.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.5 -21.46 38.64 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.5 57.88 6.34 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.323 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.547 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -129.4 76.44 1.72 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.983 0.421 . . . . 0.0 111.406 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -75.88 -7.17 53.87 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.51 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.3 -19.87 57.86 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.369 0.128 . . . . 0.0 111.22 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.62 ' CZ ' HG11 ' A' ' 29' ' ' VAL . 0.2 OUTLIER -57.8 -42.0 83.31 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.899 179.654 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.3 t -63.28 -35.69 81.19 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.908 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -73.24 -42.15 62.91 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.169 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 20.1 mt -80.79 -62.38 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.766 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 22.5 mm -97.23 125.54 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.822 0.344 . . . . 0.0 111.543 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -83.58 -34.95 25.05 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.442 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -136.81 72.88 54.77 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-O 120.808 0.337 . . . . 0.0 111.085 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.58 160.31 44.42 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.814 2.343 . . . . 0.0 112.423 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.7 mtp -150.18 163.22 38.8 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.319 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.43 172.24 14.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.032 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.43 ' HA ' HD12 ' A' ' 52' ' ' ILE . 16.9 ttm -54.48 -37.44 65.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.74 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.0 t -63.46 -44.25 95.02 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.82 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.2 m -64.32 -38.59 91.59 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.095 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.43 HD12 ' HA ' ' A' ' 49' ' ' MET . 15.9 mt -69.74 -44.89 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-O 120.749 0.309 . . . . 0.0 110.908 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.18 -36.32 81.52 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.277 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.2 p -57.62 -43.11 84.52 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.8 -49.07 77.79 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.41 ' HB2' ' HD2' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -66.18 -33.18 75.18 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.688 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -60.27 -41.44 93.31 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.468 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.03 15.17 12.08 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.04 27.35 16.26 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.62 0.248 . . . . 0.0 111.362 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -76.6 -33.67 58.42 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.667 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.41 ' HD2' ' HB2' ' A' ' 56' ' ' LEU . 2.6 m-85 -66.11 103.17 0.92 Allowed 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.943 0.402 . . . . 0.0 110.622 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -32.04 63.58 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.025 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.0 p30 -166.92 -178.98 4.47 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.251 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.52 -15.62 61.78 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.254 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -62.84 -46.0 89.96 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.669 0.271 . . . . 0.0 110.342 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.23 -36.03 74.26 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.775 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.452 ' O ' HG23 ' A' ' 71' ' ' VAL . 19.0 t80 -59.93 -53.65 55.38 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.963 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.38 -32.15 81.91 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.615 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.38 99.41 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.199 0.2 . . . . 0.0 111.397 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.11 -35.24 73.98 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.447 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 67' ' ' PHE . 46.0 t -63.44 -48.09 88.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 120.743 0.306 . . . . 0.0 110.259 179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -64.76 -39.78 94.2 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.651 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.95 -48.67 79.35 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.759 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.0 ttp -61.65 -41.7 97.88 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.136 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -41.21 81.64 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.944 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.6 m -62.79 -43.71 98.07 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.833 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.8 m-20 -71.29 -42.29 68.87 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.98 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t -59.73 -36.66 77.03 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.028 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -60.3 -37.47 80.65 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.144 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -70.56 -39.37 73.99 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.012 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -75.07 -33.21 61.65 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.424 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.649 ' HB3' HG22 ' A' ' 89' ' ' VAL . 2.9 m-20 -88.07 111.6 43.89 Favored Pre-proline 0 N--CA 1.464 0.269 0 CA-C-N 116.754 -0.203 . . . . 0.0 111.122 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 31.8 Cg_exo -58.42 142.41 97.83 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.852 2.368 . . . . 0.0 112.543 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 32.0 Cg_exo -58.53 151.84 59.27 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.914 2.41 . . . . 0.0 112.618 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t70 59.29 51.39 6.86 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.709 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-160 -128.92 145.91 51.09 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.96 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.6 -40.74 75.82 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.019 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.9 m -61.99 -36.1 72.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.313 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.709 HG23 ' HB3' ' A' ' 86' ' ' HIS . 28.2 t -65.87 -46.6 88.15 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.769 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.84 -36.91 82.58 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.015 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -61.26 -46.36 90.69 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.774 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.26 -46.58 82.93 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.976 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.9 mtp180 -59.89 -37.28 78.92 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.839 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -59.43 -42.2 91.35 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.725 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.471 HD22 ' HE3' ' A' ' 13' ' ' MET . 20.1 mt -71.02 -32.12 68.81 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.81 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -44.23 71.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.888 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -60.69 -46.67 89.49 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.241 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.462 HG11 ' NE2' ' A' ' 18' ' ' HIS . 8.6 p -66.03 -42.95 92.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.946 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -64.14 -50.3 68.77 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.849 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.58 -46.97 83.34 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.001 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -46.1 90.81 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.867 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -43.99 78.14 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.002 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.427 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -57.48 -46.35 83.8 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.98 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.37 -36.35 83.4 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.052 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.9 mmmp? -69.14 -44.81 71.6 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.129 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.427 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 8.0 ptm -69.4 -33.31 72.83 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.746 -0.207 . . . . 0.0 111.408 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.81 -42.7 16.17 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.478 0.18 . . . . 0.0 111.347 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.804 -0.617 . . . . 0.0 110.737 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.69 0.281 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -68.52 -40.13 80.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.958 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.415 HD21 ' O ' ' A' ' 61' ' ' TYR . 78.8 mt -58.97 -33.71 70.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.911 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -72.72 -34.72 67.28 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.88 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.25 -49.71 53.8 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.433 ' HA ' HD12 ' A' ' 9' ' ' ILE . 24.0 p -60.31 -36.81 78.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.929 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.9 t -54.56 -34.08 61.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.251 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.4 -46.7 93.48 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.425 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.433 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.4 mt -64.53 -43.64 96.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 120.875 0.369 . . . . 0.0 110.303 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 mp -62.95 -35.52 80.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.452 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -58.18 -28.07 64.43 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.569 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -58.77 -36.83 75.03 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.527 0.203 . . . . 0.0 110.789 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.423 ' HA ' ' HB2' ' A' ' 18' ' ' HIS . 1.2 mpp? -59.83 -37.58 79.6 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.46 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -98.71 0.71 45.14 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.626 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -90.09 10.75 23.1 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt 75.09 21.58 1.92 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.372 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -111.13 -35.09 6.0 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.04 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.483 ' NE2' HG11 ' A' ' 98' ' ' VAL . 11.1 m-70 -124.61 18.16 8.79 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.29 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.63 -37.21 56.72 Favored 'General case' 0 N--CA 1.46 0.063 0 CA-C-O 120.652 0.263 . . . . 0.0 110.956 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.93 -38.19 76.14 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.028 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 6.6 m-85 -77.5 -32.36 54.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.248 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.454 ' HB1' ' CD1' ' A' ' 26' ' ' TYR . . . -94.39 8.08 43.23 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.435 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.9 t90 -69.92 -51.55 14.72 Favored Pre-proline 0 CA--C 1.535 0.379 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.435 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 72.0 Cg_endo -76.39 2.13 7.63 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.308 2.005 . . . . 0.0 113.435 -179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -150.54 58.24 0.94 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.013 0.435 . . . . 0.0 111.011 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.454 ' CD1' ' HB1' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -112.25 -54.37 2.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.665 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.5 ptpt -72.02 153.27 92.8 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.47 -179.56 0.2 Allowed 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.894 2.396 . . . . 0.0 112.723 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.7 m -107.7 73.99 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.132 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -61.66 102.13 0.23 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.874 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.413 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.6 p -61.52 -35.62 68.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.636 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -71.79 -47.4 53.68 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.605 0.24 . . . . 0.0 111.307 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -46.38 54.97 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.2 mt -80.75 -21.28 41.22 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.82 58.57 8.13 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.466 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.414 HD13 ' HB2' ' A' ' 39' ' ' TYR . 0.4 OUTLIER -126.99 66.16 1.28 Allowed 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.934 0.397 . . . . 0.0 111.092 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -62.1 -21.17 64.77 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.354 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -76.46 -20.19 57.27 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.516 0.198 . . . . 0.0 111.29 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.452 ' CE1' HG13 ' A' ' 43' ' ' ILE . 1.1 t80 -59.05 -31.76 69.15 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 120.596 0.236 . . . . 0.0 110.786 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.4 t -60.15 -40.01 88.36 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.483 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -84.76 -37.95 20.22 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 121.262 -0.175 . . . . 0.0 111.2 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 12.2 mt -62.89 -33.42 60.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.019 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.452 HG13 ' CE1' ' A' ' 39' ' ' TYR . 40.0 mm -123.37 116.6 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.158 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -33.82 75.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.279 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -124.77 90.61 50.71 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.56 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -67.45 106.8 1.29 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.782 2.321 . . . . 0.0 112.452 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 27.0 mtp -146.46 144.7 29.84 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.298 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.74 172.09 13.45 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.606 ' HA ' HD12 ' A' ' 52' ' ' ILE . 0.4 OUTLIER -56.51 -43.28 79.6 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.01 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.3 t -61.99 -34.78 76.8 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.749 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 86.6 m -70.32 -41.74 72.88 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.702 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.606 HD12 ' HA ' ' A' ' 49' ' ' MET . 7.5 mt -66.64 -45.02 89.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.804 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.8 mtpp -67.59 -34.63 77.41 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.037 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.3 t -57.55 -42.0 82.09 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.973 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -60.72 -49.6 76.84 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.814 0.34 . . . . 0.0 110.176 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.564 HD22 ' HE2' ' A' ' 67' ' ' PHE . 14.1 tp -60.99 -35.9 78.04 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -59.86 -39.58 85.7 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.119 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.4 15.18 11.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.925 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.36 28.54 16.95 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.59 0.234 . . . . 0.0 111.562 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -74.66 -37.35 62.73 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.722 0.296 . . . . 0.0 110.508 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.519 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 7.7 m-85 -73.91 100.67 3.57 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.819 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -69.91 -32.37 70.64 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.005 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -145.78 159.87 42.57 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.021 0.439 . . . . 0.0 111.473 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.557 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -70.66 -14.5 62.49 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.192 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -62.96 -45.52 92.04 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 120.69 0.281 . . . . 0.0 110.6 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -71.46 -32.46 68.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.794 179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.564 ' HE2' HD22 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -55.2 -53.49 55.3 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.969 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -62.2 -31.3 78.55 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.68 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.77 -41.36 95.38 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.668 0.271 . . . . 0.0 111.069 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.9 -38.96 64.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.361 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 67' ' ' PHE . 26.8 t -64.31 -46.23 93.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-O 120.734 0.302 . . . . 0.0 110.83 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.1 mtt-85 -59.18 -33.39 70.88 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.103 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.1 -46.63 50.26 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.931 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.25 -42.26 90.71 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -63.8 -38.75 92.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.9 m -66.33 -38.99 88.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.019 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.437 ' ND2' HG23 ' A' ' 43' ' ' ILE . 3.7 m120 -70.9 -44.07 67.0 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.975 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.1 t -58.23 -34.12 70.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.101 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -56.66 -37.26 70.55 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.219 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -66.29 -47.77 72.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.205 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -72.46 -33.86 67.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.079 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.976 ' HB3' HG22 ' A' ' 89' ' ' VAL . 21.5 m-20 -65.39 114.01 13.83 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.132 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.638 ' O ' HG21 ' A' ' 89' ' ' VAL . 35.5 Cg_exo -58.43 167.59 4.76 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.902 2.401 . . . . 0.0 112.66 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.03 116.96 4.91 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.48 2.12 . . . . 0.0 112.334 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.4 t0 61.51 68.72 0.69 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.109 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.528 ' HB3' HG23 ' A' ' 89' ' ' VAL . 4.3 t-80 -125.77 158.96 33.62 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.04 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.15 -43.91 78.75 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.271 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.6 m -65.36 -34.34 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.301 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.976 HG22 ' HB3' ' A' ' 82' ' ' ASN . 28.4 t -63.93 -43.32 97.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.907 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.19 -36.98 73.89 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.978 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . 0.417 ' HG2' ' CD2' ' A' ' 21' ' ' TYR . 10.3 mtt -66.85 -36.99 83.59 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.1 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.66 65.56 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.69 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.51 78.0 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.213 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.434 ' HD2' ' CE2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.96 -40.48 93.51 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.89 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.0 mt -68.98 -31.66 70.67 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.003 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.39 -49.17 62.01 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.877 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.6 -46.45 90.2 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.414 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.483 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.6 p -64.45 -42.98 96.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.315 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -65.04 -50.47 66.1 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.536 0.208 . . . . 0.0 110.5 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.0 -42.66 90.59 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.103 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -47.81 84.02 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.992 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.25 -44.15 80.11 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.103 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.557 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 1.9 t80 -65.07 -42.25 94.35 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.861 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.13 76.61 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.189 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -70.03 -44.6 68.91 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.168 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.6 ptm -68.77 -33.33 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.324 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.0 -41.83 15.45 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.058 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.06 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.64 0.257 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -61.66 -36.15 80.01 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.766 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.48 -37.82 88.76 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.191 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.1 mttt -72.49 -42.0 65.37 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.81 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -49.18 76.11 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.209 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 19.3 p -62.35 -36.71 83.08 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.017 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.6 t -54.47 -34.79 62.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.958 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.64 -40.12 96.04 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 121.064 -0.588 . . . . 0.0 112.589 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 37.4 mt -64.14 -39.28 84.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.807 0.337 . . . . 0.0 110.437 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.518 HD13 ' CD2' ' A' ' 56' ' ' LEU . 0.5 OUTLIER -63.34 -35.48 80.54 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.643 179.114 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.2 -29.64 65.83 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.571 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG3' ' HD3' ' A' ' 17' ' ' LYS . 0.7 OUTLIER -58.63 -36.59 74.32 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.402 0.144 . . . . 0.0 111.049 179.459 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.451 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 3.2 mtt -58.89 -37.24 76.15 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.705 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -103.72 10.24 36.8 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.454 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.45 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -104.08 16.55 26.0 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.638 0.256 . . . . 0.0 111.534 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 66.61 28.54 9.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.26 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HD3' ' HG3' ' A' ' 12' ' ' GLU . 22.0 mttm -115.88 -35.78 4.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.129 179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.684 ' CD2' HD23 ' A' ' 95' ' ' LEU . 4.8 t60 -134.44 27.17 3.75 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.885 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.451 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -80.77 -32.13 35.61 Favored 'General case' 0 N--CA 1.461 0.081 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.29 94.09 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.208 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -83.24 -32.09 26.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.48 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -95.95 12.42 30.43 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.451 ' CB ' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -74.3 -53.72 3.55 Favored Pre-proline 0 CA--C 1.532 0.279 0 O-C-N 122.505 -0.122 . . . . 0.0 111.112 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.451 ' HD3' ' CB ' ' A' ' 23' ' ' TRP . 3.0 Cg_exo -74.51 -1.94 11.73 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.773 2.315 . . . . 0.0 113.222 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -133.4 50.89 2.18 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.989 0.423 . . . . 0.0 111.06 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -109.15 -47.52 3.41 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.781 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.6 156.06 56.23 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.247 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.66 -172.76 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.882 2.388 . . . . 0.0 112.74 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -111.91 76.47 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 121.112 0.482 . . . . 0.0 111.211 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.58 107.2 1.09 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.017 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 36' ' ' LEU . 9.5 p -62.31 -38.71 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.545 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.05 -45.58 60.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.587 0.232 . . . . 0.0 111.342 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.2 -48.24 52.72 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.065 0.395 . . . . 0.0 112.065 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.9 mt -81.54 -21.66 38.38 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.55 58.62 5.31 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.479 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -130.61 74.27 1.59 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 120.957 0.408 . . . . 0.0 111.227 -179.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -70.9 -8.06 50.22 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.367 -0.379 . . . . 0.0 112.013 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.33 -20.02 57.66 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 121.344 -0.142 . . . . 0.0 111.193 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.87 -43.66 98.1 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.937 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.3 -38.84 90.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.717 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.36 -36.6 84.67 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.695 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.405 HG22 HG13 ' A' ' 43' ' ' ILE . 13.2 mt -78.39 -52.83 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.234 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.405 HG13 HG22 ' A' ' 42' ' ' ILE . 3.2 mt -128.91 141.47 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.806 0.336 . . . . 0.0 111.503 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.53 -31.88 12.55 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.489 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -120.7 65.34 12.37 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 120.671 0.272 . . . . 0.0 111.414 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.06 164.08 30.0 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.853 2.369 . . . . 0.0 112.718 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 9.1 ttm -148.37 158.89 44.38 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.5 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -138.16 164.52 28.96 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.21 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -57.56 -40.41 78.84 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.822 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 t -62.66 -41.55 99.12 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.56 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 4.9 m -64.57 -42.32 95.71 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.972 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.559 HG23 ' OH ' ' A' ' 61' ' ' TYR . 15.5 mt -69.69 -45.08 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.967 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? -66.11 -34.21 77.54 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.22 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -57.5 -40.03 77.77 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.877 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.21 -48.22 82.65 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.518 ' CD2' HD13 ' A' ' 10' ' ' LEU . 13.5 tp -63.96 -35.18 79.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.729 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.92 -40.99 97.76 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.503 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.86 15.37 11.43 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 60.58 28.08 17.77 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.663 0.268 . . . . 0.0 111.401 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -74.51 -33.94 62.91 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.766 0.317 . . . . 0.0 110.528 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.559 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.2 m-85 -70.11 105.99 3.1 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.888 179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttm-85 -69.62 -29.0 66.4 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.245 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -156.37 164.42 38.3 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.9 0.381 . . . . 0.0 111.632 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.44 -23.0 64.56 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.242 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.87 -38.32 90.38 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.742 0.306 . . . . 0.0 110.482 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -70.3 -35.22 73.56 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.512 ' O ' HG23 ' A' ' 71' ' ' VAL . 16.4 t80 -59.42 -48.52 81.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.533 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.88 -33.0 81.65 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.464 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.61 -37.46 84.02 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.555 0.217 . . . . 0.0 111.435 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -76.43 -30.76 57.54 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.269 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 67' ' ' PHE . 39.3 t -66.3 -48.57 80.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 111.027 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -64.5 -34.68 78.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.945 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.6 tp -69.06 -46.98 66.47 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.765 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 ttp -59.6 -46.43 88.96 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.198 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.462 ' CZ ' ' HB2' ' A' ' 96' ' ' GLN . 4.5 m-85 -60.88 -39.79 90.56 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.183 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 24.7 t -59.51 -46.32 89.18 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.846 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -74.99 -41.68 59.04 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.784 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.4 m -60.97 -34.94 75.55 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.287 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -60.28 -35.03 74.6 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.653 0.263 . . . . 0.0 111.215 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -71.63 -35.85 70.55 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.85 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -82.82 -40.94 19.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.347 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.666 ' HB3' HG22 ' A' ' 89' ' ' VAL . 29.2 m-20 -69.45 116.59 44.27 Favored Pre-proline 0 N--CA 1.464 0.262 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.081 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.539 ' O ' HG21 ' A' ' 89' ' ' VAL . 50.7 Cg_exo -54.71 153.62 23.58 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.916 2.411 . . . . 0.0 112.576 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.03 136.83 28.01 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.565 2.177 . . . . 0.0 112.151 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 t70 58.19 61.24 2.37 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.03 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.689 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.4 t-80 -126.97 150.16 49.52 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.911 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -56.52 -44.12 80.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.326 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.3 p -60.71 -35.89 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.198 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.689 HG23 ' HB3' ' A' ' 86' ' ' HIS . 19.5 t -64.98 -45.74 93.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.779 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.83 78.69 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.802 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.7 mtp -61.46 -46.59 89.44 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.831 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.711 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -56.01 -50.17 71.63 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.934 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -58.87 -41.11 86.31 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -61.99 -42.02 98.69 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.996 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.711 HD12 ' HA ' ' A' ' 92' ' ' ALA . 5.5 mt -60.51 -41.5 94.48 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.838 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.08 -41.88 73.51 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.916 179.66 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.55 -46.67 89.31 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.252 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.407 HG11 ' CE1' ' A' ' 18' ' ' HIS . 11.1 p -66.69 -42.64 89.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.014 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -47.04 79.57 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.825 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.62 -46.35 90.6 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.625 0.25 . . . . 0.0 110.976 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -47.7 84.65 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.95 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.0 mmt180 -67.66 -38.77 84.25 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.451 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.2 OUTLIER -58.41 -50.71 72.72 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.009 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.13 -35.67 77.69 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.229 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.0 -44.8 62.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.396 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.451 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 2.0 ptm -69.26 -34.01 74.11 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.93 -41.64 15.73 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.6 0.238 . . . . 0.0 110.911 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 117.947 -1.025 . . . . 0.0 111.044 -179.812 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 120.705 0.288 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -57.02 -37.11 71.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt -61.24 -46.61 89.7 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.822 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -67.73 -34.48 76.93 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.825 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.65 -39.61 70.24 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.831 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 m -65.59 -39.05 91.16 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.54 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.55 -35.65 68.37 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.059 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.18 -47.58 90.38 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.109 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 32.4 mt -64.89 -44.25 96.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-O 120.788 0.328 . . . . 0.0 110.319 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.527 HD11 ' CZ ' ' A' ' 67' ' ' PHE . 2.8 mp -62.42 -35.79 80.35 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.737 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.1 mtmt -58.47 -28.19 65.1 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.375 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 33.3 tt0 -58.48 -36.63 74.04 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.841 -0.163 . . . . 0.0 110.967 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -57.46 -37.11 72.33 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.487 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -107.67 9.96 29.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.63 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.472 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -92.04 12.06 23.21 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.8 tttm 73.03 26.97 2.12 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.528 0.331 . . . . 0.0 111.284 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 25.7 mttt -120.8 -35.39 3.37 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.346 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.703 ' CD2' HD23 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -131.77 25.7 4.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.172 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.52 -34.48 31.2 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.068 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.45 -34.73 76.47 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.437 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -79.58 -32.57 42.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.381 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.14 15.29 28.75 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -61.83 4.8 Favored Pre-proline 0 CA--C 1.53 0.193 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -64.64 -19.76 64.94 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 122.258 1.972 . . . . 0.0 112.799 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.38 35.94 4.32 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.475 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 -40.95 10.21 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.011 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.6 mttp -89.87 163.44 32.38 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.288 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -81.16 -174.53 2.25 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.945 2.43 . . . . 0.0 112.758 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.0 m -113.83 75.14 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.091 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -58.6 103.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.055 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.552 HG23 ' C ' ' A' ' 36' ' ' LEU . 10.4 p -61.55 -39.19 82.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.633 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -72.05 -45.51 60.53 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.52 0.2 . . . . 0.0 111.536 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.95 -48.36 45.75 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 mt -81.21 -21.5 39.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.87 57.68 6.22 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.411 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.552 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -129.81 73.83 1.55 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.98 0.419 . . . . 0.0 111.21 -179.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -71.69 -8.92 57.09 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.715 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.6 -20.1 57.13 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-O 120.461 0.172 . . . . 0.0 111.388 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.483 ' CD2' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -61.57 -41.81 97.94 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.66 -0.246 . . . . 0.0 110.884 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -61.68 -39.18 90.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.736 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.05 -39.62 94.48 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.628 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.471 HD12 ' HA ' ' A' ' 39' ' ' TYR . 5.8 mt -74.81 -51.66 21.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.843 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.458 HD13 ' HB2' ' A' ' 77' ' ' ASN . 10.0 mt -130.35 112.24 22.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -11.79 60.63 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.822 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.448 ' H ' HG22 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -126.93 71.79 75.38 Favored Pre-proline 0 CA--C 1.534 0.341 0 CA-C-O 120.71 0.291 . . . . 0.0 111.047 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -61.0 145.48 99.06 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 122.897 2.398 . . . . 0.0 112.539 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.9 mmt -147.89 139.45 23.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.232 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -145.39 165.54 28.2 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.835 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.439 ' HA ' HD12 ' A' ' 52' ' ' ILE . 3.4 ttm -57.01 -36.56 70.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.646 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.0 t -66.35 -39.34 89.11 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.812 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 8.2 m -67.2 -40.11 86.45 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.982 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.561 HG23 ' OH ' ' A' ' 61' ' ' TYR . 13.3 mt -68.46 -45.19 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.99 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -66.09 -35.22 79.93 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.127 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.6 t -57.64 -42.98 84.51 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.967 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.38 -47.75 84.72 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.4 tp -62.59 -34.53 77.19 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.693 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.81 -41.31 99.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.295 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.81 15.29 11.51 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 59.91 28.45 17.96 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.689 0.28 . . . . 0.0 111.424 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -72.99 -34.1 66.23 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.517 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.561 ' OH ' HG23 ' A' ' 52' ' ' ILE . 5.8 m-85 -72.86 103.09 3.59 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.49 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 48.6 ttt180 -67.3 -29.76 69.43 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.226 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -155.65 178.1 10.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.812 0.339 . . . . 0.0 111.281 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.34 -25.25 62.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.62 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -42.07 99.62 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.774 0.321 . . . . 0.0 110.267 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -64.92 -37.67 88.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.802 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.527 ' CZ ' HD11 ' A' ' 10' ' ' LEU . 27.2 t80 -59.41 -51.86 68.07 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.806 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.22 -31.53 77.34 Favored Glycine 0 C--N 1.334 0.445 0 C-N-CA 121.049 -0.595 . . . . 0.0 112.696 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 72' ' ' ARG . . . -58.8 -39.39 80.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.611 0.243 . . . . 0.0 111.32 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -76.68 -33.11 58.26 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.169 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 67' ' ' PHE . 40.7 t -67.44 -46.75 82.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.604 0.24 . . . . 0.0 110.789 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 69' ' ' ALA . 15.5 ptt180 -59.09 -36.99 76.07 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.85 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.15 -42.09 66.36 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.629 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 14.5 tmm? -62.17 -46.77 87.46 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.129 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -66.39 -35.57 80.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.053 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.6 t -59.78 -47.63 84.91 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.117 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.458 ' HB2' HD13 ' A' ' 43' ' ' ILE . 15.9 p30 -75.82 -30.74 59.1 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.584 0.231 . . . . 0.0 110.868 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.91 -41.88 97.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.822 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -61.19 -33.59 73.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.409 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -71.16 -44.47 65.46 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.06 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -75.25 -37.28 61.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.311 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.78 ' HB3' HG22 ' A' ' 89' ' ' VAL . 9.1 m-20 -58.28 115.11 10.26 Favored Pre-proline 0 N--CA 1.465 0.282 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.34 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.489 ' O ' HG21 ' A' ' 89' ' ' VAL . 34.4 Cg_exo -58.45 163.15 10.97 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.971 2.447 . . . . 0.0 112.629 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -73.91 126.44 10.66 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.638 2.226 . . . . 0.0 112.45 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.0 t0 58.47 62.42 1.97 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.157 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.471 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.5 t-80 -123.06 154.09 39.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -56.81 -43.8 81.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.245 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 22.1 m -59.7 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.324 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.78 HG22 ' HB3' ' A' ' 82' ' ' ASN . 22.5 t -62.77 -44.77 99.76 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.922 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.55 -41.83 95.31 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.823 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.9 mtt -65.05 -43.61 91.72 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.606 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.497 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -60.91 -48.18 83.02 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.021 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.65 -46.98 77.4 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.0 tttp -63.02 -38.06 89.67 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.842 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.703 HD23 ' CD2' ' A' ' 18' ' ' HIS . 12.6 mt -66.91 -36.27 81.88 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.086 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 7.5 tm0? -70.06 -47.85 60.27 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.074 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -61.3 -46.84 88.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.496 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.401 HG13 ' N ' ' A' ' 99' ' ' PHE . 14.1 p -63.36 -43.31 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.234 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.401 ' N ' HG13 ' A' ' 98' ' ' VAL . 2.2 t80 -65.32 -51.01 63.46 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-O 120.591 0.234 . . . . 0.0 110.803 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.48 -42.77 92.82 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.928 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.89 85.88 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.873 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -65.66 -44.18 87.11 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.982 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -43.47 95.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.757 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.8 -44.22 90.64 Favored 'General case' 0 N--CA 1.46 0.065 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -64.72 -40.91 96.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.603 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -44.4 72.04 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.827 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -72.23 -42.34 65.82 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.206 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.492 -0.766 . . . . 0.0 110.839 179.848 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.628 0.251 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -61.42 -40.88 96.03 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.797 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -38.61 89.0 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.994 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -71.67 -36.1 70.53 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.806 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -50.19 61.61 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.238 -179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.556 ' HA ' HD12 ' A' ' 9' ' ' ILE . 29.7 p -62.25 -37.79 86.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.046 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.8 m -62.69 -36.42 82.88 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.915 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.11 -41.93 98.27 Favored Glycine 0 C--N 1.336 0.559 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.35 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.556 HD12 ' HA ' ' A' ' 6' ' ' CYS . 11.2 mt -63.97 -46.34 94.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-O 120.663 0.268 . . . . 0.0 110.657 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 5.9 mt -62.17 -36.25 81.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.86 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.6 mttp -58.84 -31.7 68.74 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.33 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 3.3 tt0 -58.1 -36.59 73.1 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.365 0.126 . . . . 0.0 111.016 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 24.0 mtt -56.87 -37.1 70.87 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.185 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.33 16.61 19.91 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.575 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -95.97 15.48 20.45 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.689 0.28 . . . . 0.0 111.53 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.31 24.03 1.13 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.595 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 48.8 mttp -116.91 -32.78 4.97 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.838 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.86 18.51 3.51 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.01 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.48 -35.71 81.37 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.494 0.183 . . . . 0.0 111.494 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.54 70.42 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.114 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.443 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 10.2 m-85 -99.71 -24.84 14.58 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.594 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.55 -16.17 35.37 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.623 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 12.2 t90 -53.45 -51.83 72.2 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-O 120.298 0.094 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.623 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 90.3 Cg_endo -82.74 -19.4 6.11 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.476 2.117 . . . . 0.0 113.189 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -97.42 36.16 1.52 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.622 0.249 . . . . 0.0 111.59 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.51 -58.15 0.99 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.858 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -66.35 138.46 95.86 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.966 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.01 160.72 32.62 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.787 2.325 . . . . 0.0 112.507 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 29' ' ' VAL . 8.7 m -88.91 87.49 2.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 121.024 0.44 . . . . 0.0 110.745 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.69 104.34 0.22 Allowed 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.111 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.498 HG23 ' C ' ' A' ' 36' ' ' LEU . 12.9 p -59.73 -36.6 66.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.72 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -72.06 -47.03 54.57 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.509 0.189 . . . . 0.0 111.509 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.29 49.95 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.77 -21.51 40.96 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.87 57.19 8.1 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.387 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.498 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -126.58 65.28 1.26 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.062 0.458 . . . . 0.0 111.179 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -64.94 -19.71 66.09 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -76.15 -19.46 58.45 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.195 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.447 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -59.48 -41.83 90.71 Favored 'General case' 0 CA--C 1.526 0.056 0 CA-C-O 120.496 0.189 . . . . 0.0 110.786 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.51 -32.72 74.25 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.653 0.263 . . . . 0.0 110.948 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 m-20 -75.81 -45.77 34.19 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.03 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.617 HD12 ' CE2' ' A' ' 81' ' ' TYR . 49.3 mt -74.56 -34.45 35.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.461 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.447 HG13 ' CE2' ' A' ' 39' ' ' TYR . 33.0 mm -103.64 107.99 23.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 120.631 0.253 . . . . 0.0 111.16 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttt -68.52 -34.05 75.2 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.468 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -130.41 88.7 46.6 Favored Pre-proline 0 CA--C 1.532 0.253 0 CA-C-O 120.704 0.287 . . . . 0.0 110.945 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.72 140.72 39.68 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.738 2.292 . . . . 0.0 112.632 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttm -160.61 153.62 21.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.018 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -147.56 162.0 39.98 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.5 tpp -54.54 -38.94 67.18 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.0 t -62.51 -39.71 94.39 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.449 0.166 . . . . 0.0 111.108 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.7 m -70.97 -40.62 71.82 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.982 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.4 HG22 ' CE2' ' A' ' 67' ' ' PHE . 15.4 mt -69.7 -44.83 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.546 0.213 . . . . 0.0 110.785 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.14 -35.1 79.18 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.671 -0.241 . . . . 0.0 111.1 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -57.42 -44.01 84.26 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.784 -0.189 . . . . 0.0 111.082 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.63 -49.76 76.24 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.844 0.354 . . . . 0.0 110.109 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.6 tp -63.09 -34.29 77.28 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.716 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.37 -39.74 88.3 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.193 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.0 15.41 10.11 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 62.77 27.18 15.97 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.303 0.241 . . . . 0.0 111.585 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -75.95 -34.43 59.83 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.84 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -78.21 99.35 6.2 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.938 0.399 . . . . 0.0 110.588 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -58.0 -32.58 68.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.119 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -146.55 168.21 21.81 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 111.057 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.18 -16.9 61.42 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.363 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -62.95 -45.92 90.19 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.634 0.254 . . . . 0.0 110.334 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.41 -38.93 85.38 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.53 ' O ' HG23 ' A' ' 71' ' ' VAL . 20.1 t80 -63.42 -52.65 60.65 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.603 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -64.14 -31.34 80.5 Favored Glycine 0 C--N 1.335 0.51 0 CA-C-N 115.979 -0.555 . . . . 0.0 113.151 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.92 91.22 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.829 0.315 . . . . 0.0 111.182 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -72.2 -30.33 64.85 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.43 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 67' ' ' PHE . 43.4 t -65.46 -47.99 84.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 120.759 0.314 . . . . 0.0 110.498 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 56.9 mtp85 -59.63 -39.68 85.1 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.25 -46.05 74.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.815 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -59.28 -46.8 87.57 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.249 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -66.09 -35.52 80.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.773 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.0 m -59.65 -46.77 88.03 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.503 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.21 -36.43 61.39 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.507 0.194 . . . . 0.0 110.977 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -59.73 -39.09 83.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.231 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -57.3 -34.65 68.91 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.15 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.7 tttt -66.37 -44.02 84.32 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.598 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.617 ' CE2' HD12 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -70.39 -37.74 74.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.24 179.757 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.736 ' HB3' HG22 ' A' ' 89' ' ' VAL . 17.3 m120 -65.61 111.62 6.67 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.761 -0.199 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.529 ' O ' HG21 ' A' ' 89' ' ' VAL . 42.8 Cg_endo -67.18 147.14 78.41 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.629 2.219 . . . . 0.0 112.356 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 50.2 Cg_exo -53.55 131.74 45.29 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.671 2.247 . . . . 0.0 112.723 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t70 63.0 64.31 0.87 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.514 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.562 ' HB3' HG23 ' A' ' 89' ' ' VAL . 5.5 t-80 -136.8 155.94 49.15 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.034 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -55.8 -44.46 77.82 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.403 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.6 m -63.52 -35.24 71.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.637 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.736 HG22 ' HB3' ' A' ' 82' ' ' ASN . 26.2 t -60.8 -46.27 96.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.88 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.33 -33.7 76.45 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.027 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 6.0 mtm -64.42 -46.56 82.69 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.861 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.45 -44.29 96.77 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.839 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.1 mtt180 -65.84 -43.09 89.54 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.731 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.443 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 22.3 tttp -63.37 -42.94 98.87 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.103 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -66.65 -39.07 88.06 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.903 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -69.11 -43.79 73.73 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.703 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -61.48 -46.88 88.16 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.33 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.6 p -66.33 -42.95 91.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.808 -0.178 . . . . 0.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -63.85 -51.59 63.94 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.862 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.39 -41.31 98.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -47.56 85.21 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.658 0.266 . . . . 0.0 110.839 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.87 -43.9 78.32 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.798 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.456 ' HD1' HD12 ' A' ' 107' ' ' LEU . 0.3 OUTLIER -60.45 -42.89 97.08 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.027 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.04 -32.62 73.11 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.007 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -70.9 -44.43 66.27 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.987 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 9.2 ptm -69.06 -33.38 73.47 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.195 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.456 HD12 ' HD1' ' A' ' 103' ' ' PHE . 8.8 mt -83.89 -42.24 16.57 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.041 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.842 179.758 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 . . . . . 0 N--CA 1.488 1.438 0 CA-C-O 120.683 0.278 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -69.07 -34.75 75.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.948 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.06 -46.8 76.48 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.553 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -32.29 71.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.15 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.62 -40.91 84.65 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.563 0.22 . . . . 0.0 110.799 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.3 m -63.48 -38.95 93.09 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.856 179.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.9 m -56.93 -35.7 69.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.68 97.73 Favored Glycine 0 C--N 1.337 0.612 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.628 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 16.1 mt -65.47 -47.67 85.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-O 120.705 0.288 . . . . 0.0 110.66 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.493 HD13 ' HG3' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -63.45 -35.79 81.61 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.776 179.403 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -30.75 66.69 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.333 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.491 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 52.7 tt0 -58.55 -36.66 74.25 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.004 0.19 . . . . 0.0 110.829 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -58.53 -37.17 75.09 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.679 0.276 . . . . 0.0 110.397 178.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.82 5.29 33.0 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.742 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.491 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.81 17.84 11.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.629 0.252 . . . . 0.0 111.349 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 15' ' ' ALA . 47.6 mmtt 68.02 37.37 3.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.125 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.436 ' CD ' ' HG3' ' A' ' 12' ' ' GLU . 55.0 mttt -128.09 -39.28 1.75 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.07 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -123.73 19.09 9.47 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.374 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.01 62.76 Favored 'General case' 0 C--N 1.335 -0.052 0 CA-C-O 120.643 0.259 . . . . 0.0 111.106 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.69 -36.16 62.75 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.275 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 5.3 m-85 -81.42 -33.08 32.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.217 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.17 20.0 16.51 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.403 ' N ' ' CD ' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.68 -50.88 62.16 Favored Pre-proline 0 CA--C 1.529 0.154 0 CA-C-N 116.94 -0.118 . . . . 0.0 111.049 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 23' ' ' TRP . 50.5 Cg_exo -53.88 -25.43 35.42 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.548 2.165 . . . . 0.0 112.934 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -118.84 37.11 4.2 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.132 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.16 -35.36 64.02 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.17 162.57 47.3 Favored Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.909 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.18 -177.4 0.12 Allowed 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.155 2.57 . . . . 0.0 112.768 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.3 m -120.91 83.78 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.252 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.03 101.85 0.31 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.875 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.7 p -61.83 -36.63 74.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.737 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -71.83 -47.65 51.69 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.563 0.22 . . . . 0.0 111.391 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.5 -47.29 49.72 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 20.4 mt -80.91 -21.49 40.5 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.88 57.61 9.48 Favored Glycine 0 C--N 1.337 0.594 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.476 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.455 ' O ' HD12 ' A' ' 36' ' ' LEU . 0.6 OUTLIER -126.05 74.5 1.44 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.051 0.453 . . . . 0.0 111.296 -179.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.92 -3.85 34.56 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.777 179.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -76.25 -20.0 57.8 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.37 0.129 . . . . 0.0 111.304 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.507 ' HA ' HD12 ' A' ' 42' ' ' ILE . 4.3 t80 -57.42 -34.06 68.53 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 116.671 -0.241 . . . . 0.0 110.969 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.48 -40.46 96.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.751 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.91 -41.02 75.24 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.476 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.507 HD12 ' HA ' ' A' ' 39' ' ' TYR . 12.8 mt -68.74 -51.44 45.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.305 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.96 150.5 28.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-O 120.941 0.401 . . . . 0.0 111.644 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.1 pttm -96.04 -32.77 12.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.677 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 -110.96 83.39 3.63 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-O 120.705 0.288 . . . . 0.0 111.057 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -73.01 125.76 10.65 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.833 2.355 . . . . 0.0 112.65 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.1 mtp -148.63 141.36 24.56 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.148 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.66 168.99 13.6 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.493 ' HA ' HD12 ' A' ' 52' ' ' ILE . 26.9 mtt -56.31 -38.74 71.69 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.102 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.5 t -62.45 -35.72 80.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.833 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 57.3 m -73.18 -38.78 66.03 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.017 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.493 HD12 ' HA ' ' A' ' 49' ' ' MET . 19.7 mt -66.89 -45.13 88.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.917 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.493 ' HG3' HD13 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -69.31 -34.24 74.37 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.959 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.0 t -57.32 -42.91 82.78 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.729 -0.214 . . . . 0.0 110.901 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -62.02 -49.38 76.24 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.879 0.371 . . . . 0.0 110.112 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 56' ' ' LEU . 10.3 tp -63.76 -32.66 74.24 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.002 179.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.77 -40.6 88.78 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.651 0.262 . . . . 0.0 111.056 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -91.34 15.19 12.59 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.861 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.52 27.75 17.41 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.629 0.252 . . . . 0.0 111.599 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -70.68 -34.29 71.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.68 0.276 . . . . 0.0 110.689 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -73.63 106.55 5.44 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.608 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -80.58 -28.8 37.08 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.068 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -146.38 165.25 29.9 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.944 0.402 . . . . 0.0 111.436 -179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -73.11 -15.67 61.48 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.55 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -63.1 -44.94 94.27 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -69.48 -37.98 77.49 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.848 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.1 t80 -66.53 -53.62 32.84 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.917 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.45 -38.0 84.87 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.665 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.92 -35.27 76.25 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.591 0.234 . . . . 0.0 111.22 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -76.17 -34.2 59.35 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.329 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.2 t -67.09 -48.24 79.57 Favored 'Isoleucine or valine' 0 C--O 1.232 0.14 0 CA-C-O 120.621 0.248 . . . . 0.0 110.622 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -63.48 -34.03 76.88 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.082 179.656 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 tp -68.25 -48.38 65.23 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 tmm? -59.33 -42.72 92.12 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.3 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.11 -44.0 95.17 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.795 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -37.26 86.56 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.777 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -69.66 -47.85 61.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.832 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.24 -33.91 69.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.206 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -56.54 -39.45 73.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.149 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -75.01 -38.92 61.45 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.791 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -59.89 -31.86 70.2 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.674 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.779 ' HB2' HG22 ' A' ' 89' ' ' VAL . 21.8 p30 -92.89 148.57 36.13 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-O 120.811 0.338 . . . . 0.0 111.104 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.76 ' O ' HG21 ' A' ' 89' ' ' VAL . 97.7 Cg_endo -80.17 169.63 17.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.999 2.466 . . . . 0.0 112.653 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.22 128.67 11.49 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.513 2.142 . . . . 0.0 112.525 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 t70 62.51 69.26 0.61 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.283 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.855 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.5 t60 -136.31 158.05 45.35 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.229 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.18 -44.68 96.06 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.326 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.475 HG22 ' CD2' ' A' ' 86' ' ' HIS . 5.3 m -64.7 -30.65 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.373 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.855 HG23 ' HB3' ' A' ' 86' ' ' HIS . 12.5 t -69.37 -40.73 80.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.893 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.58 -35.36 68.11 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.024 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . 0.412 ' HG2' ' CD2' ' A' ' 21' ' ' TYR . 6.1 mtt -65.6 -44.29 87.05 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.744 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.27 -47.59 85.36 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.238 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -59.57 -43.41 93.63 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.745 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.417 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.0 tttt -68.62 -40.45 80.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.868 179.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -34.4 78.23 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.086 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -69.3 -44.0 72.69 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.698 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -63.54 -46.86 84.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.133 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.15 -43.09 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.198 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.0 -50.63 67.76 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.781 -0.19 . . . . 0.0 110.787 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -45.98 85.39 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.762 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.2 mtp -62.44 -46.29 89.21 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.88 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -64.73 -42.5 95.17 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.983 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.02 -45.26 95.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.815 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.68 73.18 Favored 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.9 -43.36 65.49 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.065 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.7 ptm -69.27 -33.32 73.04 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.214 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.46 -42.82 14.13 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.047 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.729 0.299 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -57.97 -36.94 73.3 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 mt -62.54 -34.82 77.68 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.024 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 -32.62 67.33 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.076 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.31 -48.22 57.58 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.068 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.661 ' HA ' HD12 ' A' ' 9' ' ' ILE . 30.1 p -66.11 -36.99 84.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.385 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 82.9 p -57.57 -34.42 69.18 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.12 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.96 -43.46 98.1 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.454 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.661 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.3 mt -63.99 -45.74 95.91 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.849 0.357 . . . . 0.0 110.058 179.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.582 HD21 ' HG2' ' A' ' 53' ' ' LYS . 9.3 tp -61.27 -35.46 77.36 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -36.38 73.01 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.142 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -37.82 82.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.822 -0.172 . . . . 0.0 111.18 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.61 -37.39 75.76 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.784 0.326 . . . . 0.0 110.273 179.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -108.45 17.65 21.85 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.299 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.73 0.14 57.17 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt 78.43 16.78 1.17 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.288 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -108.57 -36.22 6.25 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.63 179.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -113.55 -3.26 13.68 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.786 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.75 -29.47 68.18 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.447 0.165 . . . . 0.0 111.409 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.67 -46.1 83.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.649 0.262 . . . . 0.0 110.85 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.6 -34.21 71.89 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.865 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -98.15 19.55 13.93 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.572 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.505 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 42.6 t90 -59.58 -51.63 79.76 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 116.77 -0.196 . . . . 0.0 111.47 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 57.0 Cg_endo -70.35 -9.66 26.38 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.251 1.967 . . . . 0.0 113.01 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -120.13 43.16 2.77 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.044 0.45 . . . . 0.0 110.903 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.43 -37.95 11.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.683 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -107.86 160.93 25.0 Favored Pre-proline 0 N--CA 1.465 0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.055 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.35 -176.07 0.13 Allowed 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.969 2.446 . . . . 0.0 112.761 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.31 79.43 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.11 0.481 . . . . 0.0 111.308 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.686 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 2.2 t0 -63.76 101.44 0.36 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.68 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -62.66 -39.53 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.715 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -71.92 -46.86 56.15 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.271 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -70.5 -48.75 54.16 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -81.51 -21.49 38.6 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.66 54.23 13.29 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.476 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 39' ' ' TYR . 0.5 OUTLIER -126.34 67.88 1.22 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.016 0.436 . . . . 0.0 111.148 -179.901 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -65.41 -22.2 66.75 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.312 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.3 -19.89 57.83 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.318 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.471 ' CE2' HG13 ' A' ' 43' ' ' ILE . 2.4 t80 -60.79 -45.61 93.72 Favored 'General case' 0 C--O 1.23 0.038 0 CA-C-O 120.536 0.207 . . . . 0.0 110.964 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 26.8 t -63.48 -30.88 71.93 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.938 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.56 -34.39 62.93 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.882 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.7 mt -83.73 -34.81 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.517 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.678 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.8 mm -102.28 124.55 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -87.45 -33.27 19.1 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.392 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 75.26 68.79 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-O 120.738 0.304 . . . . 0.0 110.945 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.32 128.94 32.58 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.885 2.39 . . . . 0.0 112.692 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -152.18 141.32 21.32 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.036 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.35 162.7 31.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.789 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.407 ' HA ' HD12 ' A' ' 52' ' ' ILE . 0.0 OUTLIER -53.52 -39.89 65.01 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.716 179.628 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.7 t -64.14 -37.71 88.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.857 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.4 m -74.05 -36.49 64.37 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.297 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.65 HG23 ' OH ' ' A' ' 61' ' ' TYR . 9.6 mt -71.58 -44.3 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.859 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.582 ' HG2' HD21 ' A' ' 10' ' ' LEU . 3.9 mtpm? -64.21 -37.77 88.65 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.76 0.282 . . . . 0.0 111.76 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.2 p -57.9 -38.76 76.41 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.372 0.13 . . . . 0.0 111.122 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -60.36 -48.25 82.55 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.5 tp -62.91 -34.98 78.57 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.468 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.17 -38.58 91.75 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.271 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.46 15.15 9.75 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 59.56 27.28 16.44 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.653 0.263 . . . . 0.0 111.504 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.67 -32.38 57.9 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.665 0.269 . . . . 0.0 110.594 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.65 ' OH ' HG23 ' A' ' 52' ' ' ILE . 4.7 m-85 -71.11 104.93 3.19 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.872 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 -62.64 -30.77 71.61 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.96 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -165.99 172.48 11.43 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.764 0.316 . . . . 0.0 111.32 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.32 -17.58 64.29 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.589 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -62.82 -43.23 99.36 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.659 0.266 . . . . 0.0 110.507 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.89 -34.67 71.82 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.831 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.8 t80 -62.81 -53.38 55.12 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.073 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -57.21 -33.19 64.5 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.705 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.41 -44.88 86.03 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.529 0.204 . . . . 0.0 111.286 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -66.7 -30.76 71.08 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.343 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 67' ' ' PHE . 42.6 t -67.09 -47.33 82.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.113 0 CA-C-O 120.692 0.282 . . . . 0.0 110.374 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -62.57 -41.29 98.83 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.25 -47.63 83.53 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.724 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 12.8 tmm? -61.88 -45.98 91.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.893 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -61.92 -42.49 99.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.171 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.4 m -62.67 -42.8 99.81 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.147 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.678 ' HB3' HD12 ' A' ' 43' ' ' ILE . 2.6 m120 -73.86 -47.12 40.53 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.154 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.0 t -60.19 -37.39 80.06 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.243 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -60.72 -33.12 72.42 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.019 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -61.52 -35.69 78.44 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.728 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -85.53 -34.02 21.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.356 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.506 ' HB3' HG22 ' A' ' 89' ' ' VAL . 23.0 m-20 -56.76 111.67 3.59 Favored Pre-proline 0 N--CA 1.466 0.365 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.107 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.687 ' O ' HG21 ' A' ' 89' ' ' VAL . 50.0 Cg_exo -56.46 154.17 31.35 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.803 2.335 . . . . 0.0 112.654 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.0 136.22 24.49 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.569 2.179 . . . . 0.0 112.516 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 59.63 55.45 4.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.419 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.774 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.9 t-80 -121.79 148.62 44.44 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.765 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -56.7 -44.09 81.17 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.308 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.7 m -61.57 -33.17 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.384 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.774 HG23 ' HB3' ' A' ' 86' ' ' HIS . 25.4 t -65.5 -44.47 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.781 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.37 -38.51 74.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.76 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.2 mtp -65.79 -42.37 90.81 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.73 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.5 -47.69 84.52 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.489 ' HD2' HG12 ' A' ' 89' ' ' VAL . 8.2 mtp180 -59.71 -44.14 93.83 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.809 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -41.97 91.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.721 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 80.3 mt -65.15 -34.43 78.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.184 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -69.12 -43.92 73.42 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.631 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.41 -47.08 83.48 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.162 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.69 -42.96 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.012 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -63.57 -50.91 67.62 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.817 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -44.29 93.57 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.019 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -48.11 83.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.023 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.66 -42.67 86.28 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.404 ' O ' ' HG3' ' A' ' 106' ' ' MET . 0.5 OUTLIER -62.64 -46.95 85.88 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.017 179.791 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.79 81.93 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.25 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -43.58 65.44 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.368 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 103' ' ' PHE . 1.0 OUTLIER -69.7 -34.12 73.47 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.76 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.01 -42.08 15.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.615 0.245 . . . . 0.0 111.069 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 . . . . . 0 C--O 1.252 1.189 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.586 179.94 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.631 0.253 . . . . 0.0 111.078 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -59.82 -36.33 76.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.931 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.459 HD22 HH21 ' A' ' 59' ' ' ARG . 13.8 mt -58.74 -46.74 86.72 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.9 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.07 -37.46 75.5 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.086 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -40.29 96.72 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.031 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.76 -37.76 79.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.914 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.6 t -58.07 -38.53 76.52 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.998 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -45.31 95.77 Favored Glycine 0 C--N 1.336 0.535 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.379 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -64.14 -42.97 97.23 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.77 0.319 . . . . 0.0 110.357 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.598 HD13 ' HE2' ' A' ' 53' ' ' LYS . 10.2 mt -62.37 -35.61 79.7 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.706 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.03 -28.77 64.78 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.806 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -58.48 -37.12 74.87 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.587 0.232 . . . . 0.0 111.006 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.86 -37.02 78.12 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.609 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.25 21.63 15.59 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -113.47 18.8 17.41 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.717 0.294 . . . . 0.0 111.506 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.47 28.59 4.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.246 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -117.21 -31.93 5.16 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.394 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.482 ' CE1' HG11 ' A' ' 98' ' ' VAL . 1.7 t60 -148.58 30.49 0.82 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.789 0.328 . . . . 0.0 110.832 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.81 -40.93 54.09 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.121 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.27 -37.13 74.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.119 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.442 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 25.4 m-85 -77.82 -34.17 52.13 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.435 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.588 ' HB2' HD11 ' A' ' 95' ' ' LEU . . . -103.34 20.91 16.9 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.413 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.93 -53.3 43.45 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-N 116.933 -0.121 . . . . 0.0 111.14 179.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.413 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 84.3 Cg_endo -78.36 -5.78 15.17 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.349 2.032 . . . . 0.0 112.907 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -106.36 37.79 2.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.645 0.26 . . . . 0.0 110.93 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -121.39 -58.09 1.8 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.954 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.65 145.62 92.67 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.888 179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.96 -177.12 3.57 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.607 2.205 . . . . 0.0 112.679 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.421 ' O ' HG23 ' A' ' 29' ' ' VAL . 13.5 m -112.6 79.76 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.041 0.448 . . . . 0.0 111.172 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.588 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -58.94 104.35 0.23 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.968 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 36' ' ' LEU . 10.4 p -62.43 -39.8 85.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.548 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.26 -45.9 58.21 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.702 -0.227 . . . . 0.0 111.606 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.588 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.99 -48.48 44.56 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.318 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.0 mt -81.31 -21.48 39.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.59 58.41 5.42 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.458 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.558 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -130.92 75.93 1.69 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.898 0.38 . . . . 0.0 111.442 -179.835 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -6.16 45.15 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.741 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.28 -20.01 57.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.385 0.136 . . . . 0.0 111.291 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.18 -41.42 83.85 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.751 -0.204 . . . . 0.0 111.012 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -64.04 -40.35 96.11 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.652 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.62 -44.31 90.94 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.818 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.4 mt -71.82 -51.68 30.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.076 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 6.2 mt -128.11 104.12 11.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.915 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -59.36 -29.89 68.01 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.512 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -110.27 81.51 2.28 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 120.817 0.341 . . . . 0.0 110.615 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.21 139.03 37.73 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.668 2.246 . . . . 0.0 112.603 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.605 ' HB3' ' HE2' ' A' ' 74' ' ' MET . 8.7 tpp -149.56 138.56 21.18 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.245 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -136.75 164.42 28.31 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.722 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -52.43 -41.43 63.24 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.719 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.5 t -65.41 -38.85 91.17 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.781 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.7 m -71.43 -43.31 66.97 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.114 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.536 HG23 ' OH ' ' A' ' 61' ' ' TYR . 8.4 mt -65.14 -45.12 95.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.175 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.598 ' HE2' HD13 ' A' ' 10' ' ' LEU . 1.0 OUTLIER -65.24 -34.68 78.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 t -57.56 -40.25 78.53 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.983 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -60.25 -47.65 85.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.851 0.358 . . . . 0.0 110.121 179.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.5 tp -66.97 -33.42 75.54 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.595 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -64.11 -41.52 97.22 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.402 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.23 15.15 9.39 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.459 HH21 HD22 ' A' ' 3' ' ' LEU . 1.5 mmp_? 58.96 27.85 16.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.588 0.233 . . . . 0.0 111.394 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.9 -32.83 45.9 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.63 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.536 ' OH ' HG23 ' A' ' 52' ' ' ILE . 1.8 m-85 -65.4 105.7 1.22 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.933 0.397 . . . . 0.0 110.844 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -32.16 70.96 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -162.97 165.28 25.15 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.87 0.367 . . . . 0.0 111.596 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -20.11 64.43 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.267 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 110.27 -0.271 . . . . 0.0 110.27 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -69.68 -34.18 73.6 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.887 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.448 ' O ' HG23 ' A' ' 71' ' ' VAL . 3.1 t80 -59.2 -53.64 55.96 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.96 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.73 -35.94 90.77 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.373 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 72' ' ' ARG . . . -60.67 -36.65 79.27 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -76.64 -38.99 53.72 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.167 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 67' ' ' PHE . 44.6 t -67.04 -47.75 81.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.948 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 69' ' ' ALA . 0.0 OUTLIER -59.28 -33.73 71.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.591 0.234 . . . . 0.0 110.789 179.49 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.7 tt -71.87 -42.1 67.26 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.473 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.605 ' HE2' ' HB3' ' A' ' 47' ' ' MET . 9.8 tpp -60.29 -46.6 89.27 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.197 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -55.71 -40.67 72.73 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.147 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.2 t -67.78 -41.81 82.65 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.014 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.41 -37.64 65.85 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.393 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.55 -35.96 73.14 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.643 0.259 . . . . 0.0 111.073 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.85 -31.78 68.83 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.193 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.12 -36.03 80.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.748 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -35.94 22.27 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.06 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.838 ' HB3' HG22 ' A' ' 89' ' ' VAL . 15.8 m-20 -67.52 125.66 91.49 Favored Pre-proline 0 N--CA 1.466 0.325 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.071 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.719 ' O ' HG21 ' A' ' 89' ' ' VAL . 52.1 Cg_exo -54.92 158.5 11.04 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.981 2.454 . . . . 0.0 112.86 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -74.57 118.69 5.43 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.596 2.197 . . . . 0.0 112.478 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 t0 62.57 70.58 0.56 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.071 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.733 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.0 t-160 -132.53 156.69 46.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.302 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -57.09 -44.28 83.02 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.186 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.9 m -64.39 -31.88 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.753 0.311 . . . . 0.0 111.141 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.838 HG22 ' HB3' ' A' ' 82' ' ' ASN . 25.8 t -65.73 -40.32 87.46 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.739 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.413 ' HA ' ' HD3' ' A' ' 93' ' ' ARG . . . -57.43 -34.42 68.92 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.918 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -33.04 73.81 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.62 -50.73 66.01 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -68.1 -38.52 82.39 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.856 179.742 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.442 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -61.28 -44.98 96.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.78 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.588 HD11 ' HB2' ' A' ' 22' ' ' ALA . 0.3 OUTLIER -66.14 -34.83 78.93 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.746 179.551 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -69.96 -41.65 74.22 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.593 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.38 -46.82 88.56 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.063 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.482 HG11 ' CE1' ' A' ' 18' ' ' HIS . 8.2 p -66.17 -42.92 92.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.898 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.88 -49.82 71.2 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.675 -0.238 . . . . 0.0 110.7 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.51 -40.97 98.43 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.85 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -47.75 84.54 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.68 0.276 . . . . 0.0 110.663 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -43.68 80.13 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.633 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -45.47 92.37 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.858 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.27 -42.56 95.65 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -70.24 -36.19 74.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.755 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -40.53 76.32 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.029 179.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.67 -42.55 17.99 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -178.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.45 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 . . . . . 0 N--CA 1.488 1.434 0 CA-C-O 120.706 0.289 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -63.8 -36.87 85.31 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.866 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.65 -44.14 96.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.845 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -67.86 -39.39 83.76 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.936 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.87 -44.64 95.56 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.013 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.429 ' HA ' HD12 ' A' ' 9' ' ' ILE . 94.5 m -59.42 -37.24 77.55 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.786 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 m -55.05 -34.13 63.3 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.266 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.78 -47.4 91.15 Favored Glycine 0 C--N 1.337 0.614 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.399 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.1 mt -64.02 -46.64 93.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 120.791 0.329 . . . . 0.0 110.317 179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.534 HD23 ' HG2' ' A' ' 53' ' ' LYS . 1.2 tp -63.02 -35.67 81.0 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.634 179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -58.47 -27.49 64.45 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.485 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.497 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -58.46 -36.54 73.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.359 0.123 . . . . 0.0 111.014 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.0 mtm -57.85 -37.23 73.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.721 0.295 . . . . 0.0 110.371 178.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.84 8.16 32.61 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.695 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.497 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -93.32 14.48 18.24 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.561 0.22 . . . . 0.0 111.48 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 68.53 32.24 4.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.984 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 9.2 mttm -123.17 -37.79 2.66 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -119.34 18.23 12.95 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.321 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.27 -29.98 48.28 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.278 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.61 -37.64 76.96 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.863 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.412 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 2.8 m-85 -80.16 -33.93 38.0 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.817 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.429 ' HB1' ' CE ' ' A' ' 49' ' ' MET . . . -98.07 19.38 14.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.881 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.48 -51.34 68.05 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 121.405 -0.118 . . . . 0.0 111.055 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -62.23 -23.2 75.2 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 122.614 2.209 . . . . 0.0 112.806 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -123.87 34.64 5.02 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.927 0.394 . . . . 0.0 110.542 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -76.95 -46.84 22.73 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.776 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 166.6 11.59 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.842 179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.22 -171.41 0.7 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.63 2.22 . . . . 0.0 112.436 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.47 HG11 ' CE2' ' A' ' 39' ' ' TYR . 5.7 m -113.18 76.35 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.045 0.45 . . . . 0.0 111.275 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -60.1 98.56 0.06 Allowed 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 13.1 p -60.54 -38.65 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.833 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -72.12 -46.88 54.9 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.625 0.232 . . . . 0.0 111.625 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.52 -48.34 41.18 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.5 mt -80.81 -21.5 40.83 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.15 52.13 47.04 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.35 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.47 71.66 0.85 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.05 0.452 . . . . 0.0 111.288 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.3 p-80 -67.17 -14.85 63.3 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.477 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -76.17 -19.76 58.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.401 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.47 ' CE2' HG11 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -61.28 -39.07 89.04 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 116.74 -0.209 . . . . 0.0 111.056 179.692 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -37.9 86.44 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.773 0.32 . . . . 0.0 110.561 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -67.48 -41.73 84.12 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.917 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 18.0 mt -77.71 -54.77 11.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.239 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.811 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.3 mm -100.95 104.74 16.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.082 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -66.95 -27.3 67.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.486 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.67 72.38 78.14 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.698 0.285 . . . . 0.0 110.802 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -58.0 132.17 47.94 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.838 2.359 . . . . 0.0 112.489 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -158.42 127.63 5.66 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.31 170.81 9.92 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.931 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.616 ' HA ' HD12 ' A' ' 52' ' ' ILE . 18.2 ttm -55.73 -36.56 67.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.895 0.379 . . . . 0.0 110.182 179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 27.0 t -62.13 -38.93 90.81 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.677 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.5 m -73.29 -36.29 66.28 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.105 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 49' ' ' MET . 23.4 mt -66.51 -44.78 90.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 120.627 0.251 . . . . 0.0 110.981 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.534 ' HG2' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -66.24 -35.33 80.15 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.154 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.6 p -57.47 -41.14 80.03 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.472 0.177 . . . . 0.0 111.13 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -46.55 88.78 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.2 tp -66.74 -34.73 78.49 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.775 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.38 -41.41 93.73 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.4 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.494 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . . . -90.66 15.28 11.3 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.31 27.55 16.65 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.649 0.261 . . . . 0.0 111.498 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' A' ' 58' ' ' ALA . 34.5 mt-10 -73.32 -32.74 64.77 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.743 179.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.468 ' CE1' ' HA ' ' A' ' 67' ' ' PHE . 4.6 m-85 -69.04 103.93 1.99 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.781 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -63.21 -29.39 70.74 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.476 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -166.41 179.68 5.44 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.904 0.383 . . . . 0.0 111.567 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.77 -20.94 61.08 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.409 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.86 -45.99 89.98 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.674 0.273 . . . . 0.0 110.327 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.76 -30.14 69.52 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.797 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.468 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 0.2 OUTLIER -59.85 -49.74 76.53 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.595 179.645 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.92 -33.11 77.22 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.513 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.73 -35.87 75.44 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.567 0.222 . . . . 0.0 111.17 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -40.3 61.38 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.811 179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.7 t -64.82 -48.32 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.081 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -33.75 74.55 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.031 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.3 tp -70.69 -47.06 61.79 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.62 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.7 ttp -60.49 -43.83 96.58 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.411 ' CE2' ' HB2' ' A' ' 96' ' ' GLN . 3.2 m-85 -58.43 -43.51 88.73 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.017 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.5 t -59.27 -45.54 90.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.735 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.811 ' HB3' HD12 ' A' ' 43' ' ' ILE . 58.9 m-20 -70.48 -39.92 73.95 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.724 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -42.5 91.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.106 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -58.12 -39.77 79.55 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.132 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.85 -45.65 73.99 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.978 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -72.17 -39.84 68.39 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.197 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.659 ' HB3' HG22 ' A' ' 89' ' ' VAL . 82.6 m-20 -67.9 125.25 91.15 Favored Pre-proline 0 N--CA 1.465 0.294 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.187 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.684 ' O ' HG21 ' A' ' 89' ' ' VAL . 53.4 Cg_endo -69.32 164.46 34.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.714 2.276 . . . . 0.0 112.428 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.38 128.91 11.55 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.562 2.175 . . . . 0.0 112.585 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.8 t0 60.2 68.07 0.8 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.0 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.662 ' HB3' HG23 ' A' ' 89' ' ' VAL . 5.2 t60 -131.63 157.8 42.73 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.28 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.33 -44.31 84.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.039 179.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.41 HG22 ' HD2' ' A' ' 86' ' ' HIS . 29.8 m -64.17 -32.87 59.13 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.163 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.684 HG21 ' O ' ' A' ' 83' ' ' PRO . 23.9 t -68.74 -44.62 82.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.55 -39.31 73.2 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.884 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 42.1 mtt -66.07 -40.27 90.75 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.87 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.08 -42.36 90.21 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -49.12 79.05 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.412 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 25.1 tttm -66.57 -39.21 88.36 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.891 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -35.16 76.47 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.035 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.411 ' HB2' ' CE2' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -68.98 -44.58 72.6 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.739 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -63.51 -46.71 84.83 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.28 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.616 HG23 ' NH1' ' A' ' 102' ' ' ARG . 9.3 p -62.22 -43.13 97.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.753 -0.203 . . . . 0.0 111.14 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -49.65 70.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.669 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -42.92 99.75 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.907 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.65 -48.01 83.36 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.996 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.616 ' NH1' HG23 ' A' ' 98' ' ' VAL . 0.0 OUTLIER -67.23 -44.27 79.9 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.912 179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -59.83 -48.67 80.76 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.856 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.87 -37.59 84.72 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.521 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -72.1 -44.21 63.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 102' ' ' ARG . 1.3 tmm? -67.03 -45.09 78.54 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.382 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -40.14 35.63 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.891 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.411 -179.666 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 120.744 0.307 . . . . 0.0 111.281 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -59.58 -42.56 92.77 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.769 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD21 ' O ' ' A' ' 61' ' ' TYR . 5.8 mt -64.78 -46.11 83.48 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.813 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -33.6 74.01 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.954 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.57 -43.38 85.13 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.674 0.273 . . . . 0.0 110.724 179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.591 ' HA ' HD12 ' A' ' 9' ' ' ILE . 93.9 m -62.55 -40.77 97.88 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.464 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -36.08 75.21 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.057 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.61 -47.29 91.89 Favored Glycine 0 C--N 1.335 0.52 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.359 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mt -65.52 -47.51 86.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-O 120.705 0.288 . . . . 0.0 110.502 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.26 -35.61 80.92 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.16 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.5 mttp -57.96 -31.14 66.58 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.229 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.433 ' CG ' ' HD3' ' A' ' 17' ' ' LYS . 4.3 tt0 -59.65 -38.07 80.42 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.502 0.192 . . . . 0.0 110.985 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.403 ' HA ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -61.67 -38.12 86.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.727 0.299 . . . . 0.0 110.484 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -96.35 -1.74 47.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.609 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -88.6 9.83 22.64 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 75.65 20.85 1.79 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.612 0.365 . . . . 0.0 111.335 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.433 ' HD3' ' CG ' ' A' ' 12' ' ' GLU . 9.8 mtpt -108.73 -38.94 5.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.32 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.472 ' NE2' HG11 ' A' ' 98' ' ' VAL . 6.6 m-70 -121.44 16.35 11.3 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.289 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.08 -32.42 59.25 Favored 'General case' 0 C--O 1.227 -0.109 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.336 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.75 96.03 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.738 0.304 . . . . 0.0 111.039 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -72.84 -36.32 67.45 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.906 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.29 24.89 10.82 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.498 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.469 ' N ' ' HD2' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -64.41 -57.73 16.34 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.388 -179.647 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 23' ' ' TRP . 24.5 Cg_endo -62.01 -17.15 54.41 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.372 2.048 . . . . 0.0 113.002 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.37 35.51 3.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.803 0.335 . . . . 0.0 111.08 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.99 -35.61 37.2 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.633 179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HB2' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -119.63 156.64 53.44 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.369 -179.759 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.426 ' HD2' ' HB2' ' A' ' 27' ' ' LYS . 29.6 Cg_endo -63.19 -178.55 0.46 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.902 2.402 . . . . 0.0 112.714 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.7 m -114.89 86.69 0.94 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.13 0.491 . . . . 0.0 111.156 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.44 103.56 0.25 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.713 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 36' ' ' LEU . 12.2 p -59.71 -40.94 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -72.14 -46.05 58.05 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.01 48.77 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 37.4 mt -81.91 -21.57 37.27 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.29 64.27 2.94 Favored Glycine 0 C--N 1.334 0.458 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.566 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.525 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -134.53 79.46 1.8 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.944 0.402 . . . . 0.0 111.313 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -10.26 59.29 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.662 179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -76.23 -19.64 58.18 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.418 0.151 . . . . 0.0 111.34 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.405 ' CZ ' HG13 ' A' ' 43' ' ' ILE . 2.2 t80 -57.75 -34.71 69.82 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.508 0.194 . . . . 0.0 111.141 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 35.2 t -65.21 -37.45 87.34 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.83 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -75.83 -43.41 46.08 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.213 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 45.7 mt -74.12 -61.6 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.279 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.405 HG13 ' CZ ' ' A' ' 39' ' ' TYR . 30.8 mm -90.96 106.62 17.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.28 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 pttp -66.14 -33.69 76.36 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -124.71 94.38 44.5 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.708 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.22 110.97 2.13 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.679 2.253 . . . . 0.0 112.364 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 29.7 tpp -144.21 133.32 22.88 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.131 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -131.68 163.57 27.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.184 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.611 ' HA ' HD12 ' A' ' 52' ' ' ILE . 67.6 mtt -54.72 -38.25 66.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.928 -179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 t -62.36 -38.15 88.42 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.604 0.24 . . . . 0.0 110.824 179.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 91.3 m -74.17 -39.84 62.95 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.993 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 49' ' ' MET . 9.2 mt -65.35 -45.08 94.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-O 120.574 0.226 . . . . 0.0 111.07 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -36.51 83.28 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.826 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.9 t -57.72 -39.43 77.26 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.917 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -49.57 77.07 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.8 tp -61.16 -34.08 74.46 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.468 179.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -65.29 -37.34 86.86 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.118 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.77 15.27 8.56 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 60.83 27.25 17.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.624 0.25 . . . . 0.0 111.546 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.55 -34.21 53.85 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.803 0.335 . . . . 0.0 110.583 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.489 ' O ' HD21 ' A' ' 3' ' ' LEU . 6.0 m-85 -78.78 107.29 11.38 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.797 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 mtt180 -92.16 -27.38 17.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.222 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -139.15 164.06 30.78 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.894 0.378 . . . . 0.0 111.64 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.73 -18.63 60.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.509 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -45.2 93.73 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.593 0.235 . . . . 0.0 110.457 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -70.49 -36.81 74.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.705 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.449 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 5.6 t80 -63.98 -53.81 44.31 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.901 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -61.12 -31.51 77.04 Favored Glycine 0 C--N 1.334 0.461 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.661 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.77 94.65 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 111.446 0.165 . . . . 0.0 111.446 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.91 -39.12 83.63 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.116 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.401 HG21 ' CZ ' ' A' ' 99' ' ' PHE . 21.8 t -65.2 -48.22 84.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.972 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -64.83 -34.07 77.49 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.145 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -47.81 84.35 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.876 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -60.54 -41.02 93.63 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.949 179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -58.23 -46.36 86.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.93 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.7 m -63.33 -42.03 98.93 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.765 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 46.3 m-20 -69.27 -34.17 74.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.885 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.07 -33.77 73.86 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.262 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -60.65 -34.21 73.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.095 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.35 -41.25 73.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.853 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -78.55 -34.98 46.73 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.306 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.406 ' ND2' HG22 ' A' ' 88' ' ' VAL . 51.1 m-20 -92.28 111.83 52.29 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.618 -0.265 . . . . 0.0 111.267 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.432 ' HG2' ' CD2' ' A' ' 86' ' ' HIS . 41.7 Cg_endo -66.64 156.44 65.69 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.753 2.302 . . . . 0.0 112.312 179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -66.95 154.66 73.89 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.58 2.187 . . . . 0.0 112.441 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.67 37.75 15.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.187 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.479 ' HB3' HG23 ' A' ' 89' ' ' VAL . 2.5 t-80 -120.04 150.34 40.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.156 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -44.02 85.33 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.406 HG22 ' ND2' ' A' ' 82' ' ' ASN . 10.7 p -56.76 -36.33 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.554 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.479 HG23 ' HB3' ' A' ' 86' ' ' HIS . 15.6 t -61.04 -44.48 98.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.659 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.65 -36.63 72.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.048 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.4 mtp -62.54 -44.14 97.07 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.898 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -40.66 96.9 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.319 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -47.96 82.76 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.716 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -62.83 -41.59 99.39 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.98 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.49 -37.47 82.91 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.899 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -70.05 -41.83 73.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.656 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -60.67 -46.95 88.4 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.171 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.472 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.2 p -68.0 -42.92 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.195 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.401 ' CZ ' HG21 ' A' ' 71' ' ' VAL . 5.7 t80 -64.4 -51.54 62.72 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.569 0.223 . . . . 0.0 110.777 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -60.62 -44.09 96.74 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.075 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 4.7 mtp -60.09 -46.73 88.6 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.987 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.08 77.81 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.147 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -42.92 95.97 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.614 -0.267 . . . . 0.0 110.887 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.98 -32.77 73.41 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.91 -44.22 70.11 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.713 -0.221 . . . . 0.0 110.795 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 7.0 ptm -69.38 -34.67 74.88 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.359 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.09 -42.38 17.48 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.074 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.731 0.3 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -62.08 -43.84 97.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.901 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.41 HD22 ' O ' ' A' ' 61' ' ' TYR . 0.8 OUTLIER -58.87 -36.83 75.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.092 179.33 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt -61.47 -34.79 76.05 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.956 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 47.7 t -62.38 -39.21 92.45 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.881 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 84.4 m -59.68 -38.57 81.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.881 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.2 t -58.0 -39.5 78.43 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.946 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.75 -38.09 93.37 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.37 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.2 mt -66.68 -45.86 87.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-O 120.748 0.308 . . . . 0.0 110.38 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.9 -35.52 80.32 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.802 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mtpp -58.38 -28.2 64.94 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.712 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -58.71 -36.45 74.27 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.585 0.231 . . . . 0.0 110.68 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.462 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 6.6 mtt -59.56 -37.23 77.89 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.556 179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.67 1.9 38.1 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 179.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.22 19.5 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.647 0.26 . . . . 0.0 111.637 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 mmtt 68.62 28.59 5.72 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.304 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.2 mttt -116.1 -31.25 5.75 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.967 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 29.95 1.3 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.801 0.334 . . . . 0.0 110.805 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 13' ' ' MET . . . -78.15 -36.63 47.42 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.123 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.35 -31.36 69.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.264 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CE1' ' HD3' ' A' ' 94' ' ' LYS . 23.8 m-85 -86.23 -29.81 22.86 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.584 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.646 ' HB2' HD21 ' A' ' 95' ' ' LEU . . . -113.24 23.25 13.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.584 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 1.5 t90 -62.77 -53.91 52.05 Favored Pre-proline 0 N--CA 1.466 0.35 0 O-C-N 122.481 -0.137 . . . . 0.0 110.913 179.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 92.4 Cg_endo -83.94 -16.77 6.2 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.634 2.223 . . . . 0.0 113.539 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -101.8 33.54 2.97 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.634 0.254 . . . . 0.0 111.61 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -107.27 -46.07 3.96 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.054 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -85.62 161.21 51.61 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.235 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -68.73 166.47 26.03 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.837 2.358 . . . . 0.0 112.743 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.561 HG21 ' CZ ' ' A' ' 39' ' ' TYR . 9.8 m -90.43 82.41 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.152 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . 66.4 m-20 -59.74 105.1 0.34 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.053 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 36' ' ' LEU . 12.3 p -61.37 -40.34 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.744 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -72.22 -45.06 61.82 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . . . -71.27 -48.43 51.02 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.428 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.432 HD13 HD21 ' A' ' 36' ' ' LEU . 12.1 mt -80.75 -21.74 40.81 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.26 52.19 18.81 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.476 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.432 HD21 HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -128.17 75.74 1.64 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.97 0.414 . . . . 0.0 111.346 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.26 -11.47 60.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.409 179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -17.42 59.45 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.458 0.169 . . . . 0.0 111.458 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.561 ' CZ ' HG21 ' A' ' 29' ' ' VAL . 11.5 t80 -55.79 -39.53 71.4 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.501 0.191 . . . . 0.0 111.129 179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 37.6 t -66.37 -36.51 83.06 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.678 0.275 . . . . 0.0 110.65 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.78 -45.02 46.45 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.407 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.9 mt -75.4 -52.97 17.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.706 0.288 . . . . 0.0 111.427 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.412 HD12 ' HB3' ' A' ' 77' ' ' ASN . 30.1 mm -92.2 104.85 16.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.154 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -72.1 -34.15 68.4 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.365 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -114.37 92.37 27.55 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.83 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.34 128.4 18.29 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.677 2.252 . . . . 0.0 112.563 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.86 139.98 14.25 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.384 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.1 164.03 32.49 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.283 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.817 ' HA ' HD12 ' A' ' 52' ' ' ILE . 5.7 mtt -58.05 -36.48 72.83 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.909 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.0 t -61.8 -34.69 76.37 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.63 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.45 -36.47 63.35 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.175 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.817 HD12 ' HA ' ' A' ' 49' ' ' MET . 7.7 mt -68.65 -44.62 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-O 120.676 0.274 . . . . 0.0 110.828 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 7.8 tttt -62.59 -45.37 93.23 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.203 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.5 p -57.59 -39.12 76.08 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.806 -0.179 . . . . 0.0 110.875 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.427 ' HD3' ' CZ ' ' A' ' 61' ' ' TYR . 20.2 tttp -60.35 -48.66 80.77 Favored 'General case' 0 N--CA 1.462 0.137 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -35.5 81.34 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.318 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -63.32 -37.34 86.88 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.279 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.04 15.23 7.62 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.79 27.42 17.2 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.281 0.232 . . . . 0.0 111.597 -179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -80.84 -34.53 33.76 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 120.725 0.297 . . . . 0.0 110.674 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.427 ' CZ ' ' HD3' ' A' ' 55' ' ' LYS . 3.3 m-85 -77.4 93.37 4.06 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.489 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.0 mtt85 -65.42 -28.87 69.55 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.808 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -159.27 174.08 15.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.861 0.362 . . . . 0.0 111.366 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.39 -10.39 59.68 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.888 179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -62.99 -47.65 82.23 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.569 0.223 . . . . 0.0 110.614 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -72.97 -39.22 66.31 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.579 179.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.698 ' O ' HG23 ' A' ' 71' ' ' VAL . 2.9 t80 -58.41 -53.7 55.31 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.88 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.27 -36.21 90.24 Favored Glycine 0 C--N 1.334 0.424 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.446 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.31 96.43 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.606 0.241 . . . . 0.0 110.986 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.98 -37.21 69.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.226 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 67' ' ' PHE . 22.7 t -64.11 -48.46 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.384 0.135 . . . . 0.0 111.272 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -64.7 -32.87 74.73 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.734 -0.212 . . . . 0.0 111.2 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.25 -47.13 74.73 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.806 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttm -59.3 -44.34 92.53 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.228 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -58.01 -42.26 84.86 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.046 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.06 -45.47 90.7 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.93 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.412 ' HB3' HD12 ' A' ' 43' ' ' ILE . 46.5 m-20 -74.73 -33.09 62.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.121 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -39.29 79.69 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.985 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -64.56 -32.18 73.72 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -67.88 -36.46 80.29 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.801 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -82.39 -38.15 24.53 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.333 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.879 ' HB3' HG22 ' A' ' 89' ' ' VAL . 42.2 m-20 -63.56 111.12 4.55 Favored Pre-proline 0 N--CA 1.466 0.357 0 CA-C-N 116.64 -0.254 . . . . 0.0 111.21 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.496 ' O ' HG21 ' A' ' 89' ' ' VAL . 23.6 Cg_exo -64.62 145.91 87.94 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.941 2.427 . . . . 0.0 112.513 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 43.8 Cg_exo -56.14 135.96 72.65 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.662 2.241 . . . . 0.0 112.384 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 t70 60.27 60.04 2.15 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.141 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.754 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.7 t60 -130.66 151.93 50.57 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.94 -43.97 86.65 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.158 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.613 HG22 ' HD2' ' A' ' 86' ' ' HIS . 27.0 m -62.51 -32.15 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.599 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.879 HG22 ' HB3' ' A' ' 82' ' ' ASN . 34.5 t -62.77 -45.36 99.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.645 -0.252 . . . . 0.0 110.695 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.91 -41.2 86.69 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.603 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.2 mtt -65.74 -43.39 89.13 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.745 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.58 -47.74 78.9 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.212 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -63.01 -48.92 76.71 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.829 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.434 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 36.0 tttp -62.48 -41.52 98.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.822 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.646 HD21 ' HB2' ' A' ' 22' ' ' ALA . 1.6 mt -63.47 -36.09 82.6 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.695 179.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -70.06 -44.28 69.47 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.765 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -61.17 -46.81 88.98 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.239 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 9.6 p -64.73 -42.77 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.922 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -51.32 62.7 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.436 0.16 . . . . 0.0 110.787 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -46.25 87.83 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.998 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -46.28 90.26 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.839 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -67.07 -43.98 81.24 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.822 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.14 -42.47 94.89 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.82 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.58 -32.84 74.65 Favored 'General case' 0 CA--C 1.527 0.073 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -71.52 -44.17 65.14 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.084 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 4.7 ptm -69.28 -36.06 76.68 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.723 -0.217 . . . . 0.0 111.322 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.5 -41.56 21.53 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.747 -0.206 . . . . 0.0 110.863 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.987 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.744 0.307 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -61.38 -43.44 98.86 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.856 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.99 -40.54 95.1 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.725 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.04 -34.6 78.44 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.144 179.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.62 -38.15 86.33 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.737 0.303 . . . . 0.0 110.775 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 85.0 m -64.52 -37.37 87.31 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.314 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.0 p -58.5 -40.99 84.36 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.7 -0.227 . . . . 0.0 111.147 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -63.07 -45.87 94.58 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.073 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.2 mt -64.28 -45.56 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 120.718 0.294 . . . . 0.0 110.29 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.692 HD22 ' HE3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -63.34 -35.53 80.69 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.641 179.093 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.2 ttmm -58.15 -27.88 64.2 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.443 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -58.31 -36.33 73.2 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.406 0.146 . . . . 0.0 110.859 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 14.9 mmt -57.46 -37.54 73.03 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.499 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -107.92 10.78 28.39 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.65 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -91.46 11.21 24.71 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 75.2 26.9 1.16 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 122.578 0.351 . . . . 0.0 111.196 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.3 mttt -121.51 -34.89 3.35 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.41 ' CD2' ' HB2' ' A' ' 21' ' ' TYR . 0.8 OUTLIER -132.83 22.82 4.23 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.622 0.249 . . . . 0.0 111.016 179.58 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.97 -36.2 72.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.992 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.34 -36.41 66.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.215 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.41 ' HB2' ' CD2' ' A' ' 18' ' ' HIS . 8.8 m-85 -75.84 -35.36 59.98 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.39 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB2' HD21 ' A' ' 95' ' ' LEU . . . -106.57 23.49 14.15 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -54.59 5.35 Favored Pre-proline 0 N--CA 1.464 0.237 0 CA-C-N 116.923 -0.126 . . . . 0.0 111.244 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -85.59 12.6 3.0 Favored 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.621 2.214 . . . . 0.0 113.23 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -130.53 56.13 1.78 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.03 0.443 . . . . 0.0 110.785 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -131.19 -48.82 1.0 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.051 179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -64.77 154.08 86.38 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-O 120.599 0.238 . . . . 0.0 111.07 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.72 179.12 6.81 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.851 2.368 . . . . 0.0 112.737 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.7 m -92.57 68.9 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.018 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -59.49 98.97 0.05 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.067 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.11 -37.1 77.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.749 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.11 -45.83 59.07 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 111.584 0.216 . . . . 0.0 111.584 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -72.61 -47.71 45.58 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 mt -80.94 -21.56 40.35 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.65 50.35 49.26 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.385 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -121.33 63.2 0.89 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.438 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -62.25 -18.2 60.54 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.448 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -76.06 -19.72 58.36 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.58 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -54.81 -39.11 68.14 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.617 0.246 . . . . 0.0 110.939 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -65.04 -40.44 94.81 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.8 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.46 -43.13 91.32 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.845 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.0 mt -70.31 -45.4 75.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.965 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.516 HD13 ' HB2' ' A' ' 77' ' ' ASN . 7.7 mt -127.45 111.7 25.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.951 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 pttt -72.25 -29.86 64.32 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.358 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -118.68 66.96 7.36 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 110.784 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.82 156.42 39.39 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.769 2.313 . . . . 0.0 112.546 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.8 tpp -158.89 160.34 36.01 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.17 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -148.21 166.06 29.05 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.51 -37.3 70.25 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.1 t -65.67 -41.33 92.59 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.401 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -65.04 -41.03 95.59 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.047 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.502 HG23 ' OH ' ' A' ' 61' ' ' TYR . 18.0 mt -67.57 -44.9 86.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.9 179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.692 ' HE3' HD22 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -62.45 -34.85 77.62 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.979 179.673 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.5 t -57.55 -42.23 82.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.041 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.75 -48.02 83.66 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.797 0.332 . . . . 0.0 110.177 179.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.3 tp -64.7 -33.69 76.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.844 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.23 -41.49 98.46 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.415 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.84 15.24 10.17 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 59.11 27.39 16.35 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.651 0.263 . . . . 0.0 111.551 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.42 -32.22 58.36 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.706 0.289 . . . . 0.0 110.687 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.502 ' OH ' HG23 ' A' ' 52' ' ' ILE . 1.8 m-85 -71.02 100.19 1.95 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.69 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.3 ttp85 -63.42 -31.54 72.72 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.141 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -162.65 174.56 12.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.826 0.346 . . . . 0.0 111.42 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.53 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -69.83 -14.55 62.81 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.885 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -46.61 87.51 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.663 0.268 . . . . 0.0 110.394 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.68 -35.48 72.83 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.013 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.412 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 3.3 t80 -61.88 -52.07 65.61 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -56.41 -33.36 61.85 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.631 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.76 -44.51 96.01 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.562 0.22 . . . . 0.0 111.165 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.402 ' HB3' HG12 ' A' ' 52' ' ' ILE . 1.1 m-20 -63.55 -36.68 84.58 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.423 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.4 t -63.06 -48.39 88.09 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 120.713 0.292 . . . . 0.0 110.789 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.1 mmp_? -64.96 -40.15 94.56 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.621 179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -41.88 95.32 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.753 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.1 ttp -62.71 -46.61 87.3 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.556 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.82 -36.21 74.15 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.795 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 38.5 m -60.57 -47.48 86.01 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.044 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.516 ' HB2' HD13 ' A' ' 43' ' ' ILE . 12.2 p30 -75.99 -31.55 59.02 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 121.096 -0.242 . . . . 0.0 111.07 179.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.28 -33.58 76.15 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.219 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -58.53 -37.29 75.35 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.534 0.207 . . . . 0.0 111.28 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -72.61 -39.71 67.07 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -78.24 -38.48 42.86 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.721 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.8 m-20 -62.53 128.13 91.08 Favored Pre-proline 0 N--CA 1.465 0.295 0 CA-C-O 120.554 0.216 . . . . 0.0 111.073 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.461 ' O ' HG21 ' A' ' 89' ' ' VAL . 72.6 Cg_endo -76.68 135.5 16.14 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.602 2.201 . . . . 0.0 112.392 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 83' ' ' PRO . 36.8 Cg_exo -57.39 128.16 28.4 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.741 2.294 . . . . 0.0 112.406 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.0 t0 65.53 71.7 0.43 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.154 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.74 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.8 t60 -141.65 148.21 38.78 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.077 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -56.6 -43.08 79.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.364 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.649 HG22 ' CD2' ' A' ' 86' ' ' HIS . 26.8 m -62.06 -35.74 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.13 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.74 HG23 ' HB3' ' A' ' 86' ' ' HIS . 30.0 t -66.4 -45.15 90.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.836 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -58.94 -39.04 80.4 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.814 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 24.8 mtt -63.05 -43.29 99.04 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.728 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.52 -48.61 80.25 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.084 179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.5 mpp_? -54.62 -44.07 72.82 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.679 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -37.95 89.28 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.737 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.424 HD21 ' HB2' ' A' ' 22' ' ' ALA . 0.1 OUTLIER -61.7 -37.26 83.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.972 179.571 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.03 -43.98 73.64 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.034 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -61.64 -46.59 89.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.34 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 10.0 p -65.53 -42.77 93.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.079 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.17 -50.32 66.39 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.913 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.55 -43.53 93.5 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.986 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -47.47 85.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.777 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.1 mmp_? -67.86 -39.29 83.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.913 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.53 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 0.2 OUTLIER -65.3 -41.61 93.92 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.103 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.28 -32.91 74.81 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.284 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 4.4 tttp -69.72 -44.54 70.12 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.064 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 8.5 ptm -69.13 -33.38 73.36 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.089 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 12.9 mt -83.75 -41.55 17.5 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.273 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.052 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.684 0.278 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -61.67 -37.57 84.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.846 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.652 HD21 ' O ' ' A' ' 61' ' ' TYR . 3.7 mt -63.58 -46.91 83.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.065 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.19 -42.16 96.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.91 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.54 -44.35 96.57 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.586 ' HA ' HD12 ' A' ' 9' ' ' ILE . 34.5 m -58.96 -39.51 81.94 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.745 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 33.1 t -57.54 -41.13 80.33 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.055 179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.12 94.46 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.578 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.586 HD12 ' HA ' ' A' ' 6' ' ' CYS . 4.2 mt -64.12 -46.25 94.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.719 0.295 . . . . 0.0 110.459 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.6 HD13 ' HG2' ' A' ' 53' ' ' LYS . 5.7 mt -62.75 -35.83 81.08 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.714 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -33.45 69.31 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.333 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 1.4 tt0 -58.55 -36.65 74.24 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.212 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.45 -36.98 72.11 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.699 -0.228 . . . . 0.0 110.431 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -110.67 12.62 22.6 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.478 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -96.71 17.86 15.6 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.724 0.297 . . . . 0.0 111.307 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 72.21 25.25 2.94 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.372 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB2' ' HG2' ' A' ' 12' ' ' GLU . 15.4 mtmt -118.69 -34.33 4.01 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.09 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.449 ' NE2' HG11 ' A' ' 98' ' ' VAL . 1.3 m-70 -132.42 21.72 4.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.001 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.8 -34.69 67.06 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.448 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.05 -40.28 68.45 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.744 0.306 . . . . 0.0 111.09 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -73.51 -34.21 65.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -111.62 28.69 8.51 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.483 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.2 OUTLIER -68.33 -52.16 22.28 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.706 -0.225 . . . . 0.0 111.19 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 95.4 Cg_endo -85.5 11.15 3.44 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.554 2.17 . . . . 0.0 113.02 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -129.93 55.34 1.79 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.03 0.443 . . . . 0.0 110.825 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.86 -63.95 0.56 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.004 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 0.1 OUTLIER -65.74 143.41 98.55 Favored Pre-proline 0 CA--C 1.531 0.241 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.834 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 46.5 Cg_exo -57.31 156.66 24.65 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.91 2.407 . . . . 0.0 112.864 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.1 m -95.32 84.09 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.037 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.5 106.56 0.79 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.028 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG23 ' C ' ' A' ' 36' ' ' LEU . 14.7 p -61.46 -38.42 80.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.621 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -72.3 -44.44 62.73 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.611 0.243 . . . . 0.0 111.483 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.88 -48.73 43.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.3 mt -81.12 -21.54 39.79 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 57.19 7.37 Favored Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.424 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.423 ' C ' HG23 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -126.34 64.04 1.25 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.04 0.448 . . . . 0.0 111.303 -179.83 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -67.63 -13.06 61.76 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.67 179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.23 -20.08 57.77 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.404 0.145 . . . . 0.0 111.237 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.511 ' CE1' HD13 ' A' ' 43' ' ' ILE . 1.0 OUTLIER -59.66 -35.65 74.85 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 120.557 0.218 . . . . 0.0 110.764 179.351 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.8 t -64.51 -38.68 91.85 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.947 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -67.18 -39.57 86.42 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.571 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.474 HD12 ' CE2' ' A' ' 81' ' ' TYR . 42.8 mt -74.13 -44.58 49.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.991 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.511 HD13 ' CE1' ' A' ' 39' ' ' TYR . 3.5 mp -137.82 137.01 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.656 0.265 . . . . 0.0 111.457 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -93.04 -25.45 17.94 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.804 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.91 79.82 2.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 120.693 0.282 . . . . 0.0 111.181 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.71 153.77 38.74 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.707 2.271 . . . . 0.0 112.697 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.424 ' HB3' ' HG2' ' A' ' 74' ' ' MET . 5.6 ttm -165.64 158.87 15.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.362 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -144.28 163.95 32.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.565 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.6 ttm -54.98 -35.44 64.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.849 179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.8 t -66.88 -40.94 87.93 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.747 179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.7 m -66.83 -40.77 88.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.214 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.411 HD13 HG22 ' A' ' 71' ' ' VAL . 60.5 mt -66.81 -44.06 89.39 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 CA-C-O 120.78 0.324 . . . . 0.0 110.395 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HG2' HD13 ' A' ' 10' ' ' LEU . 0.7 OUTLIER -66.76 -36.61 82.84 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.326 179.602 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.8 p -57.45 -42.31 82.25 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.432 0.16 . . . . 0.0 111.432 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -62.72 -49.55 74.6 Favored 'General case' 0 N--CA 1.461 0.102 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.8 -34.75 76.46 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.585 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -59.44 -40.58 87.24 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.05 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.67 15.34 11.2 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.19 28.37 14.01 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 122.303 0.241 . . . . 0.0 111.636 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -75.45 -37.35 60.39 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.678 0.275 . . . . 0.0 110.84 179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.652 ' O ' HD21 ' A' ' 3' ' ' LEU . 7.1 m-85 -75.88 97.46 3.95 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.542 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -78.12 -31.85 50.11 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.196 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -126.55 142.59 51.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.816 0.341 . . . . 0.0 111.105 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.03 -19.36 64.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.844 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -47.98 80.85 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 120.677 0.275 . . . . 0.0 110.543 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -62.31 -38.26 88.75 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.777 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.465 ' HZ ' HD11 ' A' ' 10' ' ' LEU . 30.2 t80 -59.43 -53.85 53.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.88 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.78 87.74 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.711 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.2 74.72 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.571 0.224 . . . . 0.0 111.197 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -73.61 -39.93 64.2 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.312 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 67' ' ' PHE . 29.7 t -63.67 -48.41 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-O 120.683 0.278 . . . . 0.0 110.646 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -64.95 -39.1 92.98 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.755 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.81 -46.07 83.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.671 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.424 ' HG2' ' HB3' ' A' ' 47' ' ' MET . 4.8 tpp -65.49 -41.73 92.93 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.353 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -55.9 -44.96 78.73 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 110.752 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.6 t -62.2 -40.69 96.9 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.733 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.418 ' HB3' HG12 ' A' ' 43' ' ' ILE . 80.6 m-20 -68.03 -46.04 72.29 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.059 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.23 -35.48 79.03 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.465 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.38 -33.46 67.85 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.883 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.468 ' HD3' HG23 ' A' ' 42' ' ' ILE . 5.4 tttp -64.87 -36.74 85.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.584 179.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.474 ' CE2' HD12 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -80.93 -37.41 29.59 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.162 179.524 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.451 ' HB3' HG22 ' A' ' 89' ' ' VAL . 21.9 m120 -61.14 111.16 3.78 Favored Pre-proline 0 N--CA 1.469 0.486 0 CA-C-O 120.488 0.185 . . . . 0.0 111.076 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -61.46 163.81 16.95 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.859 2.373 . . . . 0.0 112.505 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.37 151.14 65.43 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.644 2.229 . . . . 0.0 112.401 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 53.22 49.29 20.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.408 179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.717 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.9 t-80 -116.25 141.31 48.32 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.828 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -41.18 75.71 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.977 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 14.1 m -59.68 -32.79 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.578 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.717 HG23 ' HB3' ' A' ' 86' ' ' HIS . 32.9 t -65.71 -44.45 93.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.702 0.287 . . . . 0.0 110.574 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -63.94 -39.32 93.87 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.876 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 11.8 mtt -61.28 -42.95 99.51 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.959 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.64 -44.66 81.5 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.269 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.68 -47.04 87.13 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -65.85 -40.22 91.5 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.2 mt -63.69 -38.79 92.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.962 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -70.16 -41.51 73.71 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.782 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -61.36 -46.86 88.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.143 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.449 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.3 p -66.06 -43.05 92.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.012 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -63.68 -50.14 70.38 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.722 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.9 -43.21 94.96 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.981 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.12 -47.86 84.15 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.635 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -43.02 87.07 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.682 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.402 ' HA ' ' HG2' ' A' ' 106' ' ' MET . 0.1 OUTLIER -59.64 -41.92 91.58 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.064 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.03 -37.08 80.95 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.907 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -67.07 -44.78 79.23 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.402 ' HG2' ' HA ' ' A' ' 103' ' ' PHE . 7.4 ptm -69.53 -33.46 72.83 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.256 179.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 19.1 mt -81.37 -42.1 20.97 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.356 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.406 179.834 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.762 0.315 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -66.62 -35.14 79.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.877 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.478 HD21 ' O ' ' A' ' 61' ' ' TYR . 11.1 mt -61.03 -44.48 97.34 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.78 179.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -35.21 70.85 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.116 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -39.3 84.33 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.653 0.264 . . . . 0.0 110.83 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.3 m -63.1 -37.74 88.41 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.34 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.1 p -57.39 -33.72 68.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.642 -0.253 . . . . 0.0 111.129 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.44 -43.05 97.77 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.325 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 48.9 mt -64.03 -42.45 95.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-O 120.915 0.388 . . . . 0.0 110.498 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.2 mt -63.74 -35.65 81.28 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.698 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -30.8 67.19 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.748 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -58.61 -36.72 74.48 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.296 0.093 . . . . 0.0 111.173 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -37.63 76.29 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.651 0.262 . . . . 0.0 110.492 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.08 6.45 35.93 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.47 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.486 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -91.04 13.67 16.14 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.566 0.222 . . . . 0.0 111.515 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 72.64 23.44 3.01 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.474 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.9 mtmm -115.33 -33.69 5.22 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.945 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.454 ' O ' ' HB3' ' A' ' 22' ' ' ALA . 3.0 m-70 -126.27 20.07 7.48 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.131 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.14 -33.98 61.6 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.62 67.52 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.333 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.401 ' CE2' ' HD3' ' A' ' 94' ' ' LYS . 6.8 m-85 -83.5 -32.66 25.82 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.381 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 18' ' ' HIS . . . -104.45 24.06 12.25 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -56.79 13.08 Favored Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.788 -0.187 . . . . 0.0 110.87 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -78.17 -4.17 14.08 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.536 2.158 . . . . 0.0 113.167 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -113.76 45.12 1.5 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.734 0.302 . . . . 0.0 110.998 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -128.79 -56.84 1.19 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.947 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . 3.0 pttp -77.37 130.85 73.29 Favored Pre-proline 0 C--O 1.232 0.175 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.905 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 36.7 Cg_exo -60.52 -177.56 0.17 Allowed 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.858 2.372 . . . . 0.0 112.637 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 29' ' ' VAL . 29.4 m -123.93 77.09 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.062 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.716 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -56.21 106.29 0.26 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.728 179.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 36' ' ' LEU . 11.4 p -59.28 -40.11 80.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.672 -179.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -72.36 -46.8 53.8 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.716 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . . . -71.25 -47.66 55.8 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.4 mt -81.59 -21.33 38.45 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.74 63.82 2.76 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.373 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -114.18 70.07 0.72 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.76 0.314 . . . . 0.0 111.132 -179.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 16.9 m170 -65.62 -12.83 56.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.417 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.87 -19.96 21.16 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.534 0.207 . . . . 0.0 111.186 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -38.34 87.0 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.102 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.92 -31.59 72.83 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.001 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -78.43 -47.2 18.02 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.753 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.2 mt -69.88 -38.76 76.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.321 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.534 HG23 HD22 ' A' ' 77' ' ' ASN . 32.2 mm -124.85 128.28 73.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.496 -179.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -34.96 19.78 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.289 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -128.14 77.28 77.0 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-O 120.796 0.331 . . . . 0.0 111.004 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.83 128.45 15.06 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.779 2.319 . . . . 0.0 112.562 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 44.5 mtp -145.66 139.5 26.63 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.251 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -123.71 171.05 9.89 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.189 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 2.3 mtm -57.77 -43.11 85.27 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.198 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.404 ' HB3' ' HG3' ' A' ' 28' ' ' PRO . 0.7 OUTLIER -62.0 -39.65 92.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.788 179.594 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.2 m -64.36 -44.46 91.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.646 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.419 HG23 ' OH ' ' A' ' 61' ' ' TYR . 15.2 mt -65.32 -44.31 94.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.433 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.87 73.58 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.2 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.5 p -57.48 -41.4 80.58 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.832 -0.167 . . . . 0.0 111.124 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -60.59 -49.63 76.75 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.02 -34.57 76.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.361 178.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.26 -37.18 86.23 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.997 179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.55 15.29 9.65 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 62.45 28.44 16.8 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -76.99 -36.95 56.05 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.647 179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.478 ' O ' HD21 ' A' ' 3' ' ' LEU . 28.9 m-85 -79.42 100.62 7.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.893 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 ttt-85 -64.91 -31.62 72.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -159.54 -177.44 6.4 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.931 0.396 . . . . 0.0 111.357 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.627 ' HB1' ' HZ ' ' A' ' 103' ' ' PHE . . . -71.29 -12.67 61.57 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.788 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -47.37 83.64 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.671 0.272 . . . . 0.0 110.669 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -73.5 -37.64 65.63 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.717 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.521 ' O ' HG23 ' A' ' 71' ' ' VAL . 1.9 t80 -61.35 -53.04 61.8 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.031 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -59.94 -33.29 78.15 Favored Glycine 0 C--N 1.335 0.516 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.663 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.61 91.26 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.623 0.249 . . . . 0.0 111.108 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.34 -33.9 70.03 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.364 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 67' ' ' PHE . 38.9 t -63.38 -48.47 87.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.623 0.249 . . . . 0.0 110.906 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.3 mtt180 -61.12 -36.81 80.71 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.847 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tp -61.67 -44.68 96.49 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.764 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.2 ttm -63.68 -46.75 84.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.176 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -58.38 -43.9 88.69 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.153 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.2 t -60.55 -43.25 97.42 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.041 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.534 HD22 HG23 ' A' ' 43' ' ' ILE . 6.2 m120 -73.47 -46.72 46.46 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.117 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -34.0 72.8 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.238 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -57.12 -35.87 69.99 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.014 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 20.4 tttp -66.5 -41.97 88.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.846 179.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -76.06 -31.26 58.7 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.297 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -91.9 102.59 6.38 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.257 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.599 ' O ' HG21 ' A' ' 89' ' ' VAL . 55.2 Cg_endo -69.12 133.4 26.64 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.617 2.211 . . . . 0.0 112.24 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -57.52 165.38 6.05 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.725 2.283 . . . . 0.0 112.674 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.36 31.22 8.46 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.02 -179.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.472 ' HB3' HG23 ' A' ' 89' ' ' VAL . 0.9 OUTLIER -127.5 142.6 51.35 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.943 -179.817 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -56.73 -37.55 71.14 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.101 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.2 p -61.8 -40.22 86.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.389 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.599 HG21 ' O ' ' A' ' 83' ' ' PRO . 24.0 t -67.49 -39.95 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.82 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -56.28 -34.34 66.35 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.81 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -47.43 83.66 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.406 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.83 -44.73 96.26 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 179.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -42.83 87.88 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.509 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.401 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 2.8 tttp -66.36 -41.91 88.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.585 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.54 -36.46 84.3 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.957 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.95 -46.95 64.18 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.883 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -46.68 89.31 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 18' ' ' HIS . 9.9 p -62.61 -43.0 98.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.51 0.195 . . . . 0.0 110.775 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -49.22 70.86 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.401 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -41.29 94.12 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.957 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.0 mtm -61.23 -47.76 84.61 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.434 179.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -43.82 81.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.631 179.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.627 ' HZ ' ' HB1' ' A' ' 64' ' ' ALA . 0.7 OUTLIER -59.27 -50.98 71.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.805 179.536 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.01 -37.99 89.4 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.1 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.9 mtpt -69.48 -41.35 76.27 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.738 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -44.93 75.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.211 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.51 -41.69 60.23 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.725 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.796 -0.621 . . . . 0.0 111.108 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.789 0.328 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -60.9 -36.86 80.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.848 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.91 -43.72 91.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.93 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt -67.7 -40.66 84.3 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.142 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.39 -38.16 88.55 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.085 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.9 m -60.21 -38.93 84.84 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.935 179.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -60.87 -37.0 80.65 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.019 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.3 -36.92 90.92 Favored Glycine 0 C--N 1.337 0.592 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.54 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.431 HG23 ' CD ' ' A' ' 102' ' ' ARG . 54.4 mt -64.13 -45.91 95.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 179.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.635 HD22 ' HE3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -62.67 -35.35 79.39 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.839 179.225 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -57.62 -32.55 67.34 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.496 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.477 ' CG ' ' HD2' ' A' ' 17' ' ' LYS . 5.6 tt0 -60.32 -36.66 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.386 0.136 . . . . 0.0 110.954 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.52 ' HE1' HD22 ' A' ' 95' ' ' LEU . 4.8 mtt -59.27 -37.0 76.54 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -102.93 4.79 37.94 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' A' ' 12' ' ' GLU . . . -90.01 12.92 16.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 77.96 24.09 0.72 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.858 0.463 . . . . 0.0 111.43 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HD2' ' CG ' ' A' ' 12' ' ' GLU . 54.0 mttp -113.79 -32.7 6.04 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.827 179.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.414 ' NE2' HG11 ' A' ' 98' ' ' VAL . 0.4 OUTLIER -137.76 25.81 2.8 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.878 179.226 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.68 -40.26 23.08 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.204 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.09 -36.21 81.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.237 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -77.71 -33.38 53.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.394 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -112.06 25.99 11.03 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.464 ' HB3' ' HD3' ' A' ' 24' ' ' PRO . 0.0 OUTLIER -69.37 -56.6 8.15 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-N 116.929 -0.123 . . . . 0.0 110.938 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 23' ' ' TRP . 86.4 Cg_endo -81.82 -22.96 4.98 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.473 2.115 . . . . 0.0 112.987 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -98.12 35.52 1.73 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.639 0.257 . . . . 0.0 111.567 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.53 -38.42 6.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.829 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.5 mmtt -74.86 156.14 86.5 Favored Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.359 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.8 -172.32 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.921 2.414 . . . . 0.0 112.682 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.854 HG21 ' CE2' ' A' ' 39' ' ' TYR . 30.8 m -120.57 68.82 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 121.12 0.486 . . . . 0.0 111.612 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.473 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . 2.0 m-20 -62.85 108.4 1.18 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.977 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 36' ' ' LEU . 9.7 p -60.84 -40.75 86.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.534 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.19 -44.97 62.18 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.473 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . . . -71.51 -48.87 46.09 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -179.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 23.4 mt -81.09 -21.67 39.78 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.52 61.78 3.73 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.447 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.624 ' O ' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -133.45 78.65 1.79 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.935 0.398 . . . . 0.0 111.244 -179.884 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -7.66 46.1 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.867 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.22 -19.92 57.93 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.439 0.161 . . . . 0.0 111.284 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.854 ' CE2' HG21 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -59.89 -44.72 94.08 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.853 179.592 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 22.4 t -61.21 -39.46 90.32 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.933 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.94 -35.29 80.18 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.729 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.555 HG22 HG13 ' A' ' 43' ' ' ILE . 17.4 mt -80.71 -49.65 18.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.168 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.887 HD12 ' CE2' ' A' ' 81' ' ' TYR . 26.5 mt -147.75 132.89 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.1 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.7 pttt -86.18 -20.08 29.11 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.753 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.53 ' H ' HG22 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -107.46 86.03 2.54 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-O 120.676 0.274 . . . . 0.0 111.044 -179.751 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.2 143.35 39.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.769 2.313 . . . . 0.0 112.691 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -151.69 122.9 7.71 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.114 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -130.99 162.75 29.08 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.146 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.5 mtm -55.78 -40.85 73.24 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.37 -41.76 98.82 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.769 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 m -64.08 -40.94 97.35 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.986 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.411 HG23 ' OH ' ' A' ' 61' ' ' TYR . 12.4 mt -70.58 -45.15 75.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.078 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.635 ' HE3' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -66.39 -38.39 87.41 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.026 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.6 t -57.32 -41.34 79.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.844 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.1 mtmm -60.49 -48.36 82.09 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 16.3 tp -64.26 -34.46 78.16 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -63.48 -39.56 94.79 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.311 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -89.22 15.21 9.28 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.5 27.14 16.78 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -75.5 -34.09 60.81 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.724 0.297 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.484 ' CZ ' ' HA ' ' A' ' 67' ' ' PHE . 5.2 m-85 -71.06 104.65 3.08 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.581 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -28.69 66.63 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.34 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -159.71 167.94 27.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.769 0.319 . . . . 0.0 111.286 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.85 -21.4 63.36 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.515 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -62.78 -42.68 99.8 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.657 0.265 . . . . 0.0 110.558 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -70.85 -33.18 70.39 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.817 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.484 ' HA ' ' CZ ' ' A' ' 61' ' ' TYR . 15.3 t80 -62.48 -48.34 80.03 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.527 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.89 -32.91 81.37 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.622 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -60.66 -44.2 96.71 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.613 0.244 . . . . 0.0 111.152 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.76 -33.46 75.72 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.2 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.27 -46.64 92.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.723 0.297 . . . . 0.0 110.575 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.8 mtt180 -63.35 -39.51 94.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.714 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.1 tt -70.67 -43.33 69.33 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.794 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 9.0 tmm? -60.42 -44.69 95.5 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.012 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 96' ' ' GLN . 4.2 m-85 -59.15 -40.66 86.24 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.984 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.4 m -62.33 -44.6 96.12 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -71.43 -40.34 70.49 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.903 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.19 -38.0 84.97 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.035 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.84 -40.11 95.82 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.054 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.5 ttpt -75.14 -36.11 61.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.865 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.887 ' CE2' HD12 ' A' ' 43' ' ' ILE . 3.8 m-85 -69.07 -35.3 76.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.503 ' HB3' HG22 ' A' ' 89' ' ' VAL . 8.5 m120 -82.01 136.84 46.86 Favored Pre-proline 0 N--CA 1.463 0.184 0 CA-C-O 120.63 0.253 . . . . 0.0 110.909 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.453 ' O ' HG21 ' A' ' 89' ' ' VAL . 72.5 Cg_endo -76.22 131.21 12.71 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.711 2.274 . . . . 0.0 112.368 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -57.27 147.43 76.79 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.604 2.202 . . . . 0.0 112.545 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 t70 63.22 46.43 4.56 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.375 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.637 ' HB3' HG23 ' A' ' 89' ' ' VAL . 3.9 t-80 -128.02 148.28 50.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -44.01 80.54 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.469 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.7 p -58.85 -35.19 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.49 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.637 HG23 ' HB3' ' A' ' 86' ' ' HIS . 21.7 t -61.0 -43.67 96.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.902 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.35 76.0 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.916 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.23 88.83 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.773 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.8 -42.0 97.79 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.131 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.519 ' HD2' HG12 ' A' ' 89' ' ' VAL . 11.1 mtt180 -59.6 -43.96 93.56 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.687 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -61.51 -42.07 98.25 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.882 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.52 HD22 ' HE1' ' A' ' 13' ' ' MET . 87.3 mt -63.6 -30.92 71.97 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.082 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 75' ' ' PHE . 0.0 OUTLIER -70.02 -42.39 73.03 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.938 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -60.71 -46.83 88.9 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.065 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.414 HG11 ' NE2' ' A' ' 18' ' ' HIS . 10.1 p -66.79 -43.0 90.09 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.002 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.8 -50.98 66.81 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.881 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -41.96 79.11 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.81 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -48.16 76.85 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.029 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.431 ' CD ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -66.84 -44.13 81.88 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.259 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.44 -49.34 69.55 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.802 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.36 -42.48 91.67 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.046 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 15.8 tttp -66.5 -42.22 87.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.919 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -67.87 -44.44 77.08 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.064 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.57 -40.1 61.85 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.647 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.478 -0.772 . . . . 0.0 111.008 -179.725 . . . . . . . . 0 0 . 1 stop_ save_