data_2hx6_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 2hx6 _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 ' 4' ' ' ASN . . . . . 0.436 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 2.3 t-20 . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 117.743 2.497 . . . . 0.0 117.743 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -58.76 6.66 Favored 'General case' 0 N--CA 1.445 -0.715 1 C-N-CA 132.95 4.5 . . . . 0.0 112.274 169.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.84 -25.87 62.14 Favored 'General case' 0 C--N 1.37 1.469 0 C-N-CA 126.907 2.083 . . . . 0.0 113.065 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.436 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.9 OUTLIER -77.01 -39.52 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.947 0 C-N-CA 129.721 3.208 . . . . 0.0 112.551 176.698 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.41 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 27.3 t80 -65.36 -45.05 85.69 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 129.039 2.935 . . . . 0.0 109.611 175.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.3 -43.73 86.72 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 126.625 1.97 . . . . 0.0 110.99 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' HE ' HD12 ' A' ' 58' ' ' ILE 0.257 9.2 ttp-105 -66.34 -47.32 73.84 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.8 mtm180 -61.17 -27.63 68.55 Favored 'General case' 0 C--N 1.377 1.762 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 167.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -77.12 -48.75 16.89 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 128.691 2.796 . . . . 0.0 110.139 173.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.526 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 27.6 mmtt -57.8 -28.44 64.02 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 127.529 2.331 . . . . 0.0 110.573 169.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.501 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.3 OUTLIER -66.68 -49.07 67.31 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.519 166.271 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 39.2 ttt85 -55.81 -34.68 65.55 Favored 'General case' 0 C--N 1.353 0.742 0 CA-C-N 121.15 1.795 . . . . 0.0 115.21 169.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.526 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.289 0.1 OUTLIER -73.7 -37.04 65.31 Favored 'General case' 0 C--N 1.386 2.17 0 O-C-N 120.065 -1.647 . . . . 0.0 113.812 170.088 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.13 -44.27 97.59 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 129.063 2.945 . . . . 0.0 111.041 172.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.429 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -61.17 -52.59 64.18 Favored 'General case' 0 C--N 1.371 1.508 1 C-N-CA 132.003 4.121 . . . . 0.0 110.315 175.598 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -74.56 -39.53 62.22 Favored 'General case' 0 C--N 1.373 1.608 0 N-CA-C 118.218 2.673 . . . . 0.0 118.218 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.411 ' HA ' ' HG3' ' A' ' 23' ' ' ARG . 7.4 t -73.16 -40.52 64.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.024 1.73 . . . . 0.0 112.18 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.307 4.1 mp0 -75.95 -28.92 58.12 Favored 'General case' 0 C--N 1.355 0.812 0 O-C-N 118.637 -2.539 . . . . 0.0 110.41 171.961 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.339 0.3 OUTLIER -65.18 -31.21 72.27 Favored 'General case' 0 C--N 1.384 2.077 0 O-C-N 119.824 -1.797 . . . . 0.0 113.688 166.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.411 ' HG3' ' HA ' ' A' ' 20' ' ' SER 0.394 0.0 OUTLIER -66.36 -35.49 80.49 Favored 'General case' 0 C--N 1.382 2.02 0 CA-C-N 119.033 0.833 . . . . 0.0 111.8 166.604 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.506 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 47.2 tt0 -62.55 -45.02 94.85 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 169.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.491 HG12 ' CE1' ' A' ' 68' ' ' HIS . 3.1 mt -69.77 -43.48 79.88 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 O-C-N 120.617 -1.302 . . . . 0.0 113.06 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER -70.34 -26.49 63.77 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 119.379 0.991 . . . . 0.0 113.004 176.205 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -69.41 -39.78 77.72 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 121.109 -0.994 . . . . 0.0 110.166 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HA ' ' HG2' ' A' ' 31' ' ' GLU 0.492 0.0 OUTLIER -67.07 -35.01 78.9 Favored 'General case' 0 C--N 1.403 2.911 0 CA-C-N 120.405 1.457 . . . . 0.0 113.21 168.575 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.422 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.7 mt -61.92 -44.73 99.29 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 120.797 1.635 . . . . 0.0 114.702 174.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -59.96 -47.31 86.31 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 172.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.429 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.1 pt-20 -77.34 -37.45 52.41 Favored 'General case' 0 C--N 1.372 1.553 0 C-N-CA 125.165 1.386 . . . . 0.0 114.265 -176.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.35 -34.01 36.87 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-O 121.638 0.732 . . . . 0.0 112.409 -178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.6 t -71.35 -36.15 71.41 Favored 'General case' 0 C--N 1.365 1.245 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 42.2 mmtt -64.14 -42.42 96.8 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 167.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.38 -32.11 66.14 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 126.881 2.073 . . . . 0.0 113.936 176.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.32 -19.36 58.3 Favored 'General case' 0 C--N 1.375 1.692 0 C-N-CA 125.382 1.473 . . . . 0.0 111.94 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.03 17.7 31.5 Favored Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.272 0.869 . . . . 0.0 115.272 171.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.413 HG21 HD12 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -123.76 147.18 28.24 Favored 'Isoleucine or valine' 0 C--N 1.358 0.974 0 CA-C-O 123.544 1.64 . . . . 0.0 108.998 -178.249 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.277 10.0 t 5.8 -79.88 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.302 1 C-N-CA 132.715 4.406 . . . . 0.0 119.736 -173.777 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.0 m 121.71 124.27 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.689 2 N-CA-C 98.863 -4.495 . . . . 0.0 98.863 -169.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.422 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 10.7 p90 -113.24 142.54 45.69 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -100.7 126.63 47.24 Favored 'General case' 0 C--N 1.361 1.103 0 C-N-CA 125.758 1.623 . . . . 0.0 108.039 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.78 128.29 42.53 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.838 -173.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -139.34 143.97 38.03 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 101.994 -3.335 . . . . 0.0 101.994 177.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.497 ' CD1' HD11 ' A' ' 50' ' ' LEU . 2.4 p90 -131.09 154.39 48.33 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.61 118.79 28.51 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 127.26 2.224 . . . . 0.0 107.585 173.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.476 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.502 0.0 OUTLIER -68.39 -10.32 54.33 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 129.224 3.01 . . . . 0.0 116.936 -174.404 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.64 -41.29 27.3 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 128.09 2.556 . . . . 0.0 111.489 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.46 ' CD1' ' HA ' ' A' ' 133' ' ' MET . 0.1 OUTLIER -59.42 -47.7 84.45 Favored 'General case' 0 C--N 1.375 1.675 0 CA-C-O 127.738 3.637 . . . . 0.0 109.102 170.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.497 HD11 ' CD1' ' A' ' 45' ' ' TYR 0.279 7.0 tt -74.11 -31.58 62.84 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-N 110.567 -3.015 . . . . 0.0 111.116 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -62.34 -34.33 76.44 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 125.821 1.648 . . . . 0.0 109.537 170.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -62.63 -47.86 81.91 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.53 -1.356 . . . . 0.0 113.232 167.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.48 -27.26 65.99 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 117.885 2.55 . . . . 0.0 117.885 171.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.302 0.1 OUTLIER -73.68 -42.93 54.87 Favored 'Isoleucine or valine' 0 C--N 1.347 0.496 0 C-N-CA 129.52 3.128 . . . . 0.0 110.884 178.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -103.2 -26.83 12.84 Favored 'General case' 0 C--N 1.38 1.912 0 N-CA-C 117.079 2.251 . . . . 0.0 117.079 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -87.44 -29.14 21.66 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 119.456 -2.028 . . . . 0.0 111.426 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -124.97 44.05 2.88 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 128.392 2.677 . . . . 0.0 107.491 -172.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.427 HD12 ' HE ' ' A' ' 10' ' ' ARG 0.393 0.5 OUTLIER -56.19 134.32 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 C-N-CA 125.986 1.714 . . . . 0.0 112.419 -177.331 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.501 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 24.9 t70 57.54 21.21 6.85 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 130.822 3.649 . . . . 0.0 113.202 -173.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.493 ' O ' ' HB ' ' A' ' 63' ' ' VAL 0.463 0.7 OUTLIER -73.97 80.52 1.68 Allowed 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.863 2.865 . . . . 0.0 109.626 170.0 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.3 p -82.06 -26.59 33.56 Favored 'General case' 0 N--CA 1.437 -1.089 2 C-N-CA 141.404 7.882 . . . . 0.0 110.92 162.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.94 -33.32 71.75 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 128.008 2.523 . . . . 0.0 109.582 172.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.493 ' HB ' ' O ' ' A' ' 60' ' ' GLU . 3.2 t -43.18 -57.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.993 1 C-N-CA 132.455 4.302 . . . . 0.0 111.572 165.195 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.439 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 47.8 m-85 -62.5 -36.74 83.5 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 131.452 3.901 . . . . 0.0 113.468 172.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -72.98 -45.29 58.82 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 126.259 1.823 . . . . 0.0 111.607 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.407 HD12 HD11 ' A' ' 70' ' ' ILE . 3.2 tm? -63.19 -38.44 91.17 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.559 1.544 . . . . 0.0 113.268 169.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.494 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.974 0.0 OUTLIER -78.27 -17.48 56.6 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 117.742 2.497 . . . . 0.0 117.742 170.739 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.506 ' CE1' ' HB3' ' A' ' 24' ' ' GLN . 25.4 m-70 -84.51 -19.13 33.74 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 129.014 2.926 . . . . 0.0 109.682 171.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -93.74 -27.34 16.55 Favored 'General case' 0 C--N 1.364 1.223 0 C-N-CA 126.434 1.894 . . . . 0.0 107.895 168.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.541 HD13 ' H ' ' A' ' 152' ' ' THR 0.356 0.9 OUTLIER -74.98 -12.13 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 C-N-CA 129.787 3.235 . . . . 0.0 112.684 178.327 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.313 19.2 ptmt -49.49 -35.32 19.45 Favored 'General case' 0 N--CA 1.428 -1.542 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 -169.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.276 26.6 m-20 -78.77 -15.05 58.9 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 127.448 2.299 . . . . 0.0 108.565 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.792 ' CD2' ' HA ' ' A' ' 152' ' ' THR 0.373 0.0 OUTLIER -66.8 -7.08 18.82 Favored 'General case' 0 C--N 1.379 1.859 0 C-N-CA 129.173 2.989 . . . . 0.0 109.379 167.62 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.0 p -43.57 -38.66 1.18 Allowed 'Isoleucine or valine' 1 C--N 1.428 4.016 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 151.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.74 -36.49 81.13 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 129.941 3.296 . . . . 0.0 115.419 172.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.507 ' HA ' ' HG3' ' A' ' 79' ' ' GLU . 71.1 mm-40 -75.26 -38.82 60.32 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 120.211 -1.555 . . . . 0.0 111.442 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.415 0.1 OUTLIER -71.47 -29.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 CA-C-O 124.472 2.082 . . . . 0.0 112.203 171.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.403 HD21 ' HA ' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -70.01 -46.79 64.37 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 127.706 2.402 . . . . 0.0 116.782 168.407 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.507 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.333 0.8 OUTLIER -66.94 -29.51 69.4 Favored 'General case' 0 C--N 1.371 1.517 0 C-N-CA 127.332 2.253 . . . . 0.0 110.288 176.785 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -60.31 -45.66 92.61 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.02 2.528 . . . . 0.0 112.07 163.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 38' ' ' VAL . 3.3 tt . . . . . 0 N--CA 1.502 2.152 0 CA-C-N 122.524 2.42 . . . . 0.0 115.546 168.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.502 0 N-CA-C 117.345 1.698 . . . . 0.0 117.345 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 ptt85 -140.99 160.04 40.93 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 123.194 1.473 . . . . 0.0 110.163 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.4 131.68 54.84 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 127.375 2.27 . . . . 0.0 104.992 177.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -128.53 116.43 19.65 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 -174.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.558 HD11 ' CE1' ' A' ' 73' ' ' HIS . 28.9 mm -122.33 130.15 74.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.009 1.324 . . . . 0.0 109.5 -172.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.4 ' H ' ' C ' ' A' ' 150' ' ' ILE 0.436 10.5 t -139.5 150.84 45.61 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 117.088 -3.508 . . . . 0.0 112.396 178.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.475 ' HB2' ' HB2' ' A' ' 151' ' ' LYS . 0.3 OUTLIER 173.76 164.75 0.18 Allowed 'General case' 0 C--N 1.362 1.129 0 N-CA-C 103.459 -2.793 . . . . 0.0 103.459 162.905 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.416 ' O ' ' HB2' ' A' ' 110' ' ' ASN . . . 43.39 45.97 6.75 Favored Glycine 0 CA--C 1.454 -3.751 0 C-N-CA 129.547 3.451 . . . . 0.0 120.097 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 3.4 m-80 88.43 -9.66 0.49 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 130.057 3.343 . . . . 0.0 114.292 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 63' ' ' VAL . 18.2 tp -102.19 133.52 46.91 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 126.87 2.068 . . . . 0.0 114.819 -177.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -111.78 100.07 8.64 Favored 'General case' 0 C--N 1.366 1.307 0 N-CA-C 101.256 -3.609 . . . . 0.0 101.256 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.252 0.0 OUTLIER -115.36 119.85 37.64 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 119.83 -1.793 . . . . 0.0 106.578 -178.765 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -124.49 154.7 18.03 Favored Glycine 0 C--N 1.355 1.602 0 O-C-N 117.299 -3.376 . . . . 0.0 109.226 -174.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -132.44 134.11 44.68 Favored 'General case' 0 C--N 1.368 1.377 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 35.8 m -124.73 135.83 53.34 Favored 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 103.165 -2.902 . . . . 0.0 103.165 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 53.3 t -54.82 159.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 C-N-CA 129.167 2.987 . . . . 0.0 112.158 173.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 130' ' ' GLN 0.335 91.5 m -64.01 98.65 0.22 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 116.918 -1.913 . . . . 0.0 113.183 167.718 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -64.16 -36.67 20.9 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -175.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -85.14 72.71 4.47 Favored 'Trans proline' 0 CA--C 1.56 1.814 0 CA-C-N 126.005 3.18 . . . . 0.0 112.598 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.426 8.7 p30 -163.43 -136.6 0.03 OUTLIER 'General case' 0 C--N 1.377 1.796 0 N-CA-C 116.697 2.11 . . . . 0.0 116.697 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -95.84 -27.2 15.32 Favored 'General case' 0 C--N 1.376 1.732 0 C-N-CA 131.003 3.721 . . . . 0.0 113.919 174.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.452 0.0 OUTLIER 56.72 71.54 0.56 Allowed 'General case' 0 N--CA 1.423 -1.796 1 C-N-CA 134.745 5.218 . . . . 0.0 115.191 -176.243 . . . . . . . . 4 3 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.41 ' HB3' ' HG3' ' A' ' 127' ' ' PRO . 1.8 t80 -63.52 52.5 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 130.116 3.367 . . . . 0.0 116.098 -177.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.467 4.7 mptt 82.03 -68.38 0.08 Allowed 'General case' 0 N--CA 1.438 -1.045 1 C-N-CA 131.719 4.007 . . . . 0.0 110.498 176.977 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -172.3 82.6 0.45 Allowed Pre-proline 0 C--N 1.353 0.739 0 CA-C-O 115.779 -2.057 . . . . 0.0 111.314 168.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.41 ' HG3' ' HB3' ' A' ' 124' ' ' PHE . 1.6 Cg_endo -123.85 16.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.369 1.612 0 CA-C-N 127.056 3.556 . . . . 0.0 118.848 177.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.319 4.2 p -147.71 159.2 44.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 111.959 -2.382 . . . . 0.0 109.063 162.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -116.3 140.72 49.03 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 103.405 -2.813 . . . . 0.0 103.405 168.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.442 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 49.9 tp60 -130.41 72.02 1.48 Allowed 'General case' 0 C--N 1.361 1.082 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.437 ' HG ' HD21 ' A' ' 49' ' ' LEU . 49.4 t 128.99 115.73 0.0 OUTLIER 'General case' 0 C--N 1.362 1.13 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 -174.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 8.1 mmm180 -115.81 108.98 17.01 Favored 'General case' 0 N--CA 1.446 -0.672 1 N-CA-C 99.707 -4.183 . . . . 0.0 99.707 164.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.48 ' HE1' HG12 ' A' ' 135' ' ' ILE . 3.4 ttp -92.69 108.91 20.35 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 128.284 2.634 . . . . 0.0 109.15 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -116.9 113.98 23.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . 0.48 HG12 ' HE1' ' A' ' 133' ' ' MET . 47.3 mm -145.16 132.61 15.93 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.08 -175.83 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-O 125.326 2.488 . . . . 0.0 108.882 -174.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.473 ' HA ' HD21 ' A' ' 141' ' ' LEU 0.317 0.4 OUTLIER -134.42 132.41 39.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 108.955 -3.748 . . . . 0.0 106.713 160.772 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.497 ' HB2' ' HB2' ' A' ' 141' ' ' LEU 0.286 25.2 m -145.01 -119.85 0.08 Allowed 'General case' 0 N--CA 1.485 1.288 0 O-C-N 118.615 -2.553 . . . . 0.0 116.942 -174.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.519 ' CD ' ' H ' ' A' ' 140' ' ' ARG . 0.1 OUTLIER -108.57 -75.66 0.63 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 130.879 3.672 . . . . 0.0 110.71 -167.852 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.519 ' H ' ' CD ' ' A' ' 139' ' ' ARG . 14.5 ptp180 -79.66 -9.33 59.62 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 130.704 3.601 . . . . 0.0 111.685 170.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.415 -2.179 0 CA-C-N 112.744 -2.026 . . . . 0.0 116.445 -159.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.419 HD12 ' O ' ' A' ' 151' ' ' LYS 0.409 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.919 0 N-CA-C 120.82 3.637 . . . . 0.0 120.82 . . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . 0.475 ' HB2' ' HB2' ' A' ' 108' ' ' ASP 0.515 4.5 tptp -71.13 160.79 32.23 Favored 'General case' 0 CA--C 1.461 -2.463 1 C-N-CA 153.109 12.563 . . . . 0.0 103.913 -175.689 . . . . . . . . 4 3 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' THR . . . . . 0.792 ' HA ' ' CD2' ' A' ' 73' ' ' HIS 0.398 9.8 t -71.44 97.23 1.6 Allowed 'General case' 0 CA--C 1.571 1.766 1 CA-C-O 130.546 4.974 . . . . 0.0 121.11 -173.12 . . . . . . . . 4 3 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.406 HE21 ' C ' ' A' ' 153' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.686 2 CA-C-N 100.419 -7.628 . . . . 0.0 112.741 162.567 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.428 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 5.5 t-20 . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.61 -62.74 1.27 Allowed 'General case' 0 C--N 1.352 0.698 1 C-N-CA 133.866 4.867 . . . . 0.0 112.395 172.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -72.92 -20.04 61.15 Favored 'General case' 0 C--N 1.374 1.668 0 O-C-N 120.146 -1.596 . . . . 0.0 112.847 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.428 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.3 m -76.27 -34.81 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 129.789 3.235 . . . . 0.0 111.215 173.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -66.99 -41.56 86.55 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 127.769 2.428 . . . . 0.0 108.513 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.7 mt -59.29 -43.91 91.0 Favored 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 124.538 1.135 . . . . 0.0 112.862 167.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.268 77.0 mtp85 -63.45 -49.11 74.94 Favored 'General case' 0 C--N 1.373 1.606 0 O-C-N 120.236 -1.54 . . . . 0.0 115.033 170.315 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -60.29 -27.31 67.19 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 171.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -76.99 -50.67 12.64 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 127.856 2.462 . . . . 0.0 110.678 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -57.3 -29.08 63.6 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 127.623 2.369 . . . . 0.0 110.856 171.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.0 tp -68.5 -49.09 62.28 Favored 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 125.637 1.575 . . . . 0.0 112.295 168.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -55.34 -39.21 69.73 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.353 -1.467 . . . . 0.0 112.213 172.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 64.8 mmt-85 -62.4 -48.71 78.52 Favored 'General case' 0 C--N 1.372 1.575 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 163.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -56.35 -46.49 79.95 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 129.644 3.178 . . . . 0.0 111.577 174.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.473 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -57.43 -53.05 62.57 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 131.472 3.909 . . . . 0.0 111.011 173.565 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -74.33 -43.98 54.37 Favored 'General case' 0 C--N 1.377 1.79 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 t -66.98 -38.03 85.31 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.515 2.326 . . . . 0.0 112.231 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.461 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.34 41.7 mt-10 -76.91 -29.17 55.58 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 125.369 1.468 . . . . 0.0 112.145 170.525 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -33.97 72.88 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 121.415 1.916 . . . . 0.0 113.037 167.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -66.38 -44.69 82.42 Favored 'General case' 0 C--N 1.377 1.797 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.894 164.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.458 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 17.5 tt0 -57.69 -40.25 79.04 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.805 2.15 . . . . 0.0 116.805 170.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.665 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -69.24 -45.64 78.96 Favored 'Isoleucine or valine' 0 C--N 1.366 1.317 0 C-N-CA 125.683 1.593 . . . . 0.0 111.106 178.043 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.758 0.0 OUTLIER -73.54 -23.26 59.96 Favored 'General case' 0 C--N 1.369 1.452 0 O-C-N 121.296 -0.878 . . . . 0.0 112.929 177.129 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.53 -41.15 66.17 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.945 1.698 . . . . 0.0 111.592 168.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.587 0.8 OUTLIER -63.65 -29.32 70.57 Favored 'General case' 0 C--N 1.403 2.908 0 O-C-N 119.507 -1.996 . . . . 0.0 113.426 169.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 7.2 mt -68.78 -50.5 54.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.416 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 166.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.1 mtm180 -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 121.152 1.796 . . . . 0.0 114.743 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.21 -45.23 27.23 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 125.228 1.411 . . . . 0.0 111.417 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.53 -31.91 60.27 Favored 'General case' 0 C--N 1.359 1.019 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -178.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.4 t -78.71 -34.18 46.21 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 127.138 2.175 . . . . 0.0 108.847 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -72.42 -43.25 64.13 Favored 'General case' 0 C--N 1.384 2.076 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 165.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.42 73.14 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 126.399 1.879 . . . . 0.0 114.601 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.28 -16.86 60.92 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 119.082 0.855 . . . . 0.0 112.495 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.83 17.75 40.08 Favored Glycine 0 C--N 1.376 2.764 0 C-N-CA 124.413 1.006 . . . . 0.0 114.12 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.486 HG21 ' HB3' ' A' ' 78' ' ' ASN . 2.3 t -102.16 179.76 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.239 0 C-N-CA 128.113 2.565 . . . . 0.0 111.106 -172.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.397 3.1 t -75.09 -144.93 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.436 2.294 . . . . 0.0 113.834 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.2 m -150.6 157.66 43.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 119.122 -2.236 . . . . 0.0 107.588 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -128.63 154.64 46.04 Favored 'General case' 0 C--N 1.349 0.554 0 C-N-CA 124.559 1.144 . . . . 0.0 109.727 -177.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -100.92 114.62 28.66 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 101.847 -3.39 . . . . 0.0 101.847 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.345 0.0 OUTLIER -115.4 128.75 56.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.256 -1.528 . . . . 0.0 107.572 -170.713 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -130.83 146.04 52.16 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 121.076 -1.015 . . . . 0.0 109.295 -178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.482 ' CD1' HD13 ' A' ' 50' ' ' LEU . 21.0 p90 -99.97 159.3 15.19 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 124.983 1.313 . . . . 0.0 110.588 177.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.1 p -108.72 118.83 37.81 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 124.46 1.104 . . . . 0.0 108.562 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.486 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.439 0.0 OUTLIER -74.8 -10.8 59.85 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 119.458 3.133 . . . . 0.0 119.458 -170.435 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.74 -48.6 24.84 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 122.161 2.255 . . . . 0.0 113.049 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.7 pp -67.14 -31.46 71.91 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 128.726 2.811 . . . . 0.0 112.93 173.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.486 ' HB3' ' HA ' ' A' ' 47' ' ' GLN 0.306 6.2 tt -75.56 -42.72 51.52 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 128.593 2.757 . . . . 0.0 109.848 173.408 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.54 -30.32 67.01 Favored 'General case' 0 C--N 1.378 1.831 0 C-N-CA 128.471 2.708 . . . . 0.0 111.246 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -77.96 -41.32 36.53 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 119.87 -1.769 . . . . 0.0 114.508 164.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.44 -34.36 78.11 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.0 tt -66.73 -39.02 82.73 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 C-N-CA 130.421 3.489 . . . . 0.0 112.793 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -104.56 -23.79 13.08 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 174.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.77 -22.71 39.9 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 119.023 -2.298 . . . . 0.0 112.894 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 60' ' ' GLU . 3.1 mm-40 -127.91 14.37 6.86 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -177.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.427 HD11 ' HE ' ' A' ' 10' ' ' ARG 0.478 0.3 OUTLIER 20.64 -28.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.985 2 C-N-CA 136.678 5.991 . . . . 0.0 126.621 177.628 . . . . . . . . 5 4 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -155.3 64.68 0.62 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 57' ' ' GLU 0.452 6.7 pt-20 -87.44 61.93 6.87 Favored 'General case' 0 CA--C 1.469 -2.143 0 CA-C-O 125.53 2.586 . . . . 0.0 110.71 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.319 59.6 p -78.96 -11.79 60.02 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 129.154 2.982 . . . . 0.0 112.492 178.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -65.68 -34.29 77.86 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 130.464 3.506 . . . . 0.0 111.185 164.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.89 -38.04 80.63 Favored 'Isoleucine or valine' 0 C--N 1.359 1.005 0 C-N-CA 126.363 1.865 . . . . 0.0 110.582 -174.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.473 ' CE2' ' HA ' ' A' ' 18' ' ' PHE . 37.6 m-85 -66.52 -46.66 75.45 Favored 'General case' 0 CA--C 1.47 -2.125 1 C-N-CA 133.224 4.61 . . . . 0.0 111.396 169.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -60.46 -38.28 83.7 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.815 1.643 . . . . 0.0 114.875 176.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.479 ' CD1' ' CD1' ' A' ' 111' ' ' LEU . 2.1 tm? -75.24 -47.98 25.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.97 3.308 . . . . 0.0 114.414 173.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.623 0.0 OUTLIER -77.31 -17.68 58.11 Favored 'General case' 0 C--N 1.377 1.763 0 O-C-N 118.304 -2.748 . . . . 0.0 112.001 174.278 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.665 ' CE1' HG12 ' A' ' 25' ' ' ILE . 41.3 m-70 -67.91 -38.11 82.52 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 127.288 2.235 . . . . 0.0 109.516 162.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.493 8.9 mttt -77.22 -16.7 58.94 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 122.135 2.243 . . . . 0.0 112.968 168.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.532 HD13 HE21 ' A' ' 153' ' ' GLN 0.331 0.8 OUTLIER -71.75 -40.03 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 C-N-CA 126.044 1.738 . . . . 0.0 113.47 172.914 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.866 11.5 mptt -67.44 -2.4 6.29 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 131.013 3.725 . . . . 0.0 118.683 176.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -87.43 -16.52 34.63 Favored 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 167.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.42 ' CD2' ' CG ' ' A' ' 151' ' ' LYS 0.288 3.0 m-70 -90.65 10.25 26.49 Favored 'General case' 0 C--N 1.379 1.873 0 C-N-CA 129.768 3.227 . . . . 0.0 111.103 174.268 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . 0.29 24.4 t -41.14 -40.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.414 3.396 0 C-N-CA 130.334 3.454 . . . . 0.0 111.096 160.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.64 -37.95 74.19 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.633 3.173 . . . . 0.0 115.565 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -75.58 -38.24 59.27 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 128.47 2.708 . . . . 0.0 109.904 172.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.385 1.9 m -69.99 -30.42 44.03 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 CA-C-O 124.188 1.946 . . . . 0.0 113.856 173.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.486 ' HB3' HG21 ' A' ' 38' ' ' VAL . 3.7 m120 -73.81 -34.11 64.47 Favored 'General case' 0 C--N 1.345 0.382 1 C-N-CA 132.45 4.3 . . . . 0.0 111.865 172.397 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -67.41 -30.46 70.23 Favored 'General case' 0 C--N 1.367 1.327 0 C-N-CA 125.957 1.703 . . . . 0.0 111.067 165.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.566 13.4 p90 -75.11 -29.92 60.71 Favored 'General case' 0 C--N 1.379 1.864 0 N-CA-C 116.264 1.95 . . . . 0.0 116.264 162.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.368 1.4 0 C-N-CA 128.05 2.54 . . . . 0.0 114.531 174.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.612 1 N-CA-C 124.371 4.508 . . . . 0.0 124.371 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -129.97 138.53 50.89 Favored 'General case' 0 N--CA 1.431 -1.423 1 N-CA-C 98.2 -4.741 . . . . 0.0 98.2 167.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.41 144.61 49.96 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -129.46 130.29 45.7 Favored 'General case' 0 C--N 1.361 1.108 0 N-CA-C 105.596 -2.001 . . . . 0.0 105.596 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.527 ' HB ' ' HB3' ' A' ' 113' ' ' LEU . 1.0 OUTLIER -126.01 137.11 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 175.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -136.49 107.35 6.64 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 172.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.482 ' HB3' ' H ' ' A' ' 109' ' ' GLY . 0.4 OUTLIER -162.98 -117.76 0.01 OUTLIER 'General case' 0 CA--C 1.448 -2.97 0 N-CA-C 103.131 -2.914 . . . . 0.0 103.131 -178.429 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.554 ' H ' ' HG3' ' A' ' 153' ' ' GLN . . . -52.04 75.4 0.01 OUTLIER Glycine 0 C--N 1.384 3.231 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -160.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 63.13 7.35 2.72 Favored 'General case' 0 C--N 1.369 1.437 1 C-N-CA 132.358 4.263 . . . . 0.0 113.192 179.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.479 ' CD1' ' CD1' ' A' ' 66' ' ' LEU . 0.5 OUTLIER -117.32 133.12 56.35 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 129.987 3.315 . . . . 0.0 112.683 -160.132 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -111.4 98.54 7.55 Favored 'General case' 0 C--N 1.363 1.163 1 N-CA-C 98.979 -4.452 . . . . 0.0 98.979 174.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.527 ' HB3' ' HB ' ' A' ' 106' ' ' ILE 0.287 0.8 OUTLIER -115.91 121.11 41.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.453 1.501 . . . . 0.0 107.205 -167.623 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.25 132.1 7.22 Favored Glycine 0 C--N 1.364 2.117 0 O-C-N 119.938 -1.726 . . . . 0.0 109.605 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 152.85 50.56 Favored 'General case' 0 C--N 1.372 1.548 0 CA-C-N 120.848 2.324 . . . . 0.0 107.744 174.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 m -130.1 142.17 50.63 Favored 'General case' 0 C--N 1.371 1.506 0 C-N-CA 125.797 1.639 . . . . 0.0 106.709 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 12.5 m -77.47 179.18 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.999 0 C-N-CA 125.566 1.546 . . . . 0.0 110.289 169.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.41 ' HA ' ' HG3' ' A' ' 130' ' ' GLN 0.267 0.5 OUTLIER -56.66 92.56 0.01 OUTLIER 'General case' 0 C--N 1.359 1.014 0 CA-C-O 124.194 1.949 . . . . 0.0 115.698 168.029 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.354 9.1 pttp -71.6 -40.21 8.32 Favored Pre-proline 0 C--N 1.345 0.383 1 C-N-CA 133.09 4.556 . . . . 0.0 114.028 -178.711 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -75.74 60.3 5.92 Favored 'Trans proline' 0 CA--C 1.568 2.176 0 C-N-CA 124.29 3.327 . . . . 0.0 108.205 160.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.561 0.6 OUTLIER 2.3 -3.24 0.0 OUTLIER 'General case' 0 C--N 1.354 0.764 2 N-CA-C 129.217 6.747 . . . . 0.0 129.217 -168.178 . . . . . . . . 4 3 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 56.38 -16.21 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.984 1 N-CA-C 123.224 4.528 . . . . 0.0 123.224 167.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.371 10.0 mptt 72.19 18.66 4.7 Favored 'General case' 0 N--CA 1.421 -1.877 1 C-N-CA 134.821 5.248 . . . . 0.0 114.03 177.58 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -145.71 177.78 8.64 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 128.373 2.669 . . . . 0.0 107.36 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.45 ' H ' ' HE3' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -63.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.354 0.771 1 C-N-CA 132.14 4.176 . . . . 0.0 118.838 -170.466 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -109.8 -4.4 0.11 Allowed Pre-proline 0 N--CA 1.446 -0.636 1 CA-C-O 111.538 -4.077 . . . . 0.0 115.874 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.258 31.1 Cg_exo -69.0 23.61 0.15 Allowed 'Trans proline' 0 C--N 1.371 1.719 2 CA-C-N 133.963 6.022 . . . . 0.0 124.665 -166.898 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.292 19.3 m -145.41 149.55 34.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 C-N-CA 124.514 1.125 . . . . 0.0 108.916 158.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.25 130.42 55.94 Favored 'General case' 0 C--N 1.36 1.026 1 N-CA-C 98.903 -4.48 . . . . 0.0 98.903 159.675 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.41 ' HG3' ' HA ' ' A' ' 118' ' ' CYS . 61.0 mm-40 -125.08 71.99 1.22 Allowed 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -164.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.262 64.0 m 98.15 106.57 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 125.059 1.475 . . . . 0.0 110.405 178.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -115.32 140.78 48.82 Favored 'General case' 0 C--N 1.359 1.002 0 CA-C-N 113.983 -1.462 . . . . 0.0 110.423 171.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 10.1 ttt -107.38 123.51 48.47 Favored 'General case' 0 N--CA 1.436 -1.144 1 C-N-CA 133.815 4.846 . . . . 0.0 110.002 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.66 114.76 17.06 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 169.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.7 mm -136.7 135.16 48.82 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.44 ' CD1' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -112.35 176.46 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.662 0 CA-C-O 124.423 2.058 . . . . 0.0 107.759 -177.389 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -72.19 103.87 3.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 130.242 3.417 . . . . 0.0 106.024 161.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.42 87.3 p -74.73 77.46 2.06 Favored 'General case' 0 C--N 1.357 0.892 0 N-CA-C 116.155 1.909 . . . . 0.0 116.155 -171.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.461 ' O ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -79.97 -57.67 3.53 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.31 167.796 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 139' ' ' ARG 0.293 32.7 mtt180 109.56 66.16 0.0 OUTLIER 'General case' 0 C--N 1.365 1.272 1 C-N-CA 143.299 8.64 . . . . 0.0 102.788 -173.741 . . . . . . . . 4 3 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.355 0.836 1 N-CA-C 126.158 5.614 . . . . 0.0 126.158 -145.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.578 ' CD1' ' HB3' ' A' ' 151' ' ' LYS 0.442 0.3 OUTLIER . . . . . 0 N--CA 1.417 -2.077 0 CA-C-O 122.913 1.34 . . . . 0.0 111.156 . . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . 0.578 ' HB3' ' CD1' ' A' ' 150' ' ' ILE 0.564 0.0 OUTLIER -71.48 147.18 48.06 Favored 'General case' 0 CA--C 1.502 -0.899 1 C-N-CA 140.219 7.408 . . . . 0.0 105.498 -177.464 . . . . . . . . 5 4 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . 0.473 12.4 t -78.31 93.03 4.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 128.318 3.913 . . . . 0.0 117.882 -163.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.554 ' HG3' ' H ' ' A' ' 109' ' ' GLY 0.251 2.0 pt20 . . . . . 0 N--CA 1.418 -2.026 0 N-CA-C 102.122 -3.288 . . . . 0.0 102.122 177.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.485 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.442 -0.851 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -61.17 2.23 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 130.151 3.381 . . . . 0.0 114.764 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -75.6 -19.58 59.15 Favored 'General case' 0 C--N 1.376 1.734 0 CA-C-O 122.192 0.996 . . . . 0.0 112.227 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.485 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -74.32 -37.25 44.92 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 C-N-CA 129.912 3.285 . . . . 0.0 111.578 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.61 -44.26 82.57 Favored 'General case' 0 C--N 1.373 1.615 0 C-N-CA 128.731 2.812 . . . . 0.0 108.576 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.43 -43.52 77.91 Favored 'Isoleucine or valine' 0 C--N 1.368 1.381 0 C-N-CA 125.1 1.36 . . . . 0.0 112.847 167.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.27 0.9 OUTLIER -62.73 -50.86 69.41 Favored 'General case' 0 CA--C 1.564 1.507 0 C-N-CA 126.39 1.876 . . . . 0.0 115.123 173.184 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.494 ' HG2' HE22 ' A' ' 55' ' ' GLN . 32.6 mtp180 -59.29 -27.63 66.02 Favored 'General case' 0 C--N 1.372 1.546 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 163.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -77.08 -47.76 19.64 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 128.676 2.79 . . . . 0.0 110.563 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.499 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 9.5 mmpt? -58.77 -29.63 66.94 Favored 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.161 2.184 . . . . 0.0 109.571 169.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.07 -44.49 79.96 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 163.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 -60.87 -32.6 72.03 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 122.726 2.512 . . . . 0.0 113.837 171.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.499 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.29 0.5 OUTLIER -72.07 -38.46 69.44 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.498 -1.376 . . . . 0.0 112.289 171.728 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -65.23 -46.14 81.8 Favored 'General case' 0 C--N 1.386 2.154 0 C-N-CA 128.316 2.646 . . . . 0.0 111.06 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.47 ' HA ' ' CZ ' ' A' ' 64' ' ' PHE . 0.5 OUTLIER -63.2 -51.1 67.67 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 129.964 3.306 . . . . 0.0 112.201 -177.891 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -74.31 -42.96 58.64 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 126.983 2.113 . . . . 0.0 115.905 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.7 m -64.93 -42.88 94.28 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 124.428 2.061 . . . . 0.0 112.068 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.462 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.279 41.2 mt-10 -76.41 -29.79 57.2 Favored 'General case' 0 N--CA 1.439 -1.023 0 O-C-N 120.135 -1.603 . . . . 0.0 112.495 172.879 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -59.55 -31.39 69.38 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 122.348 2.34 . . . . 0.0 112.471 166.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -63.0 -46.26 88.5 Favored 'General case' 0 C--N 1.385 2.116 0 C-N-CA 124.585 1.154 . . . . 0.0 111.126 163.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.439 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 43.8 tt0 -56.08 -43.24 77.8 Favored 'General case' 0 C--N 1.371 1.53 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 169.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.7 mt -68.57 -45.79 81.12 Favored 'Isoleucine or valine' 0 C--N 1.357 0.93 0 C-N-CA 125.519 1.528 . . . . 0.0 113.888 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.726 0.1 OUTLIER -73.45 -22.93 60.06 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 174.46 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -67.73 -47.19 70.03 Favored 'General case' 0 C--N 1.377 1.78 0 CA-C-O 116.989 -1.482 . . . . 0.0 112.457 168.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.774 0.2 OUTLIER -69.77 -30.54 68.14 Favored 'General case' 0 C--N 1.406 3.028 0 CA-C-N 124.259 3.209 . . . . 0.0 113.92 171.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.47 -37.15 79.35 Favored 'Isoleucine or valine' 0 C--N 1.372 1.578 0 CA-C-N 121.85 2.114 . . . . 0.0 115.274 170.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 ttt-85 -70.59 -38.08 73.98 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 118.745 -2.472 . . . . 0.0 114.241 175.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -76.3 -41.2 49.43 Favored 'General case' 0 CA--C 1.485 -1.53 0 C-N-CA 126.493 1.917 . . . . 0.0 111.732 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.0 -32.09 45.01 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.369 11.3 p -78.51 -27.98 46.2 Favored 'General case' 0 C--N 1.359 0.987 0 O-C-N 120.823 -1.173 . . . . 0.0 110.125 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -71.36 -52.1 20.55 Favored 'General case' 0 C--N 1.371 1.522 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 158.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.03 -30.16 71.25 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.88 -11.97 60.01 Favored 'General case' 0 C--N 1.375 1.685 0 O-C-N 120.901 -1.124 . . . . 0.0 111.591 170.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.85 17.18 62.0 Favored Glycine 0 C--N 1.383 3.189 0 O-C-N 121.016 -1.052 . . . . 0.0 115.056 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.515 ' CG2' ' H ' ' A' ' 39' ' ' SER . 7.9 p -96.58 178.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.36 0 CA-C-O 125.035 2.35 . . . . 0.0 112.754 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.515 ' H ' ' CG2' ' A' ' 38' ' ' VAL . 41.9 t -23.88 -69.11 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 1 C-N-CA 136.859 6.064 . . . . 0.0 117.522 178.188 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.256 90.9 p 102.57 142.39 0.01 OUTLIER 'General case' 0 C--N 1.357 0.903 0 C-N-CA 131.007 3.723 . . . . 0.0 104.238 -166.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . 0.266 50.4 p90 -141.53 161.9 36.8 Favored 'General case' 0 C--N 1.345 0.399 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -111.12 149.58 30.65 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.847 1.659 . . . . 0.0 112.863 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.353 1.7 pp -126.84 158.38 36.82 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 119.44 -2.038 . . . . 0.0 112.861 167.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -140.41 150.25 43.63 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.347 3.059 . . . . 0.0 103.196 172.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.464 ' CD1' HD12 ' A' ' 50' ' ' LEU . 4.0 p90 -125.2 134.08 52.5 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 105.72 -1.956 . . . . 0.0 105.72 170.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.3 m -105.18 128.16 53.27 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 120.99 -1.069 . . . . 0.0 108.516 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.514 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.597 0.0 OUTLIER -73.68 -10.54 59.8 Favored 'General case' 0 C--N 1.363 1.187 1 N-CA-C 122.541 4.274 . . . . 0.0 122.541 -169.921 . . . . . . . . 5 4 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.27 -45.3 60.7 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 122.966 2.621 . . . . 0.0 111.762 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.0 tp -53.78 -48.61 69.62 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 131.138 3.775 . . . . 0.0 111.977 166.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 47' ' ' GLN . 8.3 tt -74.83 -28.65 60.78 Favored 'General case' 0 CA--C 1.487 -1.444 0 C-N-CA 125.837 1.655 . . . . 0.0 112.708 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -66.72 -30.64 70.92 Favored 'General case' 0 C--N 1.365 1.239 0 CA-C-N 120.177 1.353 . . . . 0.0 108.729 169.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -73.82 -28.69 61.75 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 167.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.82 -50.18 25.74 Favored 'General case' 0 C--O 1.207 -1.179 0 O-C-N 119.979 -1.7 . . . . 0.0 113.373 165.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.282 0.3 OUTLIER -50.95 -43.35 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 1 C-N-CA 132.939 4.496 . . . . 0.0 113.884 -177.297 . . . . . . . . 4 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.494 HE22 ' HG2' ' A' ' 11' ' ' ARG 0.26 5.3 mm100 -84.18 -31.67 25.01 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 171.828 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -99.53 39.1 1.34 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 124.201 1.953 . . . . 0.0 109.456 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . 0.295 2.7 pt-20 -160.71 -52.07 0.05 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 127.946 2.498 . . . . 0.0 110.395 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.64 0.1 OUTLIER 19.83 108.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.524 3.241 0 C-N-CA 131.518 3.927 . . . . 0.0 113.249 -169.171 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 53.23 44.3 30.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 131.59 3.956 . . . . 0.0 112.089 -173.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.469 ' HG2' HG13 ' A' ' 136' ' ' ILE 0.652 3.8 tp10 -78.29 79.64 4.72 Favored 'General case' 0 C--N 1.372 1.577 0 CA-C-O 127.22 3.391 . . . . 0.0 110.666 175.024 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.313 62.2 p -78.23 -15.87 58.38 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 127.616 2.366 . . . . 0.0 112.569 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -67.59 -33.29 74.7 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 129.859 3.264 . . . . 0.0 109.33 165.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.425 ' CG1' ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -58.57 -44.33 89.15 Favored 'Isoleucine or valine' 0 C--N 1.372 1.551 0 C-N-CA 128.978 2.911 . . . . 0.0 110.332 179.892 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.47 ' CZ ' ' HA ' ' A' ' 18' ' ' PHE . 41.1 m-85 -64.98 -45.46 85.54 Favored 'General case' 0 CA--C 1.488 -1.434 1 C-N-CA 133.332 4.653 . . . . 0.0 111.229 170.612 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.39 -34.17 77.15 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-N 122.408 2.367 . . . . 0.0 114.187 178.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.445 ' CD1' HD21 ' A' ' 111' ' ' LEU . 2.9 tm? -76.35 -45.39 32.3 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 127.43 2.292 . . . . 0.0 116.522 168.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.87 0.1 OUTLIER -75.49 -16.36 60.31 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 122.334 2.333 . . . . 0.0 113.514 176.526 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.439 ' CE1' ' HB3' ' A' ' 24' ' ' GLN 0.253 24.9 m-70 -76.81 -36.34 56.99 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 128.669 2.788 . . . . 0.0 110.296 161.637 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -73.88 -18.17 60.95 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 122.335 2.334 . . . . 0.0 114.569 169.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 26.4 mm -57.8 -70.26 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.379 1.876 0 C-N-CA 129.067 2.947 . . . . 0.0 113.013 173.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.414 ' HE3' ' HD1' ' A' ' 68' ' ' HIS 0.846 0.0 OUTLIER -52.13 -2.1 0.02 OUTLIER 'General case' 0 CA--C 1.48 -1.726 1 C-N-CA 133.015 4.526 . . . . 0.0 120.996 179.163 . . . . . . . . 5 4 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -84.26 -18.77 35.34 Favored 'General case' 0 CA--C 1.564 1.483 0 O-C-N 119.944 -1.722 . . . . 0.0 107.409 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.477 ' CD2' ' HG1' ' A' ' 152' ' ' THR . 22.9 m-70 -99.16 21.23 12.13 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 130.118 3.367 . . . . 0.0 113.993 174.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.3 t -38.62 -43.73 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.397 2.652 0 C-N-CA 129.588 3.155 . . . . 0.0 112.99 163.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.93 -39.69 74.97 Favored 'General case' 0 C--O 1.214 -0.8 1 C-N-CA 132.546 4.339 . . . . 0.0 114.096 177.099 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.254 30.8 mt-10 -75.93 -32.11 59.42 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 126.315 1.846 . . . . 0.0 112.594 169.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.422 1.8 m -66.98 -31.12 52.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.505 0 CA-C-O 127.805 3.669 . . . . 0.0 112.379 168.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . 0.451 0.0 OUTLIER -71.93 -29.56 64.42 Favored 'General case' 0 C--N 1.351 0.67 1 C-N-CA 132.593 4.357 . . . . 0.0 112.067 168.718 . . . . . . . . 4 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . 0.298 17.7 mt-10 -69.94 -30.11 67.41 Favored 'General case' 0 C--N 1.373 1.602 0 C-N-CA 129.248 3.019 . . . . 0.0 109.574 166.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -61.58 -47.26 86.31 Favored 'General case' 0 C--N 1.386 2.157 0 CA-C-N 119.295 0.952 . . . . 0.0 110.553 165.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 125' ' ' LYS 0.53 1.1 tm? . . . . . 0 N--CA 1.501 2.113 0 N-CA-C 119.612 3.19 . . . . 0.0 119.612 173.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.138 0 N-CA-C 118.112 2.005 . . . . 0.0 118.112 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -124.83 139.41 53.87 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 103.822 -2.659 . . . . 0.0 103.822 176.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.51 139.1 45.2 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -174.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -128.26 130.82 48.49 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 102.564 -3.124 . . . . 0.0 102.564 178.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.33 138.71 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 124.477 1.111 . . . . 0.0 108.115 -171.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -137.6 114.4 10.55 Favored 'General case' 0 C--N 1.38 1.928 0 N-CA-C 116.412 2.005 . . . . 0.0 116.412 -167.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.553 ' HB3' ' H ' ' A' ' 151' ' ' LYS 0.329 0.9 OUTLIER -132.32 -157.99 0.86 Allowed 'General case' 0 C--N 1.386 2.16 0 CA-C-N 122.576 2.444 . . . . 0.0 108.064 177.853 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -47.2 67.06 0.0 OUTLIER Glycine 0 CA--C 1.453 -3.84 1 C-N-CA 134.494 5.807 . . . . 0.0 118.771 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 93.41 5.01 0.05 OUTLIER 'General case' 0 CA--C 1.492 -1.277 1 C-N-CA 134.568 5.147 . . . . 0.0 111.825 169.288 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.445 HD21 ' CD1' ' A' ' 66' ' ' LEU . 16.0 tp -106.96 133.99 50.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.727 1.211 . . . . 0.0 111.383 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -110.59 99.63 8.57 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 102.13 -3.285 . . . . 0.0 102.13 171.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -106.76 131.68 53.6 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 124.625 1.17 . . . . 0.0 108.12 -177.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -135.27 138.43 9.98 Favored Glycine 0 C--N 1.348 1.25 0 O-C-N 118.938 -2.351 . . . . 0.0 108.133 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.89 152.81 50.8 Favored 'General case' 0 C--N 1.364 1.203 0 CA-C-N 120.876 2.338 . . . . 0.0 107.182 174.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 p -127.32 140.79 51.96 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 106.33 -1.729 . . . . 0.0 106.33 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.5 t -85.84 134.86 26.24 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 102.411 -3.181 . . . . 0.0 102.411 169.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.517 ' HG ' ' ND2' ' A' ' 121' ' ' ASN 0.418 14.2 p -14.64 64.41 0.0 OUTLIER 'General case' 0 C--N 1.375 1.705 0 C-N-CA 131.674 3.99 . . . . 0.0 120.29 -171.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.436 2.0 ptmt -15.77 -56.75 0.04 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 137.796 6.439 . . . . 0.0 117.215 -172.201 . . . . . . . . 3 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -68.94 48.18 0.48 Allowed 'Trans proline' 0 CA--C 1.574 2.508 0 C-N-CA 123.143 2.562 . . . . 0.0 115.174 166.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.517 ' ND2' ' HG ' ' A' ' 118' ' ' CYS 0.402 0.0 OUTLIER 156.45 -171.89 0.0 OUTLIER 'General case' 0 C--N 1.376 1.75 0 C-N-CA 131.356 3.863 . . . . 0.0 110.576 176.159 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -152.35 -77.41 0.12 Allowed 'General case' 0 N--CA 1.423 -1.779 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 157.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.502 0.0 OUTLIER 19.35 59.53 0.02 OUTLIER 'General case' 0 C--N 1.356 0.855 1 C-N-CA 135.417 5.487 . . . . 0.0 119.176 -170.496 . . . . . . . . 4 3 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 171.14 -168.7 0.02 OUTLIER 'General case' 0 CA--C 1.507 -0.698 1 C-N-CA 132.322 4.249 . . . . 0.0 104.299 -172.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 81' ' ' LEU 0.489 0.0 OUTLIER -125.22 -71.41 0.71 Allowed 'General case' 0 C--N 1.358 0.944 0 CA-C-N 119.457 1.026 . . . . 0.0 113.631 -179.763 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.476 ' HB3' ' HG ' ' A' ' 81' ' ' LEU . 9.3 p-10 -43.71 -59.57 3.37 Favored Pre-proline 0 C--N 1.355 0.831 0 N-CA-C 121.78 3.993 . . . . 0.0 121.78 172.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.619 0.0 OUTLIER 55.49 -178.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.392 2.82 1 N-CA-C 123.061 4.216 . . . . 0.0 123.061 163.648 . . . . . . . . 4 3 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 24.6 t -105.26 140.61 38.15 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 102.053 -3.314 . . . . 0.0 102.053 171.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mp -100.29 130.15 46.37 Favored 'General case' 0 C--N 1.347 0.486 1 N-CA-C 99.157 -4.386 . . . . 0.0 99.157 -177.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -123.3 74.29 1.23 Allowed 'General case' 0 CA--C 1.479 -1.756 0 N-CA-C 105.655 -1.979 . . . . 0.0 105.655 -161.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.365 0.5 OUTLIER 95.35 115.65 0.02 OUTLIER 'General case' 0 C--N 1.368 1.389 0 CA-C-O 123.482 1.611 . . . . 0.0 110.598 -176.487 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -114.75 129.93 56.76 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 171.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.9 ttt -93.73 122.02 35.76 Favored 'General case' 0 N--CA 1.439 -0.986 1 C-N-CA 132.998 4.519 . . . . 0.0 107.729 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.274 . . -127.91 114.44 17.17 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -144.4 122.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 O-C-N 119.849 -1.782 . . . . 0.0 108.634 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.469 HG13 ' HG2' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -118.14 -179.67 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 C-N-CA 127.67 2.388 . . . . 0.0 112.72 -166.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.326 0.2 OUTLIER -140.23 153.13 46.46 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 111.314 -2.676 . . . . 0.0 109.169 162.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.483 ' HB2' ' HB2' ' A' ' 141' ' ' LEU . 68.0 m -162.5 -122.35 0.02 OUTLIER 'General case' 0 C--N 1.354 0.789 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -169.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.584 ' CG ' ' H ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -84.76 -81.52 0.19 Allowed 'General case' 0 C--N 1.362 1.138 1 C-N-CA 136.118 5.767 . . . . 0.0 114.661 -171.677 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.584 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 0.5 OUTLIER -87.71 -1.16 57.78 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 129.521 3.128 . . . . 0.0 110.428 171.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.483 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.7 OUTLIER . . . . . 0 N--CA 1.42 -1.94 0 C-N-CA 125.951 1.7 . . . . 0.0 111.004 -170.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.582 ' CD1' ' H ' ' A' ' 152' ' ' THR . 5.0 tp . . . . . 0 CA--C 1.513 -0.472 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . 0.553 ' H ' ' HB3' ' A' ' 108' ' ' ASP 0.292 0.0 OUTLIER -127.92 111.24 13.36 Favored 'General case' 0 CA--C 1.459 -2.536 1 O-C-N 115.916 -4.24 . . . . 0.0 115.568 118.886 . . . . . . . . 5 4 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' THR . . . . . 0.582 ' H ' ' CD1' ' A' ' 150' ' ' ILE 0.28 74.5 p -118.71 99.11 6.57 Favored 'General case' 0 N--CA 1.435 -1.196 1 N-CA-C 97.58 -4.97 . . . . 0.0 97.58 130.755 . . . . . . . . 4 3 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.681 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -175.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.489 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 15.3 m-80 . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 115.964 1.838 . . . . 0.0 115.964 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.5 m -61.22 -55.47 31.72 Favored 'General case' 0 C--N 1.349 0.581 0 C-N-CA 130.458 3.503 . . . . 0.0 112.104 174.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -72.74 -21.16 61.07 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 128.222 2.609 . . . . 0.0 112.656 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.489 ' CG1' ' HA ' ' A' ' 4' ' ' ASN 0.267 0.7 OUTLIER -82.41 -38.13 15.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.074 0 C-N-CA 126.798 2.039 . . . . 0.0 111.049 178.156 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.82 -44.47 85.53 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 129.857 3.263 . . . . 0.0 108.885 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.88 -43.84 89.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 C-N-CA 126.048 1.739 . . . . 0.0 110.765 168.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.266 2.7 tpt85 -62.33 -50.29 72.22 Favored 'General case' 0 C--N 1.371 1.511 0 N-CA-C 116.153 1.909 . . . . 0.0 116.153 170.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -59.11 -29.18 67.18 Favored 'General case' 0 C--N 1.373 1.596 0 N-CA-C 118.486 2.773 . . . . 0.0 118.486 170.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -77.21 -51.45 10.93 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.13 3.372 . . . . 0.0 110.719 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -57.44 -29.21 64.0 Favored 'General case' 0 C--N 1.382 1.993 0 C-N-CA 128.271 2.628 . . . . 0.0 111.042 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tp -71.22 -46.68 60.63 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 114.878 -1.056 . . . . 0.0 112.569 167.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -55.32 -43.43 74.89 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 120.18 1.354 . . . . 0.0 112.722 172.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -57.91 -47.75 81.91 Favored 'General case' 0 C--N 1.371 1.543 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 165.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -50.15 74.53 Favored 'General case' 0 C--N 1.38 1.912 0 C-N-CA 128.28 2.632 . . . . 0.0 115.113 175.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.501 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -65.33 -51.44 60.55 Favored 'General case' 0 C--N 1.357 0.91 1 C-N-CA 131.942 4.097 . . . . 0.0 110.226 177.46 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -72.95 -44.84 60.68 Favored 'General case' 0 C--N 1.381 1.952 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 176.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.4 m -63.71 -42.93 97.87 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.352 1.861 . . . . 0.0 112.792 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.407 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.453 4.9 mp0 -76.75 -28.41 55.74 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 120.073 -1.642 . . . . 0.0 111.029 174.163 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -60.45 -32.53 71.47 Favored 'General case' 0 C--N 1.386 2.156 0 CA-C-N 122.467 2.394 . . . . 0.0 113.023 167.88 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -65.12 -45.33 85.54 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 124.347 1.059 . . . . 0.0 111.761 163.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -56.63 -47.04 80.56 Favored 'General case' 0 C--N 1.378 1.806 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 171.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.448 ' CD1' ' CD1' ' A' ' 67' ' ' PHE . 1.2 mt -68.57 -43.85 83.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 124.929 1.291 . . . . 0.0 112.767 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.58 1.4 p30 -73.41 -23.95 60.21 Favored 'General case' 0 C--N 1.376 1.75 0 CA-C-N 121.631 2.014 . . . . 0.0 114.001 173.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -70.61 -41.32 72.41 Favored 'General case' 0 C--N 1.382 1.979 0 C-N-CA 125.059 1.343 . . . . 0.0 111.086 169.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -66.01 -37.68 86.54 Favored 'General case' 0 C--N 1.373 1.614 0 O-C-N 119.439 -2.038 . . . . 0.0 112.429 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -40.15 87.79 Favored 'Isoleucine or valine' 0 C--N 1.363 1.17 0 C-N-CA 124.619 1.168 . . . . 0.0 113.807 174.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -67.21 -39.96 86.39 Favored 'General case' 0 C--N 1.37 1.469 0 O-C-N 120.604 -1.31 . . . . 0.0 113.265 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -75.7 -38.57 58.51 Favored 'General case' 0 CA--C 1.484 -1.575 0 C-N-CA 126.37 1.868 . . . . 0.0 111.642 -176.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.35 -44.96 67.07 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 124.055 0.942 . . . . 0.0 113.175 174.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.484 ' HB2' HD22 ' A' ' 78' ' ' ASN 0.362 96.5 p -71.41 -31.38 67.18 Favored 'General case' 0 C--N 1.355 0.824 0 O-C-N 121.214 -0.929 . . . . 0.0 113.159 177.1 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -69.69 -48.49 59.47 Favored 'General case' 0 C--N 1.367 1.355 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 164.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.1 67.69 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 126.48 1.912 . . . . 0.0 114.612 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.9 -13.67 62.36 Favored 'General case' 0 C--N 1.378 1.805 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 164.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.22 18.05 30.03 Favored Glycine 0 C--N 1.375 2.731 0 O-C-N 120.823 -1.173 . . . . 0.0 113.576 171.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.491 HG12 ' HB3' ' A' ' 78' ' ' ASN 0.256 0.8 OUTLIER -113.25 169.08 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -174.603 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.5 t -30.37 -78.3 0.02 OUTLIER 'General case' 0 C--N 1.357 0.919 1 C-N-CA 132.825 4.45 . . . . 0.0 117.242 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.5 m 122.73 146.86 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 131.483 3.913 . . . . 0.0 102.521 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 30.5 p90 -122.98 154.6 38.21 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 124.713 1.205 . . . . 0.0 109.012 174.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -101.3 144.66 29.87 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.289 2.5 pp -125.86 159.6 32.07 Favored 'General case' 0 CA--C 1.49 -1.349 0 O-C-N 119.207 -2.183 . . . . 0.0 111.066 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -133.79 165.98 23.72 Favored 'General case' 0 CA--C 1.485 -1.537 0 N-CA-C 102.059 -3.311 . . . . 0.0 102.059 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 131' ' ' CYS . 0.1 OUTLIER -152.98 147.2 25.66 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -179.453 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -95.24 124.94 39.54 Favored 'General case' 0 C--N 1.359 0.994 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 176.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.325 0.4 OUTLIER -79.51 -11.03 59.9 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 117.975 -1.012 . . . . 0.0 113.342 -179.439 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.73 -37.98 48.11 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 127.639 2.375 . . . . 0.0 112.34 176.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.3 tp -62.79 -41.02 99.09 Favored 'General case' 0 C--N 1.359 1.007 0 CA-C-O 126.536 3.065 . . . . 0.0 111.544 168.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.501 ' HG ' ' CZ ' ' A' ' 18' ' ' PHE 0.401 6.8 tt -76.62 -41.43 45.98 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 110.299 -3.137 . . . . 0.0 109.231 -172.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -54.65 -38.24 66.66 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 129.147 2.979 . . . . 0.0 111.746 165.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -66.23 -42.29 88.85 Favored 'General case' 0 C--N 1.376 1.724 0 O-C-N 119.735 -1.853 . . . . 0.0 112.136 169.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.69 67.05 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 118.693 -2.504 . . . . 0.0 116.959 170.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.401 0.2 OUTLIER -69.29 -41.81 81.15 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 C-N-CA 131.582 3.953 . . . . 0.0 111.972 179.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.05 -28.86 10.79 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 171.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -83.54 -27.31 29.41 Favored 'General case' 0 C--N 1.371 1.517 0 CA-C-N 122.277 2.308 . . . . 0.0 111.422 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -103.55 -70.11 0.77 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.931 1.693 . . . . 0.0 111.384 173.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.566 0.0 OUTLIER 83.78 155.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 127.082 2.153 . . . . 0.0 111.568 -179.419 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . 0.257 47.0 p30 31.83 47.43 0.07 Allowed 'General case' 0 N--CA 1.519 3.011 1 C-N-CA 132.483 4.313 . . . . 0.0 116.675 -177.296 . . . . . . . . 3 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.404 11.3 pt-20 -82.03 69.88 8.83 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-O 125.005 2.336 . . . . 0.0 113.358 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.414 1.2 p -81.67 -19.09 42.35 Favored 'General case' 0 N--CA 1.426 -1.637 0 C-N-CA 131.687 3.995 . . . . 0.0 113.819 164.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.488 ' CZ ' HG22 ' A' ' 136' ' ' ILE . 0.0 OUTLIER -65.42 -35.53 81.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 130.322 3.449 . . . . 0.0 109.157 171.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.52 ' HA ' HD12 ' A' ' 111' ' ' LEU . 3.0 t -58.71 -46.1 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.845 0 C-N-CA 129.668 3.187 . . . . 0.0 110.442 176.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.407 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.254 60.3 m-85 -60.55 -45.18 94.86 Favored 'General case' 0 C--O 1.212 -0.875 1 C-N-CA 131.812 4.045 . . . . 0.0 114.065 166.91 . . . . . . . . 4 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -68.32 -37.98 81.1 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 121.507 1.958 . . . . 0.0 114.049 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.451 ' HG ' ' HG ' ' A' ' 111' ' ' LEU . 1.3 tm? -65.1 -52.4 55.69 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 125.116 1.366 . . . . 0.0 112.087 168.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.448 ' CD1' ' CD1' ' A' ' 25' ' ' ILE 0.677 0.0 OUTLIER -78.44 -17.76 55.89 Favored 'General case' 0 C--N 1.38 1.896 0 CA-C-N 121.967 2.167 . . . . 0.0 116.158 -177.299 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -78.08 -22.97 48.22 Favored 'General case' 0 C--N 1.355 0.826 0 C-N-CA 128.0 2.52 . . . . 0.0 109.576 165.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -76.91 -36.93 56.28 Favored 'General case' 0 C--N 1.381 1.96 0 O-C-N 120.379 -1.451 . . . . 0.0 110.46 170.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.641 HD12 ' HG1' ' A' ' 152' ' ' THR 0.356 0.0 OUTLIER -92.92 -7.55 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.295 0 N-CA-C 120.74 3.608 . . . . 0.0 120.74 -178.777 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -47.69 -1.45 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 1 C-N-CA 133.725 4.81 . . . . 0.0 116.998 -175.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.43 ' H ' ' C ' ' A' ' 70' ' ' ILE . 18.4 t70 -83.67 -43.23 15.79 Favored 'General case' 0 C--N 1.362 1.116 1 C-N-CA 139.079 6.952 . . . . 0.0 110.353 172.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.601 ' CG ' ' HA ' ' A' ' 153' ' ' GLN . 0.2 OUTLIER -62.57 -9.76 9.87 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 131.343 3.857 . . . . 0.0 115.895 -174.001 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 p -60.49 -20.73 21.47 Favored 'Isoleucine or valine' 0 C--N 1.375 1.702 0 C-N-CA 127.937 2.495 . . . . 0.0 110.959 166.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.99 -35.15 66.8 Favored 'General case' 0 C--N 1.378 1.812 0 C-N-CA 130.339 3.456 . . . . 0.0 111.362 171.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.334 36.2 mt-10 -76.85 -32.61 57.66 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.229 -1.544 . . . . 0.0 113.118 170.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.383 0.8 OUTLIER -68.95 -29.94 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 CA-C-O 126.66 3.124 . . . . 0.0 110.12 167.867 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.491 ' HB3' HG12 ' A' ' 38' ' ' VAL . 11.8 m120 -68.04 -32.5 72.91 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 117.921 -2.987 . . . . 0.0 113.583 165.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.56 -30.03 71.2 Favored 'General case' 0 C--N 1.378 1.82 0 C-N-CA 125.882 1.673 . . . . 0.0 111.534 165.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.425 ' CE2' HG22 ' A' ' 117' ' ' VAL 0.389 6.6 t80 -65.35 -32.05 73.5 Favored 'General case' 0 CA--C 1.583 2.226 0 C-N-CA 126.864 2.066 . . . . 0.0 112.733 164.082 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.9 tp . . . . . 0 N--CA 1.523 3.214 0 CA-C-O 125.09 2.376 . . . . 0.0 114.071 162.785 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.124 0 CA-C-O 123.35 1.528 . . . . 0.0 115.155 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -141.06 151.7 44.23 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.286 -1.714 . . . . 0.0 107.902 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.0 mt -109.61 114.11 27.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -128.81 109.42 11.26 Favored 'General case' 0 CA--C 1.496 -1.107 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 -173.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.3 pp -136.63 141.01 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.075 0 C-N-CA 125.752 1.621 . . . . 0.0 111.837 -171.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.5 m -117.9 118.47 32.09 Favored 'General case' 0 C--N 1.351 0.641 0 O-C-N 119.652 -1.905 . . . . 0.0 111.873 177.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.263 0.4 OUTLIER -176.6 170.36 2.45 Favored 'General case' 0 CA--C 1.479 -1.762 0 N-CA-C 102.724 -3.065 . . . . 0.0 102.724 172.727 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.49 ' O ' ' HB2' ' A' ' 110' ' ' ASN . . . 94.0 -34.15 4.83 Favored Glycine 1 CA--C 1.417 -6.074 0 CA-C-O 115.044 -3.087 . . . . 0.0 110.753 -160.863 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 29.9 m-80 100.76 0.71 0.02 OUTLIER 'General case' 0 C--N 1.375 1.684 2 C-N-CA 132.232 4.213 . . . . 0.0 106.381 -157.448 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.52 HD12 ' HA ' ' A' ' 63' ' ' VAL 0.308 1.0 OUTLIER -86.72 137.03 32.79 Favored 'General case' 0 C--N 1.354 0.787 1 C-N-CA 138.103 6.561 . . . . 0.0 114.216 -178.681 . . . . . . . . 5 4 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.71 100.64 13.32 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 164.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.22 126.82 41.7 Favored 'General case' 0 C--N 1.382 1.981 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 175.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.66 123.71 5.32 Favored Glycine 0 C--N 1.351 1.391 0 N-CA-C 105.899 -2.881 . . . . 0.0 105.899 174.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -122.97 127.3 48.66 Favored 'General case' 0 C--N 1.369 1.446 1 N-CA-C 99.648 -4.204 . . . . 0.0 99.648 174.713 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.1 m -121.18 127.88 51.93 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 -171.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.425 HG22 ' CE2' ' A' ' 80' ' ' PHE . 13.4 t -80.24 138.73 19.31 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.558 10.9 p -54.41 67.7 0.0 OUTLIER 'General case' 0 C--N 1.378 1.84 0 N-CA-C 120.845 3.646 . . . . 0.0 120.845 -162.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.465 11.8 ttmm -22.48 -45.81 0.05 OUTLIER Pre-proline 0 C--N 1.359 0.997 1 C-N-CA 133.999 4.92 . . . . 0.0 121.795 -170.251 . . . . . . . . 3 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -70.63 60.18 2.12 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 CA-C-N 125.647 3.053 . . . . 0.0 113.595 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 170.07 161.99 0.07 Allowed 'General case' 0 C--N 1.367 1.335 0 C-N-CA 128.038 2.535 . . . . 0.0 113.521 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.481 ' C ' ' H ' ' A' ' 124' ' ' PHE . 2.5 tt0 -85.28 -69.63 0.64 Allowed 'General case' 0 C--N 1.376 1.744 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 152.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 44.37 -10.76 0.0 OUTLIER 'General case' 0 C--N 1.363 1.173 1 C-N-CA 139.648 7.179 . . . . 0.0 118.018 -170.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.481 ' H ' ' C ' ' A' ' 122' ' ' GLU . 56.4 m-85 -138.9 -163.01 1.4 Allowed 'General case' 0 N--CA 1.414 -2.245 0 N-CA-C 121.212 3.782 . . . . 0.0 121.212 -161.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.364 0.0 OUTLIER -167.84 -56.4 0.02 OUTLIER 'General case' 0 C--N 1.359 1.019 2 C-N-CA 139.725 7.21 . . . . 0.0 105.484 179.051 . . . . . . . . 4 3 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -89.31 85.26 0.13 Allowed Pre-proline 0 C--N 1.357 0.894 1 C-N-CA 131.999 4.119 . . . . 0.0 111.912 171.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -90.72 -176.08 0.94 Allowed 'Trans proline' 0 CA--C 1.488 -1.782 0 C-N-CA 124.136 3.224 . . . . 0.0 117.297 -161.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 16.6 m -112.41 136.07 52.34 Favored 'General case' 0 N--CA 1.439 -1.006 1 N-CA-C 100.192 -4.003 . . . . 0.0 100.192 162.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.5 mp -100.73 140.83 34.46 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 102.415 -3.18 . . . . 0.0 102.415 -175.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -100.28 -0.58 38.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.889 -1.132 . . . . 0.0 110.412 -166.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 45' ' ' TYR . 8.4 t 174.21 128.92 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -170.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -115.59 109.79 18.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 101.309 -3.589 . . . . 0.0 101.309 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 10.3 ttt -104.28 122.66 45.87 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.191 2.196 . . . . 0.0 107.423 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.301 . . -129.07 113.74 15.51 Favored 'General case' 0 N--CA 1.435 -1.213 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 173.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -144.24 159.98 15.37 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 C-N-CA 125.378 1.471 . . . . 0.0 111.836 -176.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.488 HG22 ' CZ ' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -140.11 -179.08 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 128.236 2.614 . . . . 0.0 108.989 -175.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.12 122.98 18.88 Favored 'General case' 0 CA--C 1.56 1.331 0 N-CA-C 117.938 2.57 . . . . 0.0 117.938 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.326 46.5 m 172.72 -76.01 0.0 OUTLIER 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.989 2.915 . . . . 0.0 105.486 177.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 168.45 -123.78 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.156 1 N-CA-C 95.722 -5.659 . . . . 0.0 95.722 -172.363 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -58.94 -24.72 62.82 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 130.979 3.711 . . . . 0.0 119.682 173.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.466 ' CD2' ' HB ' ' A' ' 136' ' ' ILE 0.359 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.125 2 C-N-CA 135.802 5.641 . . . . 0.0 124.276 178.991 . . . . . . . . 4 3 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.466 -2.251 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -77.82 115.24 17.41 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 105.433 -2.062 . . . . 0.0 105.433 176.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' THR . . . . . 0.641 ' HG1' HD12 ' A' ' 70' ' ' ILE . 11.0 t -75.38 143.84 42.57 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -124.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.601 ' HA ' ' CG ' ' A' ' 73' ' ' HIS . 3.1 tp60 . . . . . 0 C--O 1.263 1.764 0 C-N-CA 129.235 3.014 . . . . 0.0 109.841 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.452 2.5 m120 . . . . . 0 C--O 1.225 -0.202 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 -58.21 1.92 Allowed 'General case' 0 C--O 1.246 0.906 1 C-N-CA 132.504 4.321 . . . . 0.0 105.465 160.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.436 6.7 mt-10 -63.99 -8.74 12.47 Favored 'General case' 0 C--O 1.205 -1.243 0 O-C-N 119.49 -2.006 . . . . 0.0 115.358 177.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 p -67.93 -35.65 72.82 Favored 'Isoleucine or valine' 0 C--N 1.365 1.262 0 C-N-CA 131.488 3.915 . . . . 0.0 113.339 171.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -78.64 -43.81 25.32 Favored 'General case' 0 CA--C 1.497 -1.095 1 C-N-CA 133.062 4.545 . . . . 0.0 107.721 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.7 mt -64.39 -44.1 97.11 Favored 'Isoleucine or valine' 0 C--N 1.374 1.658 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.423 166.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.444 ' HE ' HD13 ' A' ' 58' ' ' ILE 0.267 26.5 mmm-85 -54.8 -50.34 68.76 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 130.576 3.55 . . . . 0.0 111.536 174.259 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -57.89 -36.72 72.8 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 118.596 2.813 . . . . 0.0 118.596 163.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -76.64 -44.43 34.09 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 118.17 -2.831 . . . . 0.0 113.259 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 30.6 mmmt -63.67 -30.43 71.54 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 131.075 3.75 . . . . 0.0 106.95 172.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.439 HD22 ' HB2' ' A' ' 17' ' ' HIS . 0.5 OUTLIER -67.87 -41.02 83.47 Favored 'General case' 0 C--N 1.373 1.619 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 162.334 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.4 mtp180 -60.15 -38.06 82.01 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.404 2.82 . . . . 0.0 112.425 171.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.8 mmt-85 -63.23 -53.25 55.97 Favored 'General case' 0 C--N 1.374 1.641 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.439 ' HB2' HD22 ' A' ' 14' ' ' LEU . 8.4 m-70 -59.07 -50.37 74.33 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 130.226 3.41 . . . . 0.0 112.343 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.483 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.62 -54.1 49.39 Favored 'General case' 0 C--N 1.378 1.819 0 C-N-CA 130.176 3.391 . . . . 0.0 111.165 176.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -73.57 -38.75 65.08 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -65.59 -43.73 88.8 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 125.438 1.495 . . . . 0.0 112.826 177.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.512 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.257 44.2 mt-10 -75.26 -28.99 60.03 Favored 'General case' 0 C--N 1.361 1.096 0 O-C-N 121.08 -1.012 . . . . 0.0 111.732 171.525 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.409 ' CE2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -67.89 -28.65 67.69 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 117.883 -3.011 . . . . 0.0 114.827 171.103 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -69.16 -37.04 78.02 Favored 'General case' 0 C--N 1.372 1.567 0 C-N-CA 125.629 1.572 . . . . 0.0 109.393 165.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.529 HE21 ' CE1' ' A' ' 68' ' ' HIS . 27.8 tt0 -58.9 -43.15 90.97 Favored 'General case' 0 C--N 1.369 1.451 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 169.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -72.42 -46.23 57.01 Favored 'Isoleucine or valine' 0 C--N 1.366 1.32 0 O-C-N 121.267 -0.896 . . . . 0.0 111.626 176.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.471 ' HA ' ' CG1' ' A' ' 29' ' ' ILE 0.634 17.7 p30 -71.98 -22.62 61.41 Favored 'General case' 0 C--N 1.372 1.586 0 O-C-N 119.733 -1.855 . . . . 0.0 115.447 175.837 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -74.37 -43.11 57.92 Favored 'General case' 0 C--N 1.373 1.591 0 O-C-N 119.754 -1.841 . . . . 0.0 110.508 166.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.433 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.312 0.3 OUTLIER -64.86 -32.73 74.57 Favored 'General case' 0 C--N 1.395 2.576 0 O-C-N 118.756 -2.465 . . . . 0.0 113.526 173.196 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.471 ' CG1' ' HA ' ' A' ' 26' ' ' ASN 0.262 1.5 pp -67.84 -43.45 86.11 Favored 'Isoleucine or valine' 0 C--N 1.375 1.681 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 174.03 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.0 ttm105 -62.84 -37.67 87.72 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 119.748 -1.845 . . . . 0.0 115.853 174.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -76.59 -48.66 18.48 Favored 'General case' 0 CA--C 1.478 -1.793 0 C-N-CA 127.756 2.423 . . . . 0.0 111.27 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.52 -34.74 76.41 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 t -73.45 -43.33 60.53 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.281 1.432 . . . . 0.0 110.73 175.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -70.74 -35.72 72.82 Favored 'General case' 0 C--N 1.375 1.711 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.75 -32.7 62.17 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 126.194 1.798 . . . . 0.0 113.748 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -16.54 60.54 Favored 'General case' 0 C--N 1.385 2.125 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.56 18.38 28.25 Favored Glycine 0 C--N 1.37 2.426 0 O-C-N 121.123 -0.985 . . . . 0.0 115.289 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.442 ' CG2' ' N ' ' A' ' 39' ' ' SER . 0.6 OUTLIER -104.1 166.93 2.85 Favored 'Isoleucine or valine' 0 C--N 1.357 0.917 0 N-CA-C 101.722 -3.436 . . . . 0.0 101.722 176.03 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.442 ' N ' ' CG2' ' A' ' 38' ' ' VAL 0.298 0.0 OUTLIER -39.18 160.87 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.115 1 C-N-CA 134.417 5.087 . . . . 0.0 118.011 159.925 . . . . . . . . 5 4 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.9 p -103.89 117.76 35.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 118.808 -2.433 . . . . 0.0 110.034 -173.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -118.28 153.24 34.28 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-O 122.034 0.921 . . . . 0.0 110.372 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -113.83 105.8 13.7 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.485 ' HA ' ' HB2' ' A' ' 129' ' ' LEU 0.356 0.1 OUTLIER -94.58 120.71 35.24 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 118.845 -2.409 . . . . 0.0 111.671 -169.347 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -132.55 145.23 50.97 Favored 'General case' 0 C--N 1.4 2.801 0 CA-C-N 120.64 1.564 . . . . 0.0 109.426 -170.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.409 ' CD2' ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -92.65 147.32 22.97 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.582 3.153 . . . . 0.0 114.897 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.4 p -108.45 96.81 6.6 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 128.625 2.77 . . . . 0.0 105.543 175.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -48.03 -8.43 0.02 OUTLIER 'General case' 0 C--O 1.2 -1.508 1 C-N-CA 132.056 4.142 . . . . 0.0 119.773 -174.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.34 81.43 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 125.383 3.72 . . . . 0.0 116.695 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.488 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.2 -38.96 92.93 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 129.726 3.21 . . . . 0.0 112.997 171.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.488 ' H ' HD22 ' A' ' 49' ' ' LEU . 5.9 tt -72.01 -36.59 69.76 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 127.456 2.303 . . . . 0.0 111.062 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.58 -30.41 71.13 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 129.642 3.177 . . . . 0.0 108.82 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -69.4 -45.68 68.67 Favored 'General case' 0 C--N 1.37 1.499 0 CA-C-O 124.306 2.003 . . . . 0.0 115.315 164.325 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.482 ' HA ' HD21 ' A' ' 141' ' ' LEU . . . -75.52 -27.83 58.89 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 117.574 2.435 . . . . 0.0 117.574 -172.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.412 ' HB ' HD23 ' A' ' 50' ' ' LEU . 5.2 tt -74.35 -37.61 45.48 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.845 1 C-N-CA 132.941 4.496 . . . . 0.0 110.587 176.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -107.94 -29.17 9.18 Favored 'General case' 0 C--N 1.38 1.904 0 N-CA-C 117.862 2.541 . . . . 0.0 117.862 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.81 -45.32 17.12 Favored 'General case' 0 C--N 1.357 0.933 0 CA-C-N 121.663 2.029 . . . . 0.0 114.35 -172.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.518 ' HB3' ' HA ' ' A' ' 141' ' ' LEU 0.276 0.0 OUTLIER -103.35 -44.05 5.26 Favored 'General case' 0 CA--C 1.48 -1.749 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 171.423 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.444 HD13 ' HE ' ' A' ' 10' ' ' ARG 0.488 0.0 OUTLIER 74.82 -168.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.854 1 C-N-CA 131.984 4.114 . . . . 0.0 112.638 179.132 . . . . . . . . 5 4 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . 0.252 50.2 p30 21.94 49.54 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 1 C-N-CA 131.909 4.083 . . . . 0.0 117.786 179.002 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.458 ' O ' ' HB ' ' A' ' 63' ' ' VAL 0.5 11.4 pt-20 -80.76 62.99 5.0 Favored 'General case' 0 C--N 1.362 1.12 0 CA-C-O 127.308 3.432 . . . . 0.0 112.227 -172.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.561 1.4 p -80.64 -15.67 56.0 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.223 2.609 . . . . 0.0 116.994 176.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.406 ' CE2' HD11 ' A' ' 111' ' ' LEU . 4.0 t80 -71.44 -33.28 69.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.823 2.449 . . . . 0.0 107.871 167.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.458 ' HB ' ' O ' ' A' ' 60' ' ' GLU . 94.0 t -69.61 -36.21 69.66 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 128.059 2.544 . . . . 0.0 108.945 175.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.512 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 31.5 m-85 -66.92 -34.91 78.82 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.498 1.919 . . . . 0.0 115.826 164.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -83.01 -36.72 24.79 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-N 122.032 2.196 . . . . 0.0 112.086 -176.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 108' ' ' ASP . 2.8 tt -65.41 -42.61 92.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.648 1.579 . . . . 0.0 110.934 167.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.403 ' HA ' HG12 ' A' ' 70' ' ' ILE 0.926 0.0 OUTLIER -77.84 -15.15 59.27 Favored 'General case' 0 C--N 1.368 1.387 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 173.596 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.529 ' CE1' HE21 ' A' ' 24' ' ' GLN 0.283 41.6 m-70 -83.77 -15.83 47.03 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 127.221 2.209 . . . . 0.0 112.042 166.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.489 0.0 OUTLIER -82.91 -27.49 30.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 119.973 -1.705 . . . . 0.0 109.107 155.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.666 HD11 ' CE1' ' A' ' 73' ' ' HIS . 18.7 mm -67.57 -9.55 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 C-N-CA 127.502 2.321 . . . . 0.0 113.537 170.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HB2' ' CD ' ' A' ' 28' ' ' GLU . 62.2 pttt -49.98 -33.84 19.1 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 120.609 3.559 . . . . 0.0 120.609 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -101.62 8.41 41.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.517 -1.364 . . . . 0.0 107.454 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.666 ' CE1' HD11 ' A' ' 70' ' ' ILE . 10.7 m170 -66.87 -8.88 32.32 Favored 'General case' 0 C--N 1.395 2.569 0 C-N-CA 129.125 2.97 . . . . 0.0 110.988 171.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -41.38 -46.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 128.968 2.907 . . . . 0.0 112.02 157.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.46 -23.88 64.65 Favored 'General case' 0 C--N 1.36 1.045 0 N-CA-C 117.563 2.431 . . . . 0.0 117.563 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -75.47 -46.63 31.34 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.541 1.536 . . . . 0.0 111.686 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.39 14.7 p -66.3 -29.0 45.25 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.4 0 C-N-CA 127.474 2.31 . . . . 0.0 110.206 172.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.417 ' HB3' HG21 ' A' ' 38' ' ' VAL . 73.0 m-20 -74.19 -38.69 63.55 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 128.285 2.634 . . . . 0.0 116.67 169.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -30.42 71.16 Favored 'General case' 0 C--N 1.372 1.555 0 C-N-CA 126.156 1.782 . . . . 0.0 110.896 172.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.22 -38.96 82.42 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 128.577 2.751 . . . . 0.0 112.283 166.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 tp . . . . . 0 C--N 1.368 1.393 0 C-N-CA 128.551 2.74 . . . . 0.0 118.134 171.541 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.729 0 CA-C-O 122.408 1.005 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.54 147.63 34.97 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 127.193 2.197 . . . . 0.0 113.975 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.7 tt -135.38 123.74 23.27 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -129.54 130.25 45.52 Favored 'General case' 0 C--N 1.365 1.279 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . 0.493 0.0 OUTLIER -135.27 140.72 44.4 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.294 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.9 t -124.71 143.6 50.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 119.223 -2.173 . . . . 0.0 113.213 -173.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.405 ' HB3' HD22 ' A' ' 66' ' ' LEU . 27.0 t70 -124.64 82.77 2.08 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 120.018 -1.677 . . . . 0.0 108.322 174.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.52 -47.0 0.05 OUTLIER Glycine 0 C--N 1.368 2.339 0 C-N-CA 129.78 3.562 . . . . 0.0 119.419 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -119.24 -49.17 2.4 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 128.219 2.608 . . . . 0.0 107.421 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.406 HD11 ' CE2' ' A' ' 62' ' ' TYR 0.318 5.6 mp -80.05 134.45 36.21 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 122.382 2.355 . . . . 0.0 117.062 179.234 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -104.81 101.64 11.23 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 104.987 -2.227 . . . . 0.0 104.987 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.491 ' HG ' HG13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -102.87 122.01 43.67 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 177.616 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.79 135.38 12.49 Favored Glycine 0 C--N 1.356 1.671 0 N-CA-C 106.76 -2.536 . . . . 0.0 106.76 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.9 135.58 48.52 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' A' ' 131' ' ' CYS . 48.5 m -135.5 134.62 39.69 Favored 'General case' 0 C--N 1.371 1.523 0 O-C-N 119.049 -2.282 . . . . 0.0 105.248 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 14.9 m -66.48 166.46 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.572 0 C-N-CA 125.385 1.474 . . . . 0.0 111.936 177.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.371 24.4 p -67.45 63.19 0.07 Allowed 'General case' 0 C--N 1.35 0.63 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -24.43 -47.0 0.09 OUTLIER Pre-proline 0 C--N 1.353 0.756 1 C-N-CA 137.356 6.262 . . . . 0.0 118.988 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -73.72 53.06 2.66 Favored 'Trans proline' 0 CA--C 1.566 2.109 0 C-N-CA 123.718 2.945 . . . . 0.0 113.364 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -159.23 152.34 22.22 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.914 2.086 . . . . 0.0 110.706 -175.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -126.09 11.25 7.61 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 120.472 1.487 . . . . 0.0 112.465 170.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.314 0.0 OUTLIER -95.34 2.83 54.81 Favored 'General case' 0 C--N 1.364 1.215 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 -176.361 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.458 ' HB2' ' HD3' ' A' ' 125' ' ' LYS 0.53 0.0 OUTLIER -45.66 149.75 0.57 Allowed 'General case' 0 C--N 1.353 0.741 1 N-CA-C 122.074 4.101 . . . . 0.0 122.074 178.427 . . . . . . . . 5 4 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.593 ' H ' ' HD3' ' A' ' 127' ' ' PRO 0.816 10.8 mmtt 125.01 92.79 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.594 1 C-N-CA 134.606 5.162 . . . . 0.0 103.787 169.766 . . . . . . . . 4 3 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.455 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.8 t70 112.51 13.48 0.0 OUTLIER Pre-proline 0 CA--C 1.592 2.572 1 C-N-CA 131.706 4.002 . . . . 0.0 113.49 -156.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.593 ' HD3' ' H ' ' A' ' 125' ' ' LYS . 85.0 Cg_endo -63.88 -175.44 0.29 Allowed 'Trans proline' 0 C--N 1.387 2.556 2 C-N-CA 127.987 5.791 . . . . 0.0 119.364 175.23 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 38.4 m -101.99 164.52 11.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 109.905 -3.316 . . . . 0.0 104.467 170.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 43' ' ' LEU . 5.8 mp -102.48 143.5 32.11 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 102.406 -3.183 . . . . 0.0 102.406 171.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.02 53.99 1.97 Allowed 'General case' 0 CA--C 1.484 -1.583 0 N-CA-C 104.243 -2.503 . . . . 0.0 104.243 -170.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.408 ' HB2' ' HB ' ' A' ' 116' ' ' THR . 1.8 m 147.28 104.2 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 104.587 -2.375 . . . . 0.0 104.587 -175.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -117.39 112.76 21.12 Favored 'General case' 0 N--CA 1.439 -0.992 1 N-CA-C 99.667 -4.198 . . . . 0.0 99.667 166.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.0 ttt -109.07 126.83 53.58 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.28 114.91 17.51 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 171.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -137.57 157.58 33.83 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.205 1.802 . . . . 0.0 108.092 178.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.08 175.08 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 N-CA-C 100.546 -3.872 . . . . 0.0 100.546 173.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -115.08 137.86 51.53 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.592 3.157 . . . . 0.0 106.194 168.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.413 ' HB2' ' HD2' ' A' ' 139' ' ' ARG . 17.5 m -140.63 -127.09 0.1 Allowed 'General case' 0 CA--C 1.502 -0.875 0 CA-C-N 121.009 1.731 . . . . 0.0 112.872 -178.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.511 ' CD ' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -92.82 -85.11 0.27 Allowed 'General case' 0 N--CA 1.428 -1.55 1 C-N-CA 134.184 4.994 . . . . 0.0 105.671 179.97 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.511 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 5.5 ptp180 -94.23 -9.06 37.43 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 128.376 2.67 . . . . 0.0 112.907 174.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.518 ' HA ' ' HB3' ' A' ' 57' ' ' GLU 0.508 0.4 OUTLIER . . . . . 0 C--N 1.382 1.984 0 C-N-CA 129.407 3.083 . . . . 0.0 110.315 -177.688 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.357 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.5 0.0 OUTLIER -122.69 153.88 38.82 Favored 'General case' 0 CA--C 1.478 -1.818 1 C-N-CA 132.527 4.331 . . . . 0.0 104.652 167.956 . . . . . . . . 4 3 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . 0.339 9.2 t -70.65 97.9 1.42 Allowed 'General case' 0 N--CA 1.431 -1.375 1 CA-C-O 131.763 5.554 . . . . 0.0 117.932 -150.787 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.638 HE22 ' CE1' ' A' ' 73' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.42 -1.958 3 C-N-CA 148.359 10.663 . . . . 0.0 121.009 166.411 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -60.81 2.05 Favored 'General case' 0 C--N 1.353 0.72 1 C-N-CA 133.602 4.761 . . . . 0.0 110.253 171.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -73.17 -17.28 61.39 Favored 'General case' 0 C--N 1.373 1.588 0 C-N-CA 126.815 2.046 . . . . 0.0 112.571 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . 0.253 0.6 OUTLIER -80.7 -36.61 15.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 127.133 2.173 . . . . 0.0 110.598 175.153 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -64.63 -46.25 83.39 Favored 'General case' 0 C--N 1.375 1.674 0 C-N-CA 128.344 2.657 . . . . 0.0 108.657 175.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.8 mt -54.59 -43.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.362 1.118 0 C-N-CA 126.279 1.831 . . . . 0.0 112.968 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.38 11.0 ttt180 -67.48 -42.91 82.2 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 171.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -60.27 -27.52 67.32 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 165.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -76.91 -50.72 12.66 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 130.315 3.446 . . . . 0.0 109.99 173.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -57.25 -29.22 63.63 Favored 'General case' 0 C--N 1.378 1.814 0 C-N-CA 128.234 2.614 . . . . 0.0 110.666 170.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.0 tp -72.08 -44.14 63.72 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 124.319 1.048 . . . . 0.0 113.664 168.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -54.9 -43.66 73.46 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.319 -1.488 . . . . 0.0 110.607 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.2 mtp85 -63.39 -46.1 87.99 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 166.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.38 -47.84 82.55 Favored 'General case' 0 C--N 1.384 2.077 0 C-N-CA 130.111 3.364 . . . . 0.0 113.268 175.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.514 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.91 -46.71 83.6 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 130.407 3.483 . . . . 0.0 110.732 176.212 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.93 -42.66 57.29 Favored 'General case' 0 C--N 1.377 1.765 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.7 m -68.31 -43.09 78.4 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 127.023 2.129 . . . . 0.0 112.281 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.507 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.409 43.8 mt-10 -74.55 -28.72 61.07 Favored 'General case' 0 C--N 1.364 1.208 0 O-C-N 120.442 -1.411 . . . . 0.0 112.223 169.334 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.256 0.6 OUTLIER -60.71 -34.07 73.83 Favored 'General case' 0 C--N 1.38 1.924 0 O-C-N 119.035 -2.291 . . . . 0.0 112.978 165.384 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.7 mtt85 -66.23 -35.81 81.38 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 120.648 -1.283 . . . . 0.0 112.101 166.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.44 ' CG ' ' CE1' ' A' ' 68' ' ' HIS . 8.6 tp-100 -60.8 -46.74 89.32 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 116.879 2.178 . . . . 0.0 116.879 166.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.557 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.2 mt -70.98 -45.07 74.81 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 O-C-N 120.657 -1.277 . . . . 0.0 111.756 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.646 0.5 OUTLIER -71.28 -23.68 62.01 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 119.346 -2.097 . . . . 0.0 114.929 175.203 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -73.11 -35.2 66.53 Favored 'General case' 0 C--N 1.384 2.085 0 O-C-N 121.244 -0.91 . . . . 0.0 110.822 169.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -66.51 -39.74 88.84 Favored 'General case' 0 C--N 1.391 2.408 0 O-C-N 119.127 -2.233 . . . . 0.0 112.002 169.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.4 mp -61.99 -46.32 96.75 Favored 'Isoleucine or valine' 0 C--N 1.37 1.457 0 CA-C-N 119.52 1.055 . . . . 0.0 113.567 172.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 -59.46 -39.96 85.33 Favored 'General case' 0 C--N 1.357 0.92 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 173.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -76.49 -44.71 34.19 Favored 'General case' 0 CA--C 1.487 -1.45 0 O-C-N 119.428 -2.045 . . . . 0.0 111.183 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.88 -44.84 60.83 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 124.764 1.226 . . . . 0.0 114.031 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.2 t -69.38 -28.8 66.49 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 120.106 -1.621 . . . . 0.0 110.899 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -75.75 -41.0 54.45 Favored 'General case' 0 C--N 1.389 2.309 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 165.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.22 -31.93 64.45 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 127.059 2.144 . . . . 0.0 114.809 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.67 -12.34 59.99 Favored 'General case' 0 C--N 1.382 1.99 0 O-C-N 121.107 -0.996 . . . . 0.0 111.691 166.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.66 18.16 60.58 Favored Glycine 0 C--N 1.381 3.065 0 O-C-N 120.813 -1.179 . . . . 0.0 114.813 168.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . 0.394 0.7 OUTLIER -99.2 178.88 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.168 0 C-N-CA 126.917 2.087 . . . . 0.0 110.344 -172.871 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 t -29.23 -55.11 0.14 Allowed 'General case' 0 N--CA 1.488 1.439 1 C-N-CA 132.127 4.171 . . . . 0.0 116.984 -174.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.29 3.2 t 82.46 111.65 0.06 Allowed 'General case' 0 C--N 1.359 1.009 0 C-N-CA 131.652 3.981 . . . . 0.0 108.638 -174.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.441 ' CZ ' HG11 ' A' ' 77' ' ' VAL . 3.9 p90 -113.24 158.42 20.51 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 122.347 1.07 . . . . 0.0 111.065 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -100.72 155.66 17.77 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 127.536 2.334 . . . . 0.0 105.371 175.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -119.34 126.02 50.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 O-C-N 120.442 -1.411 . . . . 0.0 108.596 -174.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -115.27 169.92 8.77 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-O 124.298 1.999 . . . . 0.0 108.038 174.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.546 ' CD2' HD11 ' A' ' 50' ' ' LEU 0.293 14.1 m-30 -107.99 172.13 7.01 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.3 2.24 . . . . 0.0 108.623 176.209 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.34 91.36 3.49 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 101.963 -3.347 . . . . 0.0 101.963 153.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . 0.321 0.0 OUTLIER -56.25 -10.46 0.88 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 127.631 2.373 . . . . 0.0 115.654 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.67 -38.74 28.47 Favored 'General case' 0 C--N 1.374 1.652 0 C-N-CA 129.031 2.932 . . . . 0.0 111.222 171.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -46.07 90.04 Favored 'General case' 0 C--N 1.372 1.552 0 CA-C-O 125.297 2.475 . . . . 0.0 108.377 167.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.546 HD11 ' CD2' ' A' ' 45' ' ' TYR 0.298 0.1 OUTLIER -62.9 -37.54 87.35 Favored 'General case' 0 C--O 1.21 -1.017 0 C-N-CA 127.474 2.31 . . . . 0.0 110.192 172.534 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -54.91 -32.74 61.42 Favored 'General case' 0 C--N 1.37 1.472 0 O-C-N 117.603 -3.186 . . . . 0.0 111.876 168.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -74.94 -58.01 3.55 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 158.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.4 -27.47 66.02 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 119.096 2.999 . . . . 0.0 119.096 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.485 ' CG1' HD22 ' A' ' 50' ' ' LEU . 29.8 mt -75.15 -48.62 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.761 0 C-N-CA 129.977 3.311 . . . . 0.0 110.709 172.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.62 -12.12 15.66 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -176.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -78.44 -3.5 43.66 Favored 'General case' 0 C--N 1.365 1.261 0 CA-C-N 122.347 2.339 . . . . 0.0 114.305 -174.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -157.86 -48.99 0.06 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.766 1.626 . . . . 0.0 111.346 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.542 0.2 OUTLIER 83.59 160.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.372 1.587 1 C-N-CA 131.97 4.108 . . . . 0.0 112.036 178.142 . . . . . . . . 4 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.5 t70 38.14 54.29 1.7 Allowed 'General case' 0 N--CA 1.513 2.685 0 C-N-CA 131.465 3.906 . . . . 0.0 114.642 -176.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.543 ' HA ' HH22 ' A' ' 139' ' ' ARG 0.484 10.4 pt-20 -75.92 66.03 2.09 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 125.499 2.571 . . . . 0.0 113.822 178.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.374 18.2 p -79.26 -16.85 55.82 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.925 2.89 . . . . 0.0 114.108 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -65.55 -33.95 77.12 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 129.652 3.181 . . . . 0.0 110.188 166.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.481 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -65.77 -46.68 88.24 Favored 'Isoleucine or valine' 0 C--N 1.362 1.116 0 C-N-CA 127.567 2.347 . . . . 0.0 109.888 -174.403 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.507 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 48.7 m-85 -62.41 -39.54 93.6 Favored 'General case' 0 C--O 1.21 -0.996 1 C-N-CA 132.572 4.349 . . . . 0.0 112.473 168.031 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -66.53 -45.41 79.54 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.724 2.056 . . . . 0.0 112.787 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.406 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.9 tm? -64.79 -49.3 71.22 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.974 1.309 . . . . 0.0 113.104 168.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.883 0.0 OUTLIER -76.38 -16.55 59.69 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 118.818 -2.426 . . . . 0.0 114.996 -176.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.557 ' CE1' HG12 ' A' ' 25' ' ' ILE . 54.5 m-70 -78.69 -27.57 45.1 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.729 2.412 . . . . 0.0 110.249 162.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -79.92 -18.98 49.15 Favored 'General case' 0 C--N 1.366 1.317 0 O-C-N 119.578 -1.951 . . . . 0.0 111.972 166.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.282 0.0 OUTLIER -97.62 -16.23 7.17 Favored 'Isoleucine or valine' 0 C--N 1.369 1.444 0 C-N-CA 127.168 2.187 . . . . 0.0 114.052 -177.348 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -52.15 -4.12 0.03 OUTLIER 'General case' 0 C--N 1.363 1.161 1 C-N-CA 133.973 4.909 . . . . 0.0 119.536 -175.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.262 29.7 t70 -95.77 -3.92 44.89 Favored 'General case' 0 N--CA 1.416 -2.146 1 C-N-CA 133.261 4.624 . . . . 0.0 108.373 178.783 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -57.56 -8.24 0.81 Allowed 'General case' 0 C--N 1.385 2.113 0 C-N-CA 130.282 3.433 . . . . 0.0 114.149 177.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.3 t -42.05 -32.04 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 128.654 2.782 . . . . 0.0 115.225 157.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.52 -37.46 50.89 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.856 2.462 . . . . 0.0 113.326 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.08 -35.81 72.0 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 119.471 -2.018 . . . . 0.0 111.21 172.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.441 HG11 ' CZ ' ' A' ' 41' ' ' PHE 0.541 16.4 t -72.33 -28.55 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.16 0 C-N-CA 129.933 3.293 . . . . 0.0 112.199 173.254 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.01 -43.89 81.72 Favored 'General case' 0 C--N 1.379 1.876 0 C-N-CA 129.914 3.286 . . . . 0.0 111.278 168.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -63.45 -35.77 81.54 Favored 'General case' 0 C--N 1.381 1.973 0 C-N-CA 126.273 1.829 . . . . 0.0 112.182 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.32 -39.14 89.41 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 127.023 2.129 . . . . 0.0 114.539 169.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.373 1.591 0 C-N-CA 130.464 3.506 . . . . 0.0 113.559 173.485 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.9 0 N-CA-C 117.518 1.767 . . . . 0.0 117.518 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -141.31 155.14 46.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 126.363 1.865 . . . . 0.0 107.483 173.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.0 mt -110.66 140.46 44.99 Favored 'General case' 0 C--N 1.348 0.505 0 C-N-CA 127.011 2.125 . . . . 0.0 110.034 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -129.29 110.85 12.29 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 103.877 -2.638 . . . . 0.0 103.877 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 13.9 pt -134.9 139.68 46.91 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.4 m -126.69 111.16 13.95 Favored 'General case' 0 C--N 1.367 1.339 0 N-CA-C 104.234 -2.506 . . . . 0.0 104.234 -176.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -136.78 161.18 36.68 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 103.618 -2.734 . . . . 0.0 103.618 -171.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.406 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 82.65 -58.01 5.02 Favored Glycine 0 N--CA 1.484 1.846 0 O-C-N 120.072 -1.642 . . . . 0.0 116.837 169.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 162.11 -29.77 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.276 1 C-N-CA 136.344 5.858 . . . . 0.0 106.691 -167.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.408 ' HB3' HG22 ' A' ' 136' ' ' ILE 0.588 0.9 OUTLIER -79.67 137.42 37.07 Favored 'General case' 0 C--N 1.375 1.714 2 C-N-CA 132.33 4.252 . . . . 0.0 122.131 -176.858 . . . . . . . . 5 4 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -89.74 101.21 13.91 Favored 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 103.668 -2.716 . . . . 0.0 103.668 171.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.343 22.8 mt -94.23 137.49 33.34 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.1 2.16 . . . . 0.0 106.404 -178.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.82 132.69 8.51 Favored Glycine 0 C--N 1.349 1.268 0 O-C-N 119.761 -1.837 . . . . 0.0 110.372 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . 0.266 1.7 m-30 -120.47 140.13 51.86 Favored 'General case' 0 C--N 1.368 1.408 0 N-CA-C 101.407 -3.553 . . . . 0.0 101.407 172.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 92.5 m -124.82 151.84 44.7 Favored 'General case' 0 CA--C 1.49 -1.347 1 N-CA-C 99.833 -4.136 . . . . 0.0 99.833 171.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 45.4 t -74.33 156.61 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 126.47 1.908 . . . . 0.0 107.931 169.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.511 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.29 72.2 m -68.54 95.49 0.64 Allowed 'General case' 0 C--N 1.362 1.133 0 CA-C-O 123.849 1.785 . . . . 0.0 109.097 164.76 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -71.94 -40.09 7.58 Favored Pre-proline 0 N--CA 1.432 -1.374 0 C-N-CA 130.795 3.638 . . . . 0.0 112.875 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -74.29 59.74 4.69 Favored 'Trans proline' 0 CA--C 1.559 1.73 0 CA-C-N 127.028 3.546 . . . . 0.0 114.122 174.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.403 ' CG ' ' H ' ' A' ' 122' ' ' GLU 0.361 4.3 p30 -162.54 -80.55 0.04 OUTLIER 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.405 2.282 . . . . 0.0 110.502 173.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.403 ' H ' ' CG ' ' A' ' 121' ' ' ASN 0.403 23.9 tt0 19.52 88.29 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.7 2 C-N-CA 137.796 6.438 . . . . 0.0 122.498 -174.741 . . . . . . . . 4 3 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -118.66 0.51 11.51 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 129.821 3.248 . . . . 0.0 107.661 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -114.88 -144.46 0.39 Allowed 'General case' 0 C--N 1.349 0.567 0 C-N-CA 128.298 2.639 . . . . 0.0 112.791 -165.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.264 7.9 mptt -116.84 -73.72 0.63 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 -178.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -152.98 92.03 3.36 Favored Pre-proline 0 C--N 1.353 0.752 0 CA-C-O 112.797 -3.478 . . . . 0.0 109.427 171.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -125.59 17.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.243 1 CA-C-N 130.678 4.849 . . . . 0.0 120.615 -174.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.6 t -147.56 148.21 30.91 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 156.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.2 mt -103.32 133.11 48.94 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 170.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 20.8 tt0 -91.29 44.04 1.17 Allowed 'General case' 0 C--N 1.369 1.427 0 CA-C-N 122.247 2.294 . . . . 0.0 112.355 -173.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 30.7 p 129.13 140.39 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 129.087 2.955 . . . . 0.0 106.748 -175.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -116.02 109.54 17.67 Favored 'General case' 0 N--CA 1.441 -0.914 1 N-CA-C 97.407 -5.034 . . . . 0.0 97.407 157.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.17 132.07 40.52 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 127.501 2.321 . . . . 0.0 107.662 -176.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.16 115.03 17.07 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.8 mt -141.58 129.78 22.35 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 CA-C-O 123.868 1.794 . . . . 0.0 106.397 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.408 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -118.88 179.39 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 124.829 2.252 . . . . 0.0 114.27 -170.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -143.5 136.07 27.27 Favored 'General case' 0 N--CA 1.442 -0.846 2 C-N-CA 134.994 5.318 . . . . 0.0 98.251 171.068 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.486 ' HB3' ' H ' ' A' ' 139' ' ' ARG . 1.0 OUTLIER -158.71 -110.45 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -169.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.614 ' CG ' ' H ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -113.04 -83.68 0.59 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.184 2.593 . . . . 0.0 111.041 -166.403 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.614 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 1.0 OUTLIER -86.16 7.84 23.37 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 131.556 3.942 . . . . 0.0 109.695 169.161 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.422 ' HG ' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER . . . . . 0 CA--C 1.572 1.827 0 CA-C-O 115.82 -2.038 . . . . 0.0 106.741 -169.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 1.4 pt . . . . . 0 C--O 1.218 -0.581 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.412 46.4 mtpt -120.56 148.67 43.56 Favored 'General case' 0 CA--C 1.496 -1.115 1 N-CA-C 96.977 -5.194 . . . . 0.0 96.977 162.804 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 6.4 t -74.61 144.06 44.08 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 121.035 3.717 . . . . 0.0 121.035 -131.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 . . . . . 0 C--O 1.264 1.852 2 CA-C-N 105.926 -5.125 . . . . 0.0 110.655 -172.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.45 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 6.2 t-20 . . . . . 0 C--O 1.222 -0.363 0 CA-C-O 122.795 1.283 . . . . 0.0 109.442 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -64.7 0.84 Allowed 'General case' 0 C--N 1.355 0.826 0 C-N-CA 130.583 3.553 . . . . 0.0 112.058 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -71.45 -12.02 61.18 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 125.554 1.541 . . . . 0.0 113.241 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.45 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.6 OUTLIER -81.2 -39.31 17.32 Favored 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 127.829 2.452 . . . . 0.0 110.22 174.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -66.1 -42.81 88.76 Favored 'General case' 0 C--N 1.371 1.505 0 C-N-CA 129.047 2.939 . . . . 0.0 109.114 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.2 -43.36 89.45 Favored 'Isoleucine or valine' 0 C--N 1.377 1.766 0 C-N-CA 125.348 1.459 . . . . 0.0 111.297 165.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.25 0.0 OUTLIER -58.52 -50.61 73.15 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 169.52 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -56.34 -26.14 51.54 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 117.915 -2.991 . . . . 0.0 115.404 166.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -77.12 -38.23 52.57 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 118.928 -2.358 . . . . 0.0 113.731 165.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.467 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 8.4 mmmt -65.07 -27.78 69.01 Favored 'General case' 0 C--N 1.372 1.557 1 CA-C-O 129.078 4.275 . . . . 0.0 107.376 170.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.45 HD11 HG13 ' A' ' 54' ' ' ILE . 0.3 OUTLIER -71.55 -46.38 59.65 Favored 'General case' 0 C--O 1.206 -1.219 0 O-C-N 116.634 -3.791 . . . . 0.0 112.479 166.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -55.76 -27.6 51.67 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.632 2.086 . . . . 0.0 116.632 167.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.467 ' HG3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -69.88 -49.79 48.82 Favored 'General case' 0 C--N 1.397 2.647 0 CA-C-N 121.842 2.11 . . . . 0.0 112.896 168.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.55 -28.67 30.83 Favored 'General case' 0 C--N 1.364 1.218 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -177.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.447 ' CE1' ' CD1' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -67.67 -53.92 23.81 Favored 'General case' 0 C--O 1.204 -1.339 0 C-N-CA 127.746 2.418 . . . . 0.0 106.547 172.45 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -74.14 -39.77 63.06 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 119.969 3.322 . . . . 0.0 119.969 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 t -73.21 -41.94 63.21 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.531 -1.356 . . . . 0.0 113.858 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . 0.522 3.4 tt0 -77.86 -28.51 50.07 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 120.109 -1.62 . . . . 0.0 112.803 176.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -72.6 -27.81 62.4 Favored 'General case' 0 C--N 1.381 1.955 0 O-C-N 118.772 -2.455 . . . . 0.0 112.828 170.152 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.8 mtt85 -66.93 -36.84 83.14 Favored 'General case' 0 C--N 1.378 1.807 0 C-N-CA 125.612 1.565 . . . . 0.0 110.156 164.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -63.02 -43.02 99.89 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.0 mt -69.83 -45.34 77.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.396 0 CA-C-N 120.009 1.277 . . . . 0.0 111.859 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.526 13.2 p30 -69.12 -24.22 64.09 Favored 'General case' 0 C--N 1.379 1.883 0 O-C-N 119.842 -1.786 . . . . 0.0 115.335 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -73.84 -47.21 40.01 Favored 'General case' 0 C--N 1.378 1.839 0 C-N-CA 126.926 2.09 . . . . 0.0 110.044 169.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -30.9 70.94 Favored 'General case' 0 C--N 1.398 2.716 0 O-C-N 117.697 -3.127 . . . . 0.0 112.95 174.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.407 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 3.2 mt -63.3 -48.63 86.51 Favored 'Isoleucine or valine' 0 C--N 1.378 1.835 0 C-N-CA 124.675 1.19 . . . . 0.0 112.508 171.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.4 ttt85 -64.37 -37.87 89.03 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 122.34 2.336 . . . . 0.0 115.465 176.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -76.5 -38.16 55.66 Favored 'General case' 0 CA--C 1.473 -1.984 0 C-N-CA 127.157 2.183 . . . . 0.0 112.344 -177.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.56 -43.51 14.43 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.391 1.5 p -66.79 -30.73 71.01 Favored 'General case' 0 C--N 1.359 1.01 0 O-C-N 120.583 -1.323 . . . . 0.0 112.85 -179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -72.04 -46.58 56.47 Favored 'General case' 0 C--N 1.375 1.68 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 162.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.72 -26.16 66.02 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 116.058 1.873 . . . . 0.0 116.058 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.57 -14.49 62.87 Favored 'General case' 0 C--N 1.376 1.738 0 C-N-CA 127.031 2.132 . . . . 0.0 112.489 166.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.41 17.63 30.81 Favored Glycine 0 C--N 1.377 2.826 0 O-C-N 121.317 -0.864 . . . . 0.0 113.291 169.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.466 HG23 HD11 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -115.82 164.1 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 -176.479 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.308 0.3 OUTLIER -26.4 -57.52 0.08 Allowed 'General case' 0 C--N 1.361 1.105 1 C-N-CA 133.764 4.826 . . . . 0.0 119.429 -175.441 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.8 t 103.47 122.19 0.01 OUTLIER 'General case' 0 C--N 1.352 0.686 1 C-N-CA 132.103 4.161 . . . . 0.0 107.263 -172.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.407 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 44.8 p90 -113.65 160.53 18.5 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-O 123.037 1.399 . . . . 0.0 112.558 -173.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -110.79 145.76 37.57 Favored 'General case' 0 C--N 1.352 0.681 0 C-N-CA 127.319 2.248 . . . . 0.0 109.481 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.8 tp -126.35 154.89 42.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 118.897 -2.377 . . . . 0.0 106.665 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -132.37 172.66 12.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 O-C-N 120.202 -1.561 . . . . 0.0 111.016 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.611 ' CD2' HD11 ' A' ' 50' ' ' LEU 0.269 4.3 m-30 -93.49 172.02 8.53 Favored 'General case' 0 CA--C 1.558 1.262 0 CA-C-O 123.125 1.44 . . . . 0.0 109.197 168.17 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.3 t -127.03 98.62 5.39 Favored 'General case' 0 C--N 1.349 0.551 0 N-CA-C 101.562 -3.495 . . . . 0.0 101.562 157.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.489 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.486 0.0 OUTLIER -61.58 -10.54 8.37 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 -177.217 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.05 -46.6 13.69 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.851 2.46 . . . . 0.0 111.001 171.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -48.49 81.53 Favored 'General case' 0 C--N 1.373 1.625 0 C-N-CA 127.401 2.28 . . . . 0.0 110.153 170.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.611 HD11 ' CD2' ' A' ' 45' ' ' TYR 0.252 6.2 tt -64.25 -33.4 75.72 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 112.54 -2.118 . . . . 0.0 112.553 172.56 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -56.82 -30.09 63.4 Favored 'General case' 0 C--N 1.368 1.395 0 CA-C-N 121.033 1.742 . . . . 0.0 112.109 166.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -84.29 -45.14 13.14 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 162.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.24 75.18 Favored 'General case' 0 C--N 1.371 1.501 0 CA-C-N 123.05 2.659 . . . . 0.0 114.005 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.45 HG13 HD11 ' A' ' 14' ' ' LEU . 1.2 tt -48.51 -34.45 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 131.075 3.75 . . . . 0.0 116.658 177.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.418 ' HA ' HG22 ' A' ' 58' ' ' ILE . 9.8 mt-30 -92.16 -9.44 42.41 Favored 'General case' 0 C--N 1.362 1.127 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 173.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -94.28 -47.22 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 127.213 2.205 . . . . 0.0 108.733 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -85.86 -3.27 58.87 Favored 'General case' 0 CA--C 1.492 -1.287 1 C-N-CA 132.003 4.121 . . . . 0.0 117.997 -176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.418 HG22 ' HA ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -17.82 -3.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.063 2 N-CA-C 125.71 5.448 . . . . 0.0 125.71 -177.738 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 44.6 t0 142.86 37.91 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.5 1 C-N-CA 134.798 5.239 . . . . 0.0 105.15 -166.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.323 54.7 mm-40 -89.67 85.36 6.43 Favored 'General case' 0 CA--C 1.472 -2.032 0 C-N-CA 131.142 3.777 . . . . 0.0 105.933 175.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.475 0.1 OUTLIER -79.7 -11.32 59.86 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 127.908 2.483 . . . . 0.0 114.086 176.021 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . 0.281 0.7 OUTLIER -61.83 -34.76 76.53 Favored 'General case' 0 N--CA 1.479 1.021 1 C-N-CA 133.896 4.878 . . . . 0.0 111.347 169.233 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . 0.303 0.5 OUTLIER -73.42 -49.76 34.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 C-N-CA 131.373 3.869 . . . . 0.0 106.993 -167.313 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.524 ' HA ' ' CD2' ' A' ' 67' ' ' PHE 0.257 30.7 m-85 -71.23 -29.82 65.59 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 130.928 3.691 . . . . 0.0 112.899 168.5 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.1 -41.74 94.65 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 122.018 2.19 . . . . 0.0 112.185 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.512 HD22 ' HZ2' ' A' ' 151' ' ' LYS . 1.9 tm? -64.17 -40.31 95.85 Favored 'General case' 0 CA--C 1.578 2.024 0 C-N-CA 126.246 1.818 . . . . 0.0 112.113 167.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.524 ' CD2' ' HA ' ' A' ' 64' ' ' PHE . 2.2 m-85 -74.36 -17.53 60.81 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 117.925 -2.984 . . . . 0.0 113.351 174.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CD2' ' O ' ' A' ' 64' ' ' PHE 0.355 57.8 m-70 -85.83 -17.04 36.8 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 128.211 2.604 . . . . 0.0 109.671 172.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -75.25 -40.27 59.05 Favored 'General case' 0 C--N 1.371 1.513 0 CA-C-O 118.07 -0.967 . . . . 0.0 111.652 156.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.414 HD13 ' HB2' ' A' ' 151' ' ' LYS . 1.6 mm -52.68 -46.24 49.69 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.787 0 C-N-CA 129.251 3.02 . . . . 0.0 114.617 172.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.6 pttp -50.66 -7.95 0.04 OUTLIER 'General case' 0 CA--C 1.491 -1.296 1 C-N-CA 132.591 4.356 . . . . 0.0 121.232 -160.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -106.62 -16.74 14.43 Favored 'General case' 0 N--CA 1.44 -0.975 0 O-C-N 119.932 -1.73 . . . . 0.0 107.854 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.676 ' CD2' ' HB ' ' A' ' 152' ' ' THR 0.286 1.0 OUTLIER -80.57 16.85 1.24 Allowed 'General case' 0 C--N 1.383 2.062 0 C-N-CA 128.229 2.611 . . . . 0.0 113.484 -178.497 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 78.6 t -40.2 -42.64 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.97 0 C-N-CA 129.658 3.183 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.64 -31.39 70.6 Favored 'General case' 0 C--N 1.364 1.217 0 C-N-CA 127.354 2.262 . . . . 0.0 116.205 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -76.25 -45.64 31.81 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 129.037 2.935 . . . . 0.0 113.139 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.363 4.9 p -66.3 -29.63 47.26 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.321 0 CA-C-O 126.562 3.077 . . . . 0.0 111.221 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.415 ' HB3' HG12 ' A' ' 38' ' ' VAL . 5.5 m120 -73.77 -31.37 63.27 Favored 'General case' 0 C--N 1.354 0.762 0 O-C-N 118.622 -2.548 . . . . 0.0 115.353 169.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -67.08 -30.51 70.57 Favored 'General case' 0 C--N 1.37 1.469 0 CA-C-N 120.734 1.606 . . . . 0.0 110.697 168.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.28 -36.33 83.76 Favored 'General case' 0 CA--C 1.572 1.812 0 C-N-CA 125.029 1.332 . . . . 0.0 113.205 167.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.466 HD11 HG23 ' A' ' 38' ' ' VAL . 10.1 tt . . . . . 0 N--CA 1.5 2.061 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 168.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 N-CA-C 118.15 2.02 . . . . 0.0 118.15 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -131.36 140.31 49.68 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 126.544 1.938 . . . . 0.0 108.877 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mp -122.56 150.63 42.34 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 127.7 2.4 . . . . 0.0 113.451 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -129.52 113.08 14.42 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 127.432 2.293 . . . . 0.0 105.397 -174.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.463 HD12 ' CE1' ' A' ' 115' ' ' PHE 0.283 1.2 pt -134.85 132.83 53.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -175.045 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.511 ' H ' ' C ' ' A' ' 150' ' ' ILE 0.255 0.4 OUTLIER -139.73 127.59 22.05 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 119.973 -1.704 . . . . 0.0 111.416 -175.211 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 171.41 169.62 0.09 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 101.431 -3.544 . . . . 0.0 101.431 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.466 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.97 -33.97 4.62 Favored Glycine 0 N--CA 1.491 2.328 0 O-C-N 120.038 -1.663 . . . . 0.0 112.855 -173.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 121.05 -13.47 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.17 1 C-N-CA 137.659 6.384 . . . . 0.0 108.004 -168.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.418 ' CD2' ' HG ' ' A' ' 66' ' ' LEU 0.788 0.0 OUTLIER -83.12 135.19 34.91 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 119.752 3.241 . . . . 0.0 119.752 -179.036 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -91.87 100.78 13.39 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 104.872 -2.269 . . . . 0.0 104.872 171.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.43 HD12 ' CE1' ' A' ' 67' ' ' PHE 0.269 3.5 mm? -95.98 132.89 40.83 Favored 'General case' 0 CA--C 1.558 1.268 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 174.28 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -118.36 128.78 7.88 Favored Glycine 0 C--N 1.351 1.392 0 N-CA-C 105.131 -3.188 . . . . 0.0 105.131 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.463 ' CE1' HD12 ' A' ' 106' ' ' ILE 0.258 6.0 m-30 -125.92 151.33 47.1 Favored 'General case' 0 C--N 1.366 1.289 0 CA-C-N 122.465 3.133 . . . . 0.0 102.797 -179.437 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.8 m -151.02 131.67 13.96 Favored 'General case' 0 CA--C 1.481 -1.697 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.401 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 13.6 t -69.05 142.85 15.63 Favored 'Isoleucine or valine' 0 C--N 1.371 1.511 0 C-N-CA 128.871 2.869 . . . . 0.0 107.494 172.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.362 87.4 m -51.05 110.91 0.48 Allowed 'General case' 0 C--N 1.375 1.692 0 CA-C-O 125.317 2.484 . . . . 0.0 116.99 -177.443 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.04 -39.12 7.89 Favored Pre-proline 0 N--CA 1.442 -0.863 0 CA-C-O 115.45 -2.214 . . . . 0.0 114.072 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.95 52.37 4.23 Favored 'Trans proline' 0 CA--C 1.556 1.601 0 CA-C-N 127.049 3.553 . . . . 0.0 114.786 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.97 177.22 3.8 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -173.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.423 ' C ' ' H ' ' A' ' 124' ' ' PHE . 12.8 tt0 -87.5 -67.25 0.84 Allowed 'General case' 0 C--N 1.371 1.526 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 156.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.441 5.3 mptp? 50.39 -19.28 0.0 OUTLIER 'General case' 0 N--CA 1.424 -1.732 1 C-N-CA 138.666 6.786 . . . . 0.0 118.421 -178.668 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.423 ' H ' ' C ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER 107.34 -143.13 0.0 OUTLIER 'General case' 0 C--N 1.369 1.423 1 C-N-CA 132.754 4.422 . . . . 0.0 109.734 175.718 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.495 0.0 OUTLIER -102.82 -54.37 2.65 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.58 1.552 . . . . 0.0 110.481 -177.057 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.333 0.0 OUTLIER -26.73 -74.96 0.03 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 133.786 4.834 . . . . 0.0 117.858 166.145 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.659 0.0 OUTLIER 52.45 -177.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.384 2.406 1 N-CA-C 122.97 4.181 . . . . 0.0 122.97 145.328 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 2.1 p -124.88 152.7 43.69 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.401 ' HA ' ' HA ' ' A' ' 117' ' ' VAL . 1.0 OUTLIER -102.03 128.69 48.36 Favored 'General case' 0 C--N 1.359 1.021 1 N-CA-C 97.105 -5.146 . . . . 0.0 97.105 172.641 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.484 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 30.9 tt0 -80.6 1.81 28.25 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 128.048 2.539 . . . . 0.0 113.11 -154.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 21.8 p 163.49 146.08 0.01 OUTLIER 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 32.8 ttt85 -115.05 122.04 44.93 Favored 'General case' 0 N--CA 1.429 -1.484 1 N-CA-C 99.892 -4.114 . . . . 0.0 99.892 162.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 3.6 ttt -93.14 125.28 37.66 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 102.192 -3.262 . . . . 0.0 102.192 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.18 112.84 14.98 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.77 144.48 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.131 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.89 175.84 5.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 115.629 1.715 . . . . 0.0 115.629 -170.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.401 ' HA ' ' HB2' ' A' ' 141' ' ' LEU . 0.4 OUTLIER -158.94 71.76 0.54 Allowed 'General case' 0 C--N 1.367 1.354 1 C-N-CA 136.694 5.998 . . . . 0.0 108.105 172.546 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.424 ' H ' ' HG ' ' A' ' 141' ' ' LEU . 7.5 t -67.7 -50.0 59.8 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-O 124.038 1.875 . . . . 0.0 110.085 174.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.27 -56.63 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 110.648 -2.978 . . . . 0.0 109.267 -175.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -109.21 14.98 23.53 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.183 2.593 . . . . 0.0 115.603 -173.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.481 ' CD2' ' N ' ' A' ' 141' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.369 1.437 0 C-N-CA 128.01 2.524 . . . . 0.0 107.163 -163.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.516 HD11 ' H ' ' A' ' 152' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.893 0 N-CA-C 121.25 3.796 . . . . 0.0 121.25 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . 0.512 ' HZ2' HD22 ' A' ' 66' ' ' LEU 0.458 0.0 OUTLIER -123.15 101.51 7.44 Favored 'General case' 0 C--N 1.401 2.813 2 N-CA-C 126.64 5.792 . . . . 0.0 126.64 153.488 . . . . . . . . 5 4 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' THR . . . . . 0.676 ' HB ' ' CD2' ' A' ' 73' ' ' HIS 0.451 68.2 p -121.8 100.57 7.07 Favored 'General case' 0 CA--C 1.457 -2.621 2 O-C-N 115.382 -4.574 . . . . 0.0 105.764 152.316 . . . . . . . . 4 3 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.493 HE21 ' C ' ' A' ' 153' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.389 -3.5 0 N-CA-C 103.759 -2.682 . . . . 0.0 103.759 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.44 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 13.2 m-80 . . . . . 0 N--CA 1.487 1.39 1 N-CA-C 122.228 4.158 . . . . 0.0 122.228 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.2 p -91.25 -68.17 0.81 Allowed 'General case' 0 N--CA 1.466 0.34 1 C-N-CA 133.071 4.548 . . . . 0.0 112.702 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.64 -13.51 62.11 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 127.261 2.225 . . . . 0.0 111.858 176.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.44 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -82.19 -36.26 13.74 Favored 'Isoleucine or valine' 0 C--N 1.359 1.006 0 C-N-CA 129.814 3.246 . . . . 0.0 108.965 175.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -68.07 -42.67 80.1 Favored 'General case' 0 C--N 1.373 1.627 0 C-N-CA 128.553 2.741 . . . . 0.0 109.144 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.3 mt -61.64 -43.1 96.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.386 0 C-N-CA 126.945 2.098 . . . . 0.0 110.722 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.315 0.7 OUTLIER -62.88 -44.66 95.52 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 171.279 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -62.97 -30.38 71.54 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 166.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -76.65 -50.97 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 128.316 2.646 . . . . 0.0 111.794 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.535 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmtt -62.32 -29.71 70.64 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.518 2.727 . . . . 0.0 109.92 174.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.42 ' CD1' ' HA ' ' A' ' 54' ' ' ILE . 0.7 OUTLIER -66.64 -51.79 52.32 Favored 'General case' 0 C--N 1.369 1.442 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.789 164.475 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -54.62 -37.77 66.01 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 120.173 1.351 . . . . 0.0 112.63 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.535 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.28 0.9 OUTLIER -71.88 -41.64 67.75 Favored 'General case' 0 C--N 1.392 2.44 0 O-C-N 120.407 -1.433 . . . . 0.0 112.508 171.48 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -57.92 -44.64 86.99 Favored 'General case' 0 C--N 1.388 2.242 0 C-N-CA 129.116 2.966 . . . . 0.0 111.775 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.46 ' HA ' ' CE1' ' A' ' 64' ' ' PHE . 0.4 OUTLIER -66.54 -55.28 16.25 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 128.773 2.829 . . . . 0.0 111.513 -178.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -75.12 -32.98 61.53 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 177.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -73.68 -40.81 63.39 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 126.047 1.739 . . . . 0.0 113.513 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.42 -28.78 62.17 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 125.666 1.586 . . . . 0.0 108.626 170.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.481 ' CZ ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -57.24 -42.27 81.16 Favored 'General case' 0 C--N 1.377 1.774 0 C-N-CA 124.789 1.236 . . . . 0.0 113.901 165.545 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -59.56 -37.92 79.72 Favored 'General case' 0 C--N 1.377 1.803 0 C-N-CA 124.613 1.165 . . . . 0.0 111.612 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -58.3 -49.27 77.75 Favored 'General case' 0 C--N 1.372 1.581 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.0 mt -66.32 -42.52 90.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 O-C-N 120.53 -1.356 . . . . 0.0 111.709 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -73.97 -27.08 60.81 Favored 'General case' 0 C--N 1.372 1.561 0 O-C-N 121.459 -0.776 . . . . 0.0 111.652 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -70.82 -35.98 72.73 Favored 'General case' 0 C--N 1.375 1.703 0 C-N-CA 126.084 1.754 . . . . 0.0 110.687 172.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -69.83 -37.29 76.17 Favored 'General case' 0 C--N 1.383 2.058 0 O-C-N 120.722 -1.236 . . . . 0.0 113.538 170.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.481 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 5.2 mt -65.11 -50.29 75.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 C-N-CA 124.707 1.203 . . . . 0.0 113.322 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -63.01 -32.79 74.23 Favored 'General case' 0 C--N 1.361 1.101 0 CA-C-N 121.778 2.081 . . . . 0.0 114.429 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -77.33 -43.64 32.33 Favored 'General case' 0 C--N 1.376 1.748 0 O-C-N 118.521 -2.612 . . . . 0.0 111.699 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.12 -41.05 64.42 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 124.316 1.046 . . . . 0.0 113.643 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -71.42 -28.84 64.27 Favored 'General case' 0 C--N 1.352 0.705 0 C-N-CA 125.484 1.513 . . . . 0.0 111.448 175.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -77.92 -38.29 45.85 Favored 'General case' 0 C--N 1.387 2.234 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 166.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.86 62.48 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 126.838 2.055 . . . . 0.0 114.592 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.8 -10.04 59.1 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 124.531 1.133 . . . . 0.0 111.753 166.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.11 17.96 56.67 Favored Glycine 0 C--N 1.379 2.93 0 O-C-N 121.122 -0.986 . . . . 0.0 114.675 167.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . 0.504 0.6 OUTLIER -94.37 -179.46 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.74 0 C-N-CA 125.814 1.646 . . . . 0.0 114.169 -173.346 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -43.87 -50.43 7.98 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 130.645 3.578 . . . . 0.0 115.658 -177.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.313 1.5 t 90.51 125.82 0.03 OUTLIER 'General case' 0 C--N 1.36 1.039 1 C-N-CA 133.492 4.717 . . . . 0.0 110.489 -177.548 . . . . . . . . 3 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.481 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 3.5 p90 -112.6 154.0 26.69 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 124.701 1.2 . . . . 0.0 109.308 -174.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.79 162.93 23.23 Favored 'General case' 0 CA--C 1.494 -1.19 0 CA-C-O 122.868 1.318 . . . . 0.0 111.133 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.66 138.17 52.8 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 120.983 -1.073 . . . . 0.0 109.373 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -132.04 141.85 49.36 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 165.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.555 ' CZ ' HD13 ' A' ' 50' ' ' LEU . 1.8 m-85 -101.11 153.8 19.27 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 123.395 1.569 . . . . 0.0 109.563 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 72.6 m -131.8 90.03 2.78 Favored 'General case' 0 CA--C 1.499 -0.993 1 N-CA-C 99.495 -4.261 . . . . 0.0 99.495 168.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -47.79 -9.59 0.02 OUTLIER 'General case' 0 C--O 1.191 -2.025 0 CA-C-O 112.764 -3.493 . . . . 0.0 119.781 -168.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.05 61.45 Favored 'General case' 0 N--CA 1.5 2.032 1 CA-C-N 129.487 5.585 . . . . 0.0 119.933 -176.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.508 HD11 ' H ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -64.12 -42.77 96.71 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 130.646 3.578 . . . . 0.0 111.622 172.402 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.555 HD13 ' CZ ' ' A' ' 45' ' ' TYR . 1.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 129.381 3.072 . . . . 0.0 109.099 171.287 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 47' ' ' GLN . 98.7 m-20 -58.89 -33.96 71.1 Favored 'General case' 0 C--N 1.365 1.268 0 C-N-CA 130.856 3.663 . . . . 0.0 110.699 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -74.71 -33.11 62.34 Favored 'General case' 0 C--N 1.364 1.225 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 164.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.41 -33.21 58.83 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 119.096 -2.252 . . . . 0.0 116.504 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.514 ' CG1' HD22 ' A' ' 50' ' ' LEU . 54.2 mt -63.34 -44.4 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.626 1 C-N-CA 133.746 4.818 . . . . 0.0 111.38 175.506 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.2 -24.91 11.32 Favored 'General case' 0 C--N 1.366 1.288 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 173.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -83.58 -17.09 42.88 Favored 'General case' 0 C--N 1.363 1.179 0 CA-C-N 123.528 2.876 . . . . 0.0 114.292 -173.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.404 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 15.0 pm0 -131.98 -50.62 0.96 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.223 1.409 . . . . 0.0 110.788 175.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.456 0.1 OUTLIER 73.8 156.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 C-N-CA 125.62 1.568 . . . . 0.0 111.033 177.55 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.4 t70 30.69 50.11 0.09 Allowed 'General case' 0 N--CA 1.52 3.049 0 C-N-CA 131.123 3.769 . . . . 0.0 115.458 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.404 ' HG3' ' HG3' ' A' ' 57' ' ' GLU 0.446 60.7 mm-40 -86.26 79.61 9.01 Favored 'General case' 0 CA--C 1.485 -1.529 0 CA-C-O 126.949 3.262 . . . . 0.0 109.742 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.309 33.2 p -78.44 -15.56 58.52 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 128.742 2.817 . . . . 0.0 112.769 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.421 ' HH ' ' C ' ' A' ' 109' ' ' GLY . 1.1 t80 -68.95 -34.25 75.03 Favored 'General case' 0 C--N 1.358 0.961 1 C-N-CA 131.82 4.048 . . . . 0.0 110.45 169.002 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.417 HG13 ' CZ ' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -64.86 -45.94 93.39 Favored 'Isoleucine or valine' 0 C--N 1.358 0.953 0 C-N-CA 130.901 3.68 . . . . 0.0 106.789 -178.698 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.46 ' CE1' ' HA ' ' A' ' 18' ' ' PHE 0.316 57.5 m-85 -62.57 -41.54 98.98 Favored 'General case' 0 C--O 1.21 -1.006 0 C-N-CA 130.322 3.449 . . . . 0.0 114.778 165.539 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -64.28 -43.04 96.02 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 123.898 3.044 . . . . 0.0 113.575 177.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.514 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.2 tm? -68.14 -41.62 81.33 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 125.064 1.346 . . . . 0.0 114.468 171.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.417 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.886 0.1 OUTLIER -77.76 -17.06 57.94 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 118.394 -2.691 . . . . 0.0 115.512 172.878 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -78.3 -18.98 54.52 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 127.845 2.458 . . . . 0.0 108.349 163.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -78.13 -33.17 50.57 Favored 'General case' 0 CA--C 1.567 1.611 0 O-C-N 119.978 -1.702 . . . . 0.0 112.085 159.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.514 HD13 ' HG1' ' A' ' 152' ' ' THR . 6.2 mm -58.0 -46.08 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.914 0 C-N-CA 128.155 2.582 . . . . 0.0 113.342 173.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 pttm -52.46 -16.92 1.0 Allowed 'General case' 0 CA--C 1.502 -0.898 0 C-N-CA 130.512 3.525 . . . . 0.0 118.272 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.277 60.7 m-20 -101.24 -14.14 17.8 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.974 2.109 . . . . 0.0 109.718 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.97 11.93 16.85 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 129.823 3.249 . . . . 0.0 113.059 -171.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.48 ' HA ' HG13 ' A' ' 77' ' ' VAL . 99.5 t -37.89 -31.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.384 2.067 0 C-N-CA 129.103 2.961 . . . . 0.0 115.996 166.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.5 -38.09 77.47 Favored 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 130.388 3.475 . . . . 0.0 114.404 175.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -76.43 -33.04 58.8 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.581 1.952 . . . . 0.0 112.101 172.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.48 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.744 0.1 OUTLIER -71.51 -26.77 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.787 0 CA-C-O 126.786 3.184 . . . . 0.0 112.517 169.83 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -70.44 -32.57 70.21 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 128.821 2.848 . . . . 0.0 111.997 163.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -63.72 -30.26 71.38 Favored 'General case' 0 C--N 1.377 1.784 0 C-N-CA 125.336 1.454 . . . . 0.0 112.372 161.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -41.29 98.03 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 124.944 1.298 . . . . 0.0 112.611 163.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.4 HD21 ' HB2' ' A' ' 125' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.922 0 C-N-CA 127.628 2.371 . . . . 0.0 115.575 173.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.708 0 CA-C-O 122.62 1.122 . . . . 0.0 114.854 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -131.71 145.82 51.84 Favored 'General case' 0 CA--C 1.506 -0.719 0 O-C-N 119.35 -2.264 . . . . 0.0 110.141 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.8 tp -115.82 135.79 53.67 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.865 2.066 . . . . 0.0 109.886 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -129.4 110.69 12.11 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 103.367 -2.827 . . . . 0.0 103.367 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.6 pt -134.52 140.92 44.79 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 C-N-CA 124.776 1.231 . . . . 0.0 110.774 -173.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 23.3 m -127.48 130.58 49.46 Favored 'General case' 0 C--N 1.363 1.179 0 O-C-N 120.1 -1.625 . . . . 0.0 112.131 -176.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.407 ' HB3' ' HB ' ' A' ' 152' ' ' THR . 33.0 t0 -173.75 166.51 4.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.8 -3.037 . . . . 0.0 102.8 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.514 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.33 -38.51 3.2 Favored Glycine 0 C--N 1.351 1.411 0 CA-C-O 123.661 1.701 . . . . 0.0 111.072 172.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 121.23 -8.85 0.0 OUTLIER 'General case' 0 N--CA 1.422 -1.849 1 C-N-CA 139.497 7.119 . . . . 0.0 108.453 -168.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.491 ' HG ' HD23 ' A' ' 113' ' ' LEU 0.641 0.0 OUTLIER -79.26 136.01 36.92 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 130.24 3.416 . . . . 0.0 116.596 177.245 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -97.21 100.48 11.95 Favored 'General case' 0 C--N 1.37 1.463 0 N-CA-C 100.26 -3.978 . . . . 0.0 100.26 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.491 HD23 ' HG ' ' A' ' 111' ' ' LEU . 1.3 pt? -119.25 123.06 43.36 Favored 'General case' 0 C--N 1.361 1.086 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -117.36 142.95 17.7 Favored Glycine 0 C--N 1.355 1.621 0 N-CA-C 106.596 -2.602 . . . . 0.0 106.596 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -131.85 142.22 49.64 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 176.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 31.4 m -125.05 129.63 50.65 Favored 'General case' 0 CA--C 1.485 -1.544 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 -173.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.0 144.05 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 127.147 2.179 . . . . 0.0 108.884 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.425 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.309 86.4 m -56.87 107.5 0.41 Allowed 'General case' 0 C--N 1.379 1.867 0 CA-C-N 120.9 1.682 . . . . 0.0 111.593 179.697 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.252 22.7 ttmm -68.81 -40.02 15.94 Favored Pre-proline 0 N--CA 1.444 -0.73 0 CA-C-O 116.057 -1.925 . . . . 0.0 115.28 -170.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.48 59.46 5.51 Favored 'Trans proline' 0 CA--C 1.56 1.778 0 CA-C-N 126.042 3.194 . . . . 0.0 113.071 171.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.258 0.0 OUTLIER 163.71 124.24 0.01 OUTLIER 'General case' 0 C--N 1.367 1.359 0 C-N-CA 129.648 3.179 . . . . 0.0 111.47 178.15 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -146.46 67.15 1.18 Allowed 'General case' 0 N--CA 1.432 -1.341 0 O-C-N 117.331 -3.356 . . . . 0.0 111.241 168.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -105.42 11.99 32.03 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 126.339 1.855 . . . . 0.0 107.832 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -128.31 150.75 49.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.088 2.555 . . . . 0.0 113.354 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.4 ' HB2' HD21 ' A' ' 81' ' ' LEU 0.266 2.4 mppt? -101.82 -45.62 5.16 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.417 1.487 . . . . 0.0 111.183 178.348 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.3 85.25 6.77 Favored Pre-proline 0 C--N 1.367 1.346 0 C-N-CA 129.058 2.943 . . . . 0.0 108.018 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -81.49 -173.12 1.68 Allowed 'Trans proline' 0 CA--C 1.497 -1.342 1 C-N-CA 132.652 8.901 . . . . 0.0 114.106 -177.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.6 p -98.44 138.94 34.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 100.375 -3.935 . . . . 0.0 100.375 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.7 134.91 42.97 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 121.136 1.789 . . . . 0.0 106.629 -167.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 118' ' ' CYS 0.252 1.1 pt20 -95.85 66.59 2.65 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 125.486 1.514 . . . . 0.0 109.538 -169.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.309 2.1 p 98.68 148.65 0.02 OUTLIER 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.409 1.884 . . . . 0.0 109.669 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -115.09 124.16 50.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 101.164 -3.643 . . . . 0.0 101.164 165.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.42 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . 4.3 ttp -102.95 108.25 19.36 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -121.72 115.16 22.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.605 1.162 . . . . 0.0 108.439 -175.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.7 mm -139.1 136.38 42.16 Favored 'Isoleucine or valine' 0 C--N 1.363 1.186 0 N-CA-C 105.658 -1.979 . . . . 0.0 105.658 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.65 -179.39 3.31 Favored 'Isoleucine or valine' 0 C--N 1.351 0.651 0 C-N-CA 127.196 2.198 . . . . 0.0 112.822 -172.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.53 149.52 49.49 Favored 'General case' 0 CA--C 1.557 1.224 1 C-N-CA 135.418 5.487 . . . . 0.0 106.972 167.199 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.514 ' HB2' HD22 ' A' ' 141' ' ' LEU . 51.4 m -164.67 -103.54 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.536 ' HD2' ' HG2' ' A' ' 140' ' ' ARG 0.258 0.0 OUTLIER -118.15 -66.69 1.05 Allowed 'General case' 0 C--N 1.355 0.815 0 C-N-CA 129.671 3.188 . . . . 0.0 113.608 -160.264 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.536 ' HG2' ' HD2' ' A' ' 139' ' ' ARG . 12.2 ptp180 -105.66 2.14 27.85 Favored 'General case' 0 CA--C 1.497 -1.079 1 C-N-CA 133.684 4.794 . . . . 0.0 108.659 174.617 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.514 HD22 ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER . . . . . 0 CA--C 1.574 1.895 0 CA-C-O 114.514 -2.66 . . . . 0.0 106.387 -152.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.422 HD11 ' H ' ' A' ' 153' ' ' GLN . 0.4 OUTLIER . . . . . 0 C--O 1.218 -0.578 0 N-CA-C 104.946 -2.242 . . . . 0.0 104.946 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.354 21.3 mttp -93.42 137.13 33.03 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 123.717 2.962 . . . . 0.0 104.382 153.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' THR . . . . . 0.514 ' HG1' HD13 ' A' ' 70' ' ' ILE 0.355 1.0 OUTLIER -79.17 116.1 19.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 120.033 3.346 . . . . 0.0 120.033 -140.332 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.422 ' H ' HD11 ' A' ' 150' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.433 2 C-N-CA 135.765 5.626 . . . . 0.0 122.93 -173.79 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.452 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 5.3 m120 . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 120.26 3.43 . . . . 0.0 120.26 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -58.37 4.31 Favored 'General case' 0 C--O 1.24 0.589 1 C-N-CA 133.172 4.589 . . . . 0.0 111.048 173.004 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -73.55 -13.62 61.06 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.096 1.759 . . . . 0.0 113.07 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.452 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.7 OUTLIER -84.88 -31.61 7.19 Favored 'Isoleucine or valine' 0 C--N 1.358 0.946 0 C-N-CA 127.808 2.443 . . . . 0.0 110.214 176.605 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.3 -38.39 71.76 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 127.567 2.347 . . . . 0.0 108.413 174.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -61.07 -44.65 98.69 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.887 164.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 1.2 mmp_? -61.4 -47.46 85.7 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 120.951 1.705 . . . . 0.0 113.916 171.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -56.83 -27.29 59.94 Favored 'General case' 0 C--N 1.376 1.736 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 164.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -76.77 -50.68 12.96 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 119.486 -2.009 . . . . 0.0 111.877 171.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -56.83 -28.4 61.5 Favored 'General case' 0 C--N 1.376 1.721 0 C-N-CA 126.828 2.051 . . . . 0.0 112.754 171.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.62 -46.56 46.13 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 113.755 -1.566 . . . . 0.0 111.621 170.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.434 4.2 ptp180 -58.22 -36.28 72.92 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.16 -1.587 . . . . 0.0 114.586 173.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.9 mtt180 -64.19 -41.96 96.87 Favored 'General case' 0 C--N 1.384 2.069 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 162.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.251 3.0 t60 -62.22 -47.97 82.08 Favored 'General case' 0 C--N 1.383 2.024 0 C-N-CA 127.941 2.496 . . . . 0.0 114.392 174.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -59.06 -53.77 54.62 Favored 'General case' 0 C--N 1.369 1.449 1 C-N-CA 132.883 4.473 . . . . 0.0 108.8 177.885 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -70.65 -46.64 62.9 Favored 'General case' 0 C--N 1.37 1.48 0 N-CA-C 118.556 2.799 . . . . 0.0 118.556 173.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m -66.29 -38.58 88.11 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 119.597 -1.94 . . . . 0.0 114.053 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.449 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.327 4.6 mp0 -77.11 -29.15 54.68 Favored 'General case' 0 C--N 1.362 1.113 0 O-C-N 120.708 -1.245 . . . . 0.0 111.013 172.207 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.3 -36.81 83.27 Favored 'General case' 0 C--N 1.387 2.202 0 O-C-N 120.178 -1.576 . . . . 0.0 114.137 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -68.09 -34.91 77.29 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 124.745 1.218 . . . . 0.0 110.47 169.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.538 HE21 ' CE1' ' A' ' 68' ' ' HIS . 19.6 tt0 -63.49 -45.75 89.26 Favored 'General case' 0 C--N 1.364 1.223 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 169.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 68' ' ' HIS . 2.1 mt -71.3 -45.48 69.87 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 O-C-N 119.277 -2.14 . . . . 0.0 111.795 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.471 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.336 3.5 m120 -75.03 -23.75 58.22 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 120.87 -1.144 . . . . 0.0 112.391 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -75.84 -38.46 58.02 Favored 'General case' 0 C--N 1.382 2.012 0 CA-C-O 116.768 -1.587 . . . . 0.0 110.561 165.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.439 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 16.4 tp10 -65.97 -35.68 81.25 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-N 122.965 2.621 . . . . 0.0 115.793 172.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.471 HG13 ' HA ' ' A' ' 26' ' ' ASN 0.38 0.7 OUTLIER -73.06 -39.68 57.63 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 115.135 1.532 . . . . 0.0 115.135 174.625 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -74.4 -31.81 62.47 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 171.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 8.6 pt-20 -77.38 -38.06 50.76 Favored 'General case' 0 C--N 1.374 1.637 0 O-C-N 118.282 -2.762 . . . . 0.0 110.81 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.27 -36.5 54.31 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.428 1.091 . . . . 0.0 111.899 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.1 t -68.28 -35.45 77.88 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 121.213 -0.929 . . . . 0.0 110.346 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.05 -39.42 69.07 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.83 -28.38 61.58 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 126.48 1.912 . . . . 0.0 115.375 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.95 -15.58 58.11 Favored 'General case' 0 C--N 1.385 2.141 0 C-N-CA 124.75 1.22 . . . . 0.0 110.943 171.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 17.53 59.34 Favored Glycine 0 C--N 1.376 2.779 0 N-CA-C 114.994 0.757 . . . . 0.0 114.994 166.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.459 HG23 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -109.82 151.76 12.01 Favored 'Isoleucine or valine' 0 C--N 1.36 1.023 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 178.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.428 ' HB2' ' CD1' ' A' ' 81' ' ' LEU 0.52 7.7 m -20.74 -47.72 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.743 2 N-CA-C 125.715 5.45 . . . . 0.0 125.715 -167.267 . . . . . . . . 4 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.343 93.7 p 87.35 137.59 0.04 OUTLIER 'General case' 0 CA--C 1.501 -0.919 1 C-N-CA 131.758 4.023 . . . . 0.0 109.543 -178.502 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -112.51 140.53 47.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 -175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -101.96 104.61 15.31 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -175.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.294 0.3 OUTLIER -105.68 161.18 14.61 Favored 'General case' 0 CA--C 1.504 -0.791 0 O-C-N 116.863 -3.648 . . . . 0.0 115.451 -175.529 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -135.75 153.37 51.58 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.416 3.0 p90 -108.36 135.36 49.78 Favored 'General case' 0 C--N 1.36 1.03 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 167.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.9 m -106.35 133.41 51.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 29.5 mm-40 -80.82 -10.76 59.69 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 121.717 3.969 . . . . 0.0 121.717 -170.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.47 -48.03 74.05 Favored 'General case' 0 N--CA 1.495 1.778 1 CA-C-N 126.582 4.265 . . . . 0.0 117.054 -175.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.582 ' H ' ' CD1' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -63.47 -34.81 78.58 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-O 128.031 3.777 . . . . 0.0 113.804 174.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.524 ' H ' HD22 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -72.84 -44.87 60.88 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 109.729 -3.396 . . . . 0.0 108.887 171.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.541 ' HA ' ' CG2' ' A' ' 54' ' ' ILE . 19.6 t70 -55.77 -30.03 60.6 Favored 'General case' 0 C--N 1.37 1.467 0 C-N-CA 127.818 2.447 . . . . 0.0 109.665 -179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.4 ttm-85 -68.16 -55.96 10.48 Favored 'General case' 0 C--N 1.375 1.714 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 157.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.35 71.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 120.603 3.557 . . . . 0.0 120.603 -177.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.541 ' CG2' ' HA ' ' A' ' 51' ' ' ASP . 5.4 tt -75.36 -39.65 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 1 C-N-CA 131.962 4.105 . . . . 0.0 110.619 178.635 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 -107.82 -22.43 12.46 Favored 'General case' 0 C--N 1.373 1.617 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -86.5 10.11 16.28 Favored 'General case' 0 C--N 1.377 1.768 0 CA-C-N 122.597 2.453 . . . . 0.0 113.82 -172.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -155.13 -52.85 0.09 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 125.794 1.638 . . . . 0.0 108.88 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.507 0.0 OUTLIER 75.85 160.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.373 1.629 0 C-N-CA 126.565 1.946 . . . . 0.0 110.125 -179.727 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.8 t70 34.87 45.63 0.16 Allowed 'General case' 0 N--CA 1.512 2.629 1 C-N-CA 131.821 4.048 . . . . 0.0 113.045 -175.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.622 0.0 OUTLIER -83.38 68.64 9.79 Favored 'General case' 0 C--O 1.206 -1.201 0 C-N-CA 128.018 2.527 . . . . 0.0 109.971 -178.233 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.292 23.4 p -79.51 -18.19 52.44 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 130.354 3.461 . . . . 0.0 112.896 177.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -65.26 -33.72 76.66 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 131.467 3.907 . . . . 0.0 111.009 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.439 HG21 HD23 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -60.07 -47.43 91.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.24 0 C-N-CA 130.712 3.605 . . . . 0.0 108.351 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.297 29.2 m-85 -64.61 -40.63 95.84 Favored 'General case' 0 CA--C 1.494 -1.174 1 C-N-CA 134.569 5.148 . . . . 0.0 113.628 171.585 . . . . . . . . 4 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -65.35 -45.26 84.9 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.565 2.346 . . . . 0.0 114.414 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -66.57 -51.04 60.83 Favored 'General case' 0 CA--C 1.567 1.617 0 C-N-CA 124.888 1.275 . . . . 0.0 112.166 171.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.749 0.0 OUTLIER -72.08 -14.71 61.92 Favored 'General case' 0 C--N 1.379 1.864 1 O-C-N 116.155 -4.091 . . . . 0.0 112.417 177.476 . . . . . . . . 4 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.552 ' CE1' HG12 ' A' ' 25' ' ' ILE . 21.2 m-70 -75.82 -27.6 57.97 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 129.124 2.969 . . . . 0.0 111.136 165.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.336 43.6 mmtm -69.1 -27.02 65.23 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.269 -1.52 . . . . 0.0 109.836 159.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.496 HG12 ' CD2' ' A' ' 73' ' ' HIS 0.495 5.5 mt -70.39 -9.08 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 N-CA-C 119.296 3.072 . . . . 0.0 119.296 166.544 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.3 pttm -75.21 -13.38 60.44 Favored 'General case' 0 CA--C 1.512 -0.517 1 O-C-N 116.027 -4.171 . . . . 0.0 114.054 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.381 70.4 m-20 -92.84 -27.31 17.22 Favored 'General case' 0 N--CA 1.432 -1.369 0 C-N-CA 129.422 3.089 . . . . 0.0 112.694 -178.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.496 ' CD2' HG12 ' A' ' 70' ' ' ILE . 3.6 t-80 -70.93 -1.09 10.76 Favored 'General case' 0 CA--C 1.493 -1.228 1 C-N-CA 135.012 5.325 . . . . 0.0 115.544 -170.773 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 55.0 t -27.33 -45.25 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.361 1.075 1 C-N-CA 132.104 4.162 . . . . 0.0 117.502 169.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.13 -31.39 62.73 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.458 2.303 . . . . 0.0 112.753 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -75.38 -43.26 51.16 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 126.415 1.886 . . . . 0.0 111.926 176.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.306 8.6 p -70.15 -31.2 46.59 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 C-N-CA 126.709 2.004 . . . . 0.0 110.804 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.424 ' HB3' HG22 ' A' ' 38' ' ' VAL . 49.0 m-20 -71.9 -30.65 65.6 Favored 'General case' 0 C--N 1.357 0.93 0 O-C-N 119.293 -2.13 . . . . 0.0 115.373 169.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -68.89 -34.62 75.72 Favored 'General case' 0 C--N 1.37 1.484 0 O-C-N 118.08 -2.887 . . . . 0.0 109.551 165.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.49 9.6 t80 -73.53 -4.39 33.61 Favored 'General case' 0 C--N 1.367 1.338 1 C-N-CA 131.779 4.032 . . . . 0.0 115.678 171.634 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.503 HD11 ' HB3' ' A' ' 125' ' ' LYS . 2.1 mt . . . . . 0 N--CA 1.503 2.178 0 C-N-CA 130.867 3.667 . . . . 0.0 113.152 -172.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.519 0 N-CA-C 117.154 1.622 . . . . 0.0 117.154 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.564 ' HE ' ' HG2' ' A' ' 120' ' ' PRO . 93.6 mtt180 -132.95 144.05 49.87 Favored 'General case' 0 C--N 1.351 0.668 0 N-CA-C 100.336 -3.95 . . . . 0.0 100.336 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.5 pp -120.79 147.94 44.67 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.201 -0.937 . . . . 0.0 112.333 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -130.24 120.64 24.77 Favored 'General case' 0 C--N 1.368 1.397 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.414 ' HB ' HD11 ' A' ' 150' ' ' ILE . 6.3 pt -134.64 138.23 49.85 Favored 'Isoleucine or valine' 0 C--N 1.35 0.604 0 C-N-CA 125.089 1.355 . . . . 0.0 109.723 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.4 t -118.62 129.22 55.2 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 -178.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.457 ' HB2' HG13 ' A' ' 150' ' ' ILE . 6.4 t0 -154.5 -174.74 5.09 Favored 'General case' 0 C--N 1.367 1.346 0 N-CA-C 102.253 -3.24 . . . . 0.0 102.253 174.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.0 -66.65 3.9 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 119.23 -2.169 . . . . 0.0 113.547 173.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 159.64 -31.4 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.066 1 C-N-CA 139.902 7.281 . . . . 0.0 104.209 -163.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.439 HD23 HG21 ' A' ' 63' ' ' VAL . 4.5 mp -78.53 137.23 37.81 Favored 'General case' 0 C--N 1.368 1.393 1 C-N-CA 133.845 4.858 . . . . 0.0 121.064 -171.129 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -94.2 103.34 15.38 Favored 'General case' 0 C--N 1.375 1.676 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 164.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -100.12 133.51 44.41 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 177.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -110.21 141.52 16.28 Favored Glycine 0 C--N 1.343 0.937 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 173.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -129.16 133.91 47.8 Favored 'General case' 0 C--N 1.353 0.755 1 N-CA-C 99.403 -4.295 . . . . 0.0 99.403 179.041 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 42.1 p -134.37 137.65 44.28 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 -171.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . 0.27 1.6 p -92.02 151.72 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 C-N-CA 125.39 1.476 . . . . 0.0 112.602 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 15.5 p -58.73 97.94 0.03 OUTLIER 'General case' 0 C--N 1.39 2.348 0 C-N-CA 128.063 2.545 . . . . 0.0 113.583 -177.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.597 17.8 ptpt 46.52 86.66 0.13 Allowed Pre-proline 0 C--N 1.351 0.651 0 C-N-CA 129.1 2.96 . . . . 0.0 115.501 -165.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.564 ' HG2' ' HE ' ' A' ' 103' ' ' ARG . 4.9 Cg_exo -45.33 108.87 0.15 Allowed 'Trans proline' 0 C--N 1.364 1.368 1 C-N-CA 125.914 4.409 . . . . 0.0 118.863 -159.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -157.95 149.76 21.82 Favored 'General case' 0 C--N 1.364 1.216 0 C-N-CA 130.056 3.342 . . . . 0.0 109.268 -169.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -146.52 100.47 3.35 Favored 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 123.181 1.467 . . . . 0.0 110.11 166.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -108.1 -7.39 16.09 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.554 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.437 17.4 m-85 -157.0 176.01 13.33 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -164.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.503 ' HB3' HD11 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -138.28 104.99 5.34 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 103.641 -2.725 . . . . 0.0 103.641 177.841 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.9 t70 160.28 -25.89 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.542 0 C-N-CA 129.567 3.147 . . . . 0.0 115.94 -167.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.343 76.1 Cg_exo -53.12 -178.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.385 2.474 1 C-N-CA 127.638 5.559 . . . . 0.0 119.131 -179.195 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 30.2 t -103.29 152.37 21.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.335 2.254 . . . . 0.0 109.392 -172.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 20.2 mt -102.34 130.85 49.19 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 177.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -89.53 38.55 0.91 Allowed 'General case' 0 C--N 1.383 2.042 0 C-N-CA 128.427 2.691 . . . . 0.0 111.26 -163.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 19.5 t 98.66 143.93 0.02 OUTLIER 'General case' 0 C--N 1.371 1.521 0 C-N-CA 125.754 1.622 . . . . 0.0 106.929 -168.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.424 HH22 HG23 ' A' ' 25' ' ' ILE . 38.1 mtm180 -107.18 122.37 46.39 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 100.452 -3.907 . . . . 0.0 100.452 168.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.468 ' SD ' ' HB2' ' A' ' 49' ' ' LEU . 1.6 tmm? -93.02 118.67 31.45 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 104.313 -2.477 . . . . 0.0 104.313 -174.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -124.67 114.96 20.01 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . 0.267 80.4 mt -140.08 148.59 22.53 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.412 ' CG2' ' H ' ' A' ' 137' ' ' ASN . 0.3 OUTLIER -133.96 -178.76 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 124.877 2.275 . . . . 0.0 110.461 -169.129 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.412 ' H ' ' CG2' ' A' ' 136' ' ' ILE . 0.3 OUTLIER -157.28 138.67 13.79 Favored 'General case' 0 N--CA 1.441 -0.89 1 C-N-CA 134.268 5.027 . . . . 0.0 102.02 176.416 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.476 ' HB3' HD22 ' A' ' 141' ' ' LEU . 0.9 OUTLIER -164.91 -115.07 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 120.137 3.384 . . . . 0.0 120.137 -168.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.592 ' HD3' ' HG2' ' A' ' 140' ' ' ARG 0.25 0.0 OUTLIER -103.44 -69.48 0.8 Allowed 'General case' 0 C--N 1.354 0.763 1 C-N-CA 133.515 4.726 . . . . 0.0 114.594 -159.482 . . . . . . . . 5 4 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.592 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 12.5 ptp180 -111.55 9.92 21.22 Favored 'General case' 0 N--CA 1.446 -0.647 1 C-N-CA 133.05 4.54 . . . . 0.0 107.25 173.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.476 HD22 ' HB3' ' A' ' 138' ' ' SER . 0.3 OUTLIER . . . . . 0 CA--C 1.574 1.868 0 CA-C-O 115.658 -2.115 . . . . 0.0 106.878 -156.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.457 HG13 ' HB2' ' A' ' 108' ' ' ASP 0.424 0.1 OUTLIER . . . . . 0 CA--C 1.546 0.795 1 N-CA-C 125.988 5.551 . . . . 0.0 125.988 . . . . . . . . . 4 3 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . 0.492 ' HG3' ' CE1' ' A' ' 73' ' ' HIS 0.324 0.0 OUTLIER -78.92 149.04 32.48 Favored 'General case' 0 CA--C 1.496 -1.116 1 C-N-CA 140.861 7.664 . . . . 0.0 101.059 159.66 . . . . . . . . 5 4 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 11.7 t -79.35 97.21 6.23 Favored 'General case' 0 CA--C 1.566 1.561 1 CA-C-O 129.689 4.566 . . . . 0.0 111.108 168.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.446 ' HA ' ' CG1' ' A' ' 70' ' ' ILE . 3.7 tt0 . . . . . 1 N--CA 1.37 -4.46 2 C-N-CA 138.226 6.611 . . . . 0.0 106.838 173.063 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.48 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.366 10.8 t-20 . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 120.306 3.447 . . . . 0.0 120.306 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.05 -59.2 2.56 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 130.894 3.678 . . . . 0.0 111.145 172.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.77 -12.31 61.48 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 128.142 2.577 . . . . 0.0 112.47 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.48 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.7 t -88.43 -30.11 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 C-N-CA 130.508 3.523 . . . . 0.0 108.39 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -73.57 -42.11 62.04 Favored 'General case' 0 C--N 1.369 1.426 0 C-N-CA 125.778 1.631 . . . . 0.0 109.038 174.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.69 -42.91 93.75 Favored 'Isoleucine or valine' 0 C--N 1.369 1.433 0 C-N-CA 126.958 2.103 . . . . 0.0 110.875 168.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.289 11.4 tpp180 -65.07 -47.29 77.81 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 79.4 mtm180 -57.89 -31.82 67.12 Favored 'General case' 0 C--N 1.379 1.849 0 C-N-CA 128.77 2.828 . . . . 0.0 117.507 167.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -77.15 -46.62 22.81 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 127.384 2.273 . . . . 0.0 110.683 170.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.502 ' HA ' ' HG3' ' A' ' 16' ' ' ARG 0.337 31.1 mtpt -59.3 -28.42 66.75 Favored 'General case' 0 C--N 1.367 1.341 0 C-N-CA 126.646 1.979 . . . . 0.0 111.36 172.271 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.81 -49.31 39.72 Favored 'General case' 0 C--O 1.21 -1.018 0 C-N-CA 125.504 1.522 . . . . 0.0 111.591 169.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.386 15.5 ptt180 -55.78 -33.34 64.27 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 170.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.502 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.292 0.1 OUTLIER -75.43 -38.16 59.96 Favored 'General case' 0 C--N 1.399 2.747 0 O-C-N 120.393 -1.442 . . . . 0.0 113.772 167.009 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.296 89.6 m-70 -56.93 -44.89 82.93 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 130.177 3.391 . . . . 0.0 109.402 172.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.454 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -65.51 -53.49 41.71 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 129.78 3.232 . . . . 0.0 110.802 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -69.07 -40.01 78.74 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.3 m -73.56 -35.47 65.47 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.861 2.064 . . . . 0.0 112.371 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.447 ' HB3' ' CD2' ' A' ' 64' ' ' PHE 0.281 50.7 mt-10 -77.3 -29.09 53.52 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 119.279 -2.138 . . . . 0.0 109.988 168.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -34.21 74.64 Favored 'General case' 0 C--N 1.376 1.72 0 O-C-N 119.196 -2.19 . . . . 0.0 112.637 169.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.321 7.4 ptm180 -69.65 -35.91 75.6 Favored 'General case' 0 C--N 1.375 1.7 0 CA-C-O 118.17 -0.919 . . . . 0.0 113.473 164.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -59.46 -50.41 74.03 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.3 mt -71.77 -44.56 68.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 C-N-CA 125.475 1.51 . . . . 0.0 110.35 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.556 ' HA ' ' CG1' ' A' ' 29' ' ' ILE 0.625 0.0 OUTLIER -70.15 -24.11 63.11 Favored 'General case' 0 C--N 1.375 1.679 0 O-C-N 119.396 -2.065 . . . . 0.0 114.247 174.443 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -75.02 -37.35 61.8 Favored 'General case' 0 C--N 1.375 1.693 0 O-C-N 119.683 -1.886 . . . . 0.0 112.879 170.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.439 ' HA ' ' HG2' ' A' ' 31' ' ' GLU 0.451 0.0 OUTLIER -69.3 -34.4 74.62 Favored 'General case' 0 C--N 1.402 2.89 0 CA-C-N 122.816 2.553 . . . . 0.0 113.735 172.866 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.556 ' CG1' ' HA ' ' A' ' 26' ' ' ASN 0.257 2.2 pp -67.19 -44.94 87.42 Favored 'Isoleucine or valine' 0 C--N 1.387 2.202 0 C-N-CA 124.624 1.169 . . . . 0.0 112.183 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -61.25 -38.57 87.18 Favored 'General case' 0 C--N 1.363 1.167 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 170.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.9 pt-20 -76.87 -41.57 43.34 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 119.432 -2.043 . . . . 0.0 113.031 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.46 -39.66 64.76 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.3 t -71.46 -35.5 70.89 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.896 1.278 . . . . 0.0 110.356 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -70.4 -38.0 74.59 Favored 'General case' 0 C--N 1.388 2.244 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 167.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.42 62.41 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.298 1.839 . . . . 0.0 114.251 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.25 -18.9 61.18 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 120.018 1.281 . . . . 0.0 112.162 170.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.14 18.23 47.39 Favored Glycine 0 C--N 1.376 2.753 0 CA-C-O 121.82 0.678 . . . . 0.0 113.355 168.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.425 HG22 ' CD2' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -119.89 162.76 18.0 Favored 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 123.774 0.83 . . . . 0.0 109.343 -175.212 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 22.67 -51.09 0.0 OUTLIER 'General case' 0 C--N 1.371 1.504 1 C-N-CA 137.974 6.51 . . . . 0.0 120.718 176.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.2 m 72.75 92.48 0.08 Allowed 'General case' 0 C--N 1.364 1.209 0 C-N-CA 131.141 3.776 . . . . 0.0 109.737 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.476 ' CZ ' ' HB ' ' A' ' 29' ' ' ILE . 36.7 p90 -113.96 140.87 48.05 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 122.019 0.914 . . . . 0.0 111.568 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -102.71 167.64 9.77 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 129.163 2.985 . . . . 0.0 105.114 170.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.397 2.8 pp -122.64 156.6 33.99 Favored 'General case' 0 CA--C 1.495 -1.162 0 O-C-N 119.639 -1.913 . . . . 0.0 110.829 167.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -138.83 146.01 40.74 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 100.33 -3.952 . . . . 0.0 100.33 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -142.66 151.8 41.77 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 121.719 0.771 . . . . 0.0 110.151 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.3 t -105.23 140.62 38.11 Favored 'General case' 0 C--N 1.358 0.952 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.419 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.327 7.4 mm-40 -80.82 -9.27 59.83 Favored 'General case' 0 C--O 1.203 -1.369 0 C-N-CA 127.874 2.47 . . . . 0.0 116.309 -179.233 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.06 -48.3 82.38 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 125.731 3.878 . . . . 0.0 118.367 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.53 HD11 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.81 -34.23 77.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-O 125.024 2.345 . . . . 0.0 112.365 172.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.53 ' H ' HD11 ' A' ' 49' ' ' LEU 0.292 0.7 OUTLIER -68.09 -44.43 76.26 Favored 'General case' 0 C--O 1.196 -1.729 0 C-N-CA 129.671 3.188 . . . . 0.0 107.03 172.79 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -54.58 -37.83 65.99 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 129.461 3.104 . . . . 0.0 111.253 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -71.87 -39.34 69.7 Favored 'General case' 0 C--N 1.374 1.645 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 163.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.66 95.03 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 124.607 3.367 . . . . 0.0 115.345 170.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.495 ' CG1' HD23 ' A' ' 50' ' ' LEU . 56.7 mt -58.8 -45.79 91.22 Favored 'Isoleucine or valine' 0 C--N 1.368 1.389 1 C-N-CA 133.686 4.795 . . . . 0.0 112.562 176.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -106.99 -21.89 12.85 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 118.659 2.836 . . . . 0.0 118.659 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.4 ttp-105 -87.32 -30.91 20.48 Favored 'General case' 0 C--N 1.366 1.305 0 CA-C-N 123.893 3.042 . . . . 0.0 111.498 -178.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -102.75 -57.56 2.03 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.689 1.595 . . . . 0.0 111.309 -176.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.557 0.2 OUTLIER 55.44 135.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 C-N-CA 129.152 2.981 . . . . 0.0 114.379 178.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.402 ' CB ' ' HD2' ' A' ' 139' ' ' ARG 0.718 32.8 t70 61.07 25.26 15.3 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 127.784 2.433 . . . . 0.0 113.73 -174.54 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.873 0.4 OUTLIER -65.42 58.31 0.03 OUTLIER 'General case' 0 C--O 1.2 -1.539 0 C-N-CA 129.597 3.159 . . . . 0.0 117.314 -177.09 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.503 1.7 p -78.6 -10.01 59.58 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 130.977 3.711 . . . . 0.0 114.681 174.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -68.18 -34.23 75.91 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.238 3.015 . . . . 0.0 108.156 165.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD1' ' A' ' 64' ' ' PHE 0.279 0.4 OUTLIER -62.87 -46.04 97.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.362 0 C-N-CA 129.623 3.169 . . . . 0.0 107.929 177.957 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.447 ' CD2' ' HB3' ' A' ' 21' ' ' GLU . 85.1 m-85 -61.44 -32.61 72.59 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 131.678 3.991 . . . . 0.0 115.175 164.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -73.61 -43.44 59.64 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-N 123.63 2.923 . . . . 0.0 112.016 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.472 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 0.9 OUTLIER -70.64 -40.32 73.13 Favored 'General case' 0 CA--C 1.559 1.324 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.913 0.0 OUTLIER -77.76 -16.28 58.51 Favored 'General case' 0 C--N 1.377 1.787 0 O-C-N 119.972 -1.705 . . . . 0.0 114.754 176.315 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.432 ' CD2' ' O ' ' A' ' 64' ' ' PHE . 31.3 m-70 -76.29 -30.24 57.69 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.972 2.509 . . . . 0.0 108.622 163.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -72.26 -25.49 61.63 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.473 -2.017 . . . . 0.0 112.301 163.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -74.68 -31.63 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 C-N-CA 128.463 2.705 . . . . 0.0 111.581 172.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 pttp -52.68 -24.54 8.75 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 129.949 3.299 . . . . 0.0 118.676 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.267 35.8 t70 -97.37 -27.24 14.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.155 2.182 . . . . 0.0 109.513 -175.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.502 ' CE1' ' N ' ' A' ' 152' ' ' THR . 16.0 m-70 -77.28 6.79 6.09 Favored 'General case' 0 C--N 1.368 1.377 1 C-N-CA 132.454 4.302 . . . . 0.0 114.708 -174.501 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.0 t -36.72 -35.68 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 C-N-CA 129.16 2.984 . . . . 0.0 115.915 166.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.29 -34.25 72.53 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.783 -1.823 . . . . 0.0 113.6 177.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.456 ' HA ' ' HG2' ' A' ' 79' ' ' GLU 0.323 35.0 mt-10 -76.41 -34.04 58.81 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.294 1.438 . . . . 0.0 113.794 171.715 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.345 1.9 m -70.72 -36.96 67.24 Favored 'Isoleucine or valine' 0 C--N 1.377 1.785 0 CA-C-O 125.439 2.542 . . . . 0.0 110.68 172.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -65.34 -32.41 74.03 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 128.107 2.563 . . . . 0.0 112.559 169.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 76' ' ' GLU 0.404 5.6 pt-20 -71.5 -29.66 65.05 Favored 'General case' 0 C--N 1.369 1.439 0 O-C-N 117.7 -3.125 . . . . 0.0 112.33 164.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -74.41 -5.59 43.29 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 128.14 2.576 . . . . 0.0 114.197 168.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.425 ' CD2' HG22 ' A' ' 38' ' ' VAL . 2.9 pp . . . . . 0 N--CA 1.508 2.43 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 -164.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.939 0 CA-C-O 121.7 0.611 . . . . 0.0 113.701 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -137.01 158.01 45.44 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 120.467 -1.607 . . . . 0.0 111.411 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.7 tp -133.02 151.77 52.03 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.397 1.879 . . . . 0.0 113.132 -175.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -125.92 118.2 24.91 Favored 'General case' 0 C--N 1.369 1.433 0 N-CA-C 103.649 -2.722 . . . . 0.0 103.649 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.415 ' HB ' ' HB2' ' A' ' 113' ' ' LEU . 1.0 OUTLIER -122.95 119.19 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 126.882 2.073 . . . . 0.0 106.676 -174.173 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.9 m -127.21 108.23 10.71 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.443 ' CG ' HD21 ' A' ' 66' ' ' LEU . 53.0 t0 -159.17 161.61 36.23 Favored 'General case' 0 CA--C 1.482 -1.657 0 N-CA-C 101.087 -3.671 . . . . 0.0 101.087 -172.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.472 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 83.8 -38.0 2.81 Favored Glycine 0 N--CA 1.474 1.222 0 O-C-N 119.708 -1.87 . . . . 0.0 114.251 174.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 108.95 0.3 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.613 1 C-N-CA 136.157 5.783 . . . . 0.0 108.19 -161.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.443 HD11 ' CG1' ' A' ' 136' ' ' ILE . 2.3 tp -79.78 129.36 34.41 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 128.867 2.867 . . . . 0.0 109.264 175.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.7 m95 -96.73 100.97 12.5 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 170.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.415 ' HB2' ' HB ' ' A' ' 106' ' ' ILE 0.319 2.0 mm? -97.26 131.24 44.17 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 173.25 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -105.92 125.3 8.15 Favored Glycine 0 C--N 1.351 1.394 0 N-CA-C 107.234 -2.346 . . . . 0.0 107.234 162.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . 0.294 1.0 OUTLIER -118.56 152.54 35.82 Favored 'General case' 0 C--N 1.374 1.667 0 CA-C-N 122.373 3.087 . . . . 0.0 106.712 179.163 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.7 m -122.27 137.8 54.72 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 100.438 -3.912 . . . . 0.0 100.438 166.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.22 128.64 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.369 0 N-CA-C 100.702 -3.814 . . . . 0.0 100.702 165.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.67 ' CB ' HD22 ' A' ' 121' ' ' ASN . 14.2 p 40.31 -137.4 0.12 Allowed 'General case' 0 C--N 1.363 1.163 0 N-CA-C 121.266 3.802 . . . . 0.0 121.266 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.359 88.3 tttt 159.31 -65.72 0.0 OUTLIER Pre-proline 0 N--CA 1.421 -1.885 2 C-N-CA 133.879 4.872 . . . . 0.0 109.182 161.812 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -75.46 53.62 3.59 Favored 'Trans proline' 0 CA--C 1.554 1.515 0 C-N-CA 123.267 2.644 . . . . 0.0 115.431 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.67 HD22 ' CB ' ' A' ' 118' ' ' CYS . 0.4 OUTLIER -170.16 172.32 6.41 Favored 'General case' 0 C--N 1.371 1.5 0 N-CA-C 117.148 2.277 . . . . 0.0 117.148 -177.542 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.557 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 29.0 tt0 -141.83 -91.29 0.14 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 128.495 2.718 . . . . 0.0 105.634 156.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.402 ' HD2' ' H ' ' A' ' 122' ' ' GLU . 6.9 mptt 50.77 14.85 0.2 Allowed 'General case' 0 C--N 1.364 1.223 1 C-N-CA 136.735 6.014 . . . . 0.0 117.505 -172.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.557 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -169.83 -119.83 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.171 0 C-N-CA 130.669 3.588 . . . . 0.0 106.964 -167.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -108.72 -65.53 1.13 Allowed 'General case' 0 N--CA 1.425 -1.712 0 N-CA-C 102.634 -3.098 . . . . 0.0 102.634 171.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -177.31 145.98 0.62 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 128.341 2.657 . . . . 0.0 107.893 169.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -147.2 38.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.065 0 N-CA-C 118.681 2.531 . . . . 0.0 118.681 -171.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.8 m -144.06 156.37 44.35 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 170.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.24 130.47 53.38 Favored 'General case' 0 C--N 1.358 0.978 1 N-CA-C 99.001 -4.444 . . . . 0.0 99.001 159.739 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . 0.327 35.9 mt-30 -119.99 72.39 0.93 Allowed 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 120.232 -1.542 . . . . 0.0 107.311 -172.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.256 4.8 t 104.12 117.1 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 125.597 1.559 . . . . 0.0 110.124 -177.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -114.87 113.86 24.76 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 173.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.0 ttp -94.01 108.16 20.01 Favored 'General case' 0 CA--C 1.497 -1.063 0 C-N-CA 126.077 1.751 . . . . 0.0 108.465 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.428 ' H ' ' CD2' ' A' ' 49' ' ' LEU . . . -123.61 114.81 20.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 121.276 0.56 . . . . 0.0 110.227 -172.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 6.3 mm -134.68 134.17 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.398 1.079 . . . . 0.0 110.544 178.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.443 ' CG1' HD11 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -142.65 -179.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.15 0 C-N-CA 127.488 2.315 . . . . 0.0 113.278 -173.087 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.88 106.34 18.32 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 131.156 3.782 . . . . 0.0 107.719 155.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.439 ' H ' ' CG ' ' A' ' 141' ' ' LEU 0.277 0.4 OUTLIER -96.59 -91.91 0.23 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 120.069 3.359 . . . . 0.0 120.069 -175.838 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.654 ' H ' HD22 ' A' ' 141' ' ' LEU . 27.0 mtp180 -127.55 -51.99 1.37 Allowed 'General case' 0 C--N 1.371 1.5 0 CA-C-O 123.384 1.564 . . . . 0.0 109.2 -158.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.436 ' HG2' ' HB2' ' A' ' 139' ' ' ARG . 1.6 ptm180 -123.58 19.95 9.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 129.729 3.212 . . . . 0.0 111.335 -168.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.654 HD22 ' H ' ' A' ' 139' ' ' ARG . 0.4 OUTLIER . . . . . 0 CA--C 1.492 -1.255 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.871 -170.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 1.2 pp . . . . . 0 C--O 1.219 -0.509 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.443 68.6 mttt -114.43 148.19 38.12 Favored 'General case' 0 C--N 1.355 0.845 1 N-CA-C 98.48 -4.637 . . . . 0.0 98.48 148.268 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' THR . . . . . 0.502 ' N ' ' CE1' ' A' ' 73' ' ' HIS 0.994 0.5 OUTLIER -76.82 146.05 38.04 Favored 'General case' 0 N--CA 1.494 1.74 1 N-CA-C 129.65 6.907 . . . . 0.0 129.65 -134.56 . . . . . . . . 5 4 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 . . . . . 0 N--CA 1.416 -2.133 2 C-N-CA 135.27 5.428 . . . . 0.0 105.418 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.522 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 18.1 m-80 . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.74 -57.91 10.39 Favored 'General case' 0 C--N 1.347 0.495 1 C-N-CA 133.268 4.627 . . . . 0.0 111.694 171.594 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.0 -15.24 61.1 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.562 2.345 . . . . 0.0 113.294 177.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.522 ' CG1' ' HA ' ' A' ' 4' ' ' ASN 0.252 0.6 OUTLIER -87.77 -37.03 10.28 Favored 'Isoleucine or valine' 0 C--N 1.355 0.827 0 C-N-CA 127.514 2.325 . . . . 0.0 110.565 179.304 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -70.26 -40.42 74.38 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 129.435 3.094 . . . . 0.0 108.795 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.17 -43.91 99.08 Favored 'Isoleucine or valine' 0 C--N 1.376 1.759 0 C-N-CA 125.02 1.328 . . . . 0.0 109.629 165.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.269 0.3 OUTLIER -58.11 -49.35 77.26 Favored 'General case' 0 C--N 1.37 1.472 0 N-CA-C 116.175 1.917 . . . . 0.0 116.175 171.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.4 -31.39 72.06 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 169.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -77.15 -51.24 11.33 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 126.93 2.092 . . . . 0.0 111.846 174.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -59.11 -28.76 66.83 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.173 3.389 . . . . 0.0 110.15 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -51.6 30.18 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 124.779 1.232 . . . . 0.0 111.27 167.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.3 ttt-85 -55.08 -39.56 69.43 Favored 'General case' 0 CA--C 1.566 1.587 0 C-N-CA 125.692 1.597 . . . . 0.0 112.622 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.5 mmt-85 -63.39 -43.86 96.37 Favored 'General case' 0 C--N 1.38 1.9 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 165.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.2 m-70 -56.89 -49.6 75.05 Favored 'General case' 0 C--N 1.39 2.368 0 C-N-CA 128.878 2.871 . . . . 0.0 110.327 171.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.441 ' CE2' HD12 ' A' ' 50' ' ' LEU . 1.4 t80 -54.92 -54.21 45.58 Favored 'General case' 0 C--N 1.379 1.864 0 C-N-CA 131.107 3.763 . . . . 0.0 110.079 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.72 -42.48 67.27 Favored 'General case' 0 C--N 1.372 1.58 0 N-CA-C 119.336 3.088 . . . . 0.0 119.336 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.6 m -69.95 -42.74 72.82 Favored 'General case' 0 C--N 1.363 1.183 0 C-N-CA 127.047 2.139 . . . . 0.0 113.337 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.505 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 4.5 mp0 -74.84 -29.19 60.97 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.208 1.403 . . . . 0.0 109.878 171.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.264 0.2 OUTLIER -62.26 -34.18 76.05 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.043 -1.66 . . . . 0.0 113.275 166.393 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -62.99 -37.55 87.62 Favored 'General case' 0 C--N 1.381 1.974 0 C-N-CA 124.313 1.045 . . . . 0.0 111.432 167.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 tp60 -60.16 -47.71 84.77 Favored 'General case' 0 C--N 1.371 1.537 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 166.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.6 mt -66.84 -45.11 88.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 O-C-N 120.942 -1.099 . . . . 0.0 112.162 178.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.423 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.56 0.7 OUTLIER -72.75 -23.02 60.77 Favored 'General case' 0 C--N 1.366 1.322 0 O-C-N 120.248 -1.533 . . . . 0.0 114.796 173.528 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -73.38 -36.09 66.01 Favored 'General case' 0 C--N 1.362 1.149 0 O-C-N 120.223 -1.548 . . . . 0.0 112.41 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.486 ' HG2' ' HG2' ' A' ' 71' ' ' LYS . 4.0 tp10 -74.03 -43.32 58.34 Favored 'General case' 0 C--N 1.394 2.521 0 O-C-N 119.281 -2.137 . . . . 0.0 109.645 171.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.423 HG13 ' HA ' ' A' ' 26' ' ' ASN 0.431 0.7 OUTLIER -63.66 -42.55 96.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 CA-C-N 120.714 1.597 . . . . 0.0 115.058 176.507 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -71.12 -32.34 68.89 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 120.204 1.366 . . . . 0.0 114.114 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 13.3 pt-20 -76.45 -39.62 52.83 Favored 'General case' 0 C--N 1.377 1.781 0 O-C-N 119.449 -2.032 . . . . 0.0 111.275 177.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.63 -44.58 56.61 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.348 1.459 . . . . 0.0 114.277 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.263 59.5 p -68.43 -30.37 69.25 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 120.092 -1.63 . . . . 0.0 112.481 175.039 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -70.05 -47.35 62.37 Favored 'General case' 0 C--N 1.379 1.848 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 162.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.41 -33.09 74.92 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 126.421 1.888 . . . . 0.0 115.988 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -14.96 61.48 Favored 'General case' 0 C--N 1.376 1.72 0 CA-C-N 119.865 1.211 . . . . 0.0 112.645 168.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 17.91 47.41 Favored Glycine 0 C--N 1.385 3.251 0 O-C-N 121.076 -1.015 . . . . 0.0 113.324 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . 0.277 0.6 OUTLIER -107.84 177.24 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.987 0 C-N-CA 126.534 1.934 . . . . 0.0 107.224 -174.868 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 6.94 -65.89 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.564 2 C-N-CA 135.758 5.623 . . . . 0.0 122.019 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.0 m 80.28 88.72 0.05 OUTLIER 'General case' 0 C--N 1.36 1.05 1 C-N-CA 132.075 4.15 . . . . 0.0 102.422 -165.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.469 ' CZ ' HG23 ' A' ' 77' ' ' VAL 0.321 52.0 p90 -111.15 140.87 45.34 Favored 'General case' 0 C--N 1.361 1.1 0 CA-C-O 122.743 1.259 . . . . 0.0 109.666 -167.173 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -100.96 162.4 12.92 Favored 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 126.148 1.779 . . . . 0.0 106.808 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.72 122.46 44.59 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.014 0.926 . . . . 0.0 108.916 -178.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -137.49 141.38 41.5 Favored 'General case' 0 N--CA 1.426 -1.663 1 N-CA-C 99.233 -4.358 . . . . 0.0 99.233 174.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.427 ' CE2' HD12 ' A' ' 50' ' ' LEU . 3.6 p90 -130.96 155.02 47.5 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 174.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.9 m -99.62 139.61 35.03 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 104.782 -2.303 . . . . 0.0 104.782 167.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -79.44 -8.74 59.33 Favored 'General case' 0 C--O 1.208 -1.129 0 C-N-CA 128.805 2.842 . . . . 0.0 116.374 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.38 96.6 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 124.447 3.294 . . . . 0.0 116.539 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.567 ' H ' HD21 ' A' ' 49' ' ' LEU 0.321 0.2 OUTLIER -68.62 -39.07 80.98 Favored 'General case' 0 CA--C 1.444 -3.127 0 C-N-CA 130.065 3.346 . . . . 0.0 113.151 174.884 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.484 HD21 ' CG1' ' A' ' 54' ' ' ILE 0.286 0.2 OUTLIER -65.01 -45.98 83.3 Favored 'General case' 0 C--O 1.202 -1.415 1 CA-C-N 108.304 -4.044 . . . . 0.0 108.991 170.71 . . . . . . . . 5 4 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -55.02 -34.32 63.39 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 117.28 -3.387 . . . . 0.0 110.915 170.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -76.63 -27.05 55.55 Favored 'General case' 0 C--N 1.365 1.281 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 166.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.0 -49.26 11.16 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 117.493 -3.254 . . . . 0.0 113.921 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.484 ' CG1' HD21 ' A' ' 50' ' ' LEU . 66.8 mt -51.56 -43.3 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 1 C-N-CA 134.686 5.194 . . . . 0.0 111.461 174.975 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.0 -26.0 11.36 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 119.549 3.166 . . . . 0.0 119.549 171.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -85.44 -16.6 39.16 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-N 124.394 3.27 . . . . 0.0 113.015 -175.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -121.59 -56.76 1.86 Allowed 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 128.443 2.697 . . . . 0.0 110.268 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.405 HD11 ' N ' ' A' ' 59' ' ' ASP 0.608 0.0 OUTLIER 73.6 -169.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 C-N-CA 129.894 3.278 . . . . 0.0 108.925 -178.089 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.405 ' N ' HD11 ' A' ' 58' ' ' ILE . 13.2 t70 -8.25 69.24 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.791 1 C-N-CA 133.756 4.822 . . . . 0.0 116.275 173.741 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.393 11.7 pt-20 -98.51 62.17 1.42 Allowed 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 129.469 3.108 . . . . 0.0 108.682 -173.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.389 24.3 p -79.21 -11.91 59.97 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 126.793 3.187 . . . . 0.0 113.244 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -69.56 -33.58 72.96 Favored 'General case' 0 CA--C 1.551 1.003 1 C-N-CA 133.131 4.572 . . . . 0.0 109.692 166.499 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.423 HG21 HD13 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -61.98 -44.96 99.64 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 C-N-CA 128.477 2.711 . . . . 0.0 108.767 -178.381 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.505 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.287 43.9 m-85 -62.42 -45.27 93.84 Favored 'General case' 0 C--O 1.205 -1.249 1 C-N-CA 134.38 5.072 . . . . 0.0 111.976 167.34 . . . . . . . . 4 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -61.48 -46.21 90.98 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 124.902 3.501 . . . . 0.0 115.575 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.472 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 2.0 tm? -67.76 -45.94 73.5 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.744 1.217 . . . . 0.0 113.908 169.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.964 0.0 OUTLIER -77.05 -16.13 59.36 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.153 -2.217 . . . . 0.0 115.869 -179.616 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.487 ' HD1' ' HD3' ' A' ' 71' ' ' LYS . 41.0 m-70 -72.65 -36.64 68.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 130.066 3.346 . . . . 0.0 107.214 162.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.95 -15.85 61.11 Favored 'General case' 0 CA--C 1.59 2.518 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.636 HG22 ' CD2' ' A' ' 73' ' ' HIS . 4.4 mm -86.23 -40.15 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 128.079 2.552 . . . . 0.0 113.743 171.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.487 ' HD3' ' HD1' ' A' ' 68' ' ' HIS . 31.6 ttpt -52.75 -14.27 0.52 Allowed 'General case' 0 N--CA 1.503 2.203 1 C-N-CA 136.104 5.762 . . . . 0.0 115.951 175.496 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.343 35.3 t70 -80.89 -34.51 33.47 Favored 'General case' 0 N--CA 1.432 -1.369 1 C-N-CA 135.97 5.708 . . . . 0.0 111.014 176.914 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.636 ' CD2' HG22 ' A' ' 70' ' ' ILE 0.371 0.0 OUTLIER -88.12 24.31 1.88 Allowed 'General case' 0 CA--C 1.487 -1.459 0 C-N-CA 130.103 3.361 . . . . 0.0 116.573 -168.407 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.464 ' HA ' HG12 ' A' ' 77' ' ' VAL . 73.1 t -38.4 -33.51 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 129.206 3.002 . . . . 0.0 113.989 158.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -64.92 -39.5 93.6 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 131.217 3.807 . . . . 0.0 115.628 171.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -74.82 -36.74 62.42 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 127.039 2.135 . . . . 0.0 111.921 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.469 HG23 ' CZ ' ' A' ' 41' ' ' PHE 0.514 0.2 OUTLIER -71.34 -28.85 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-O 124.178 1.942 . . . . 0.0 113.149 172.801 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -47.66 80.71 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 128.765 2.826 . . . . 0.0 110.957 164.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -59.26 -30.49 68.33 Favored 'General case' 0 C--N 1.382 2.002 0 C-N-CA 126.459 1.903 . . . . 0.0 114.58 168.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -68.57 -37.9 80.27 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 127.652 2.381 . . . . 0.0 112.697 171.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.457 HD23 ' HB2' ' A' ' 125' ' ' LYS . 2.3 tm? . . . . . 0 C--N 1.377 1.791 0 C-N-CA 129.227 3.011 . . . . 0.0 111.489 170.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.491 -1.429 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 43.1 ptt85 -118.57 149.57 41.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.937 1.827 . . . . 0.0 113.996 -176.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.87 143.39 47.0 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 129.255 3.022 . . . . 0.0 108.305 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -129.88 117.83 20.78 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 103.035 -2.95 . . . . 0.0 103.035 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.416 ' HB ' ' CD1' ' A' ' 150' ' ' ILE 0.319 15.4 pt -135.57 140.98 43.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 C-N-CA 127.175 2.19 . . . . 0.0 107.664 -175.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.6 m -132.93 125.09 29.07 Favored 'General case' 0 CA--C 1.497 -1.087 0 O-C-N 118.252 -2.78 . . . . 0.0 106.29 -172.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -148.12 162.49 39.31 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 103.128 -2.915 . . . . 0.0 103.128 -169.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.472 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 84.29 -61.33 4.73 Favored Glycine 0 N--CA 1.479 1.552 0 O-C-N 119.885 -1.759 . . . . 0.0 115.793 170.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 162.12 -30.34 0.0 OUTLIER 'General case' 0 CA--C 1.563 1.456 1 C-N-CA 137.845 6.458 . . . . 0.0 106.611 -167.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.423 HD13 HG21 ' A' ' 63' ' ' VAL 0.559 0.5 OUTLIER -79.56 136.61 36.91 Favored 'General case' 0 C--N 1.379 1.878 2 C-N-CA 132.657 4.383 . . . . 0.0 122.358 -175.908 . . . . . . . . 5 4 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -90.32 101.84 14.57 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.276 0.2 OUTLIER -94.49 131.57 40.06 Favored 'General case' 0 C--N 1.383 2.032 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 177.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.92 127.19 7.69 Favored Glycine 0 C--N 1.353 1.514 0 N-CA-C 105.95 -2.86 . . . . 0.0 105.95 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -120.95 139.93 52.57 Favored 'General case' 0 C--N 1.368 1.405 0 N-CA-C 104.121 -2.548 . . . . 0.0 104.121 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -132.52 137.42 47.16 Favored 'General case' 0 CA--C 1.481 -1.688 0 N-CA-C 100.956 -3.72 . . . . 0.0 100.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -68.62 164.04 2.9 Favored 'Isoleucine or valine' 0 C--N 1.368 1.39 0 CA-C-N 120.282 1.401 . . . . 0.0 109.41 169.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.442 ' SG ' ' HD2' ' A' ' 127' ' ' PRO . 24.8 p -39.04 99.2 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 126.662 1.985 . . . . 0.0 115.813 169.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.264 54.5 tptt -68.02 -40.62 23.3 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 119.404 3.113 . . . . 0.0 119.404 -168.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -100.15 58.46 0.04 OUTLIER 'Trans proline' 0 CA--C 1.549 1.271 0 CA-C-N 125.327 2.938 . . . . 0.0 111.165 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.418 ' N ' HD21 ' A' ' 121' ' ' ASN . 0.2 OUTLIER 174.34 -173.83 0.07 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 125.721 1.609 . . . . 0.0 107.009 -175.118 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.424 ' H ' ' HD2' ' A' ' 123' ' ' LYS . 2.9 tp10 -156.09 -77.54 0.09 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 153.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.424 ' HD2' ' H ' ' A' ' 122' ' ' GLU 0.3 1.7 mptp? 60.84 -32.54 0.07 Allowed 'General case' 0 N--CA 1.436 -1.15 1 C-N-CA 135.58 5.552 . . . . 0.0 117.137 -172.872 . . . . . . . . 4 3 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.408 ' H ' ' C ' ' A' ' 122' ' ' GLU . 0.1 OUTLIER -109.31 -149.07 0.43 Allowed 'General case' 0 N--CA 1.442 -0.827 1 C-N-CA 132.119 4.168 . . . . 0.0 109.602 -179.523 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.457 ' HB2' HD23 ' A' ' 81' ' ' LEU 0.306 0.0 OUTLIER -99.7 -54.01 3.03 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 129.066 2.947 . . . . 0.0 107.456 172.534 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -171.65 107.36 0.38 Allowed Pre-proline 0 C--N 1.356 0.886 0 C-N-CA 125.485 1.514 . . . . 0.0 114.199 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.442 ' HD2' ' SG ' ' A' ' 118' ' ' CYS . 8.2 Cg_endo -121.69 19.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.375 1.957 0 CA-C-N 124.015 2.47 . . . . 0.0 118.125 174.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.26 0.7 OUTLIER -146.29 153.5 40.63 Favored 'General case' 0 CA--C 1.479 -1.769 0 N-CA-C 103.361 -2.829 . . . . 0.0 103.361 159.256 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mt -103.82 135.03 46.13 Favored 'General case' 0 C--N 1.365 1.27 1 N-CA-C 99.758 -4.164 . . . . 0.0 99.758 161.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -129.95 74.85 1.61 Allowed 'General case' 0 CA--C 1.488 -1.41 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 -173.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 45' ' ' TYR 0.285 71.7 m 120.85 78.48 0.0 OUTLIER 'General case' 0 C--N 1.359 1.013 0 N-CA-C 103.845 -2.65 . . . . 0.0 103.845 -174.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -101.66 109.03 20.74 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 102.537 -3.134 . . . . 0.0 102.537 170.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.35 135.17 50.09 Favored 'General case' 0 C--N 1.348 0.528 0 C-N-CA 127.06 2.144 . . . . 0.0 111.134 -174.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.07 116.29 19.06 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 126.62 1.968 . . . . 0.0 110.647 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -135.2 133.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.365 1.255 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 174.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.508 ' CG2' ' H ' ' A' ' 137' ' ' ASN . 0.2 OUTLIER -121.35 -167.92 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.764 0 C-N-CA 127.432 2.293 . . . . 0.0 112.225 -172.243 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.508 ' H ' ' CG2' ' A' ' 136' ' ' ILE . 0.4 OUTLIER -177.19 -173.49 0.45 Allowed 'General case' 0 CA--C 1.476 -1.885 1 C-N-CA 137.991 6.517 . . . . 0.0 106.989 177.353 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.595 ' HB2' ' CD ' ' A' ' 139' ' ' ARG 0.375 12.5 m 153.81 -49.94 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 109.923 -3.308 . . . . 0.0 103.975 -168.064 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.595 ' CD ' ' HB2' ' A' ' 138' ' ' SER . 0.0 OUTLIER -133.17 -78.66 0.48 Allowed 'General case' 0 N--CA 1.424 -1.765 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.985 -157.421 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.568 ' HG3' ' CD ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -105.89 -19.44 13.74 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 130.222 3.409 . . . . 0.0 119.394 -165.413 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.455 ' HB2' ' CA ' ' A' ' 137' ' ' ASN . 2.7 mt . . . . . 0 N--CA 1.439 -1.019 0 C-N-CA 129.647 3.179 . . . . 0.0 114.049 -162.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.416 ' CD1' ' HB ' ' A' ' 106' ' ' ILE . 4.5 pt . . . . . 0 CA--C 1.547 0.846 0 CA-C-O 122.114 0.959 . . . . 0.0 113.226 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.385 38.7 mttm -116.65 146.98 42.35 Favored 'General case' 0 CA--C 1.5 -0.956 1 N-CA-C 98.969 -4.456 . . . . 0.0 98.969 155.043 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 5.9 t -77.62 139.47 39.5 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 -132.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 . . . . . 0 C--O 1.262 1.761 0 CA-C-N 109.01 -3.723 . . . . 0.0 117.51 -162.011 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.509 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 35.4 m-80 . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 117.322 2.341 . . . . 0.0 117.322 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.33 -57.7 9.53 Favored 'General case' 0 C--N 1.349 0.571 1 C-N-CA 131.956 4.102 . . . . 0.0 111.728 172.839 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -75.13 -14.57 60.58 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.013 2.125 . . . . 0.0 112.616 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.509 ' CG1' ' HA ' ' A' ' 4' ' ' ASN 0.316 0.8 OUTLIER -86.66 -33.67 7.26 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 126.791 2.036 . . . . 0.0 110.696 176.395 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -66.76 -44.69 80.76 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 128.599 2.759 . . . . 0.0 109.002 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mt -58.2 -43.21 85.23 Favored 'Isoleucine or valine' 0 C--N 1.363 1.169 0 CA-C-N 113.615 -1.629 . . . . 0.0 111.696 165.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 12.6 ttm105 -59.94 -49.44 77.66 Favored 'General case' 0 C--N 1.369 1.435 0 O-C-N 119.733 -1.855 . . . . 0.0 115.654 170.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 75.9 mtm180 -58.59 -30.53 67.27 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 119.113 3.005 . . . . 0.0 119.113 167.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -77.16 -49.02 16.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.696 3.198 . . . . 0.0 111.035 173.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 14.2 mmtp -57.49 -29.14 64.02 Favored 'General case' 0 C--N 1.376 1.752 0 C-N-CA 128.629 2.772 . . . . 0.0 109.679 170.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.435 ' CD1' ' HA ' ' A' ' 54' ' ' ILE . 0.0 OUTLIER -72.32 -43.45 64.12 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.038 1.335 . . . . 0.0 113.854 168.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -55.8 -40.92 73.38 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 119.764 -1.835 . . . . 0.0 112.496 168.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.3 mmt-85 -63.38 -48.09 79.36 Favored 'General case' 0 C--N 1.379 1.879 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 165.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.407 ' CG ' ' O ' ' A' ' 13' ' ' LYS 0.29 11.4 m-70 -57.03 -46.89 82.04 Favored 'General case' 0 C--N 1.39 2.354 1 C-N-CA 131.932 4.093 . . . . 0.0 110.27 175.81 . . . . . . . . 4 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.453 ' CE1' HD22 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -58.55 -54.54 45.91 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 130.144 3.378 . . . . 0.0 110.889 175.238 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.17 -45.16 58.11 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 118.046 2.609 . . . . 0.0 118.046 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.9 m -65.78 -41.41 92.06 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.252 2.221 . . . . 0.0 112.748 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.418 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.392 3.7 mp0 -77.28 -29.25 53.7 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 120.611 -1.306 . . . . 0.0 111.249 172.071 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.67 -31.27 70.52 Favored 'General case' 0 C--N 1.388 2.258 0 O-C-N 119.18 -2.2 . . . . 0.0 112.76 167.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -69.17 -38.33 78.64 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 125.203 1.401 . . . . 0.0 110.632 165.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 31.4 tp60 -58.47 -46.87 85.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 168.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.5 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.7 mt -70.75 -45.46 73.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 O-C-N 121.24 -0.912 . . . . 0.0 112.285 175.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.628 0.5 OUTLIER -70.61 -23.69 62.6 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 119.825 1.193 . . . . 0.0 113.662 177.099 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -69.31 -45.95 68.3 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.19 -1.569 . . . . 0.0 109.814 167.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -64.19 -36.75 85.09 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.764 -1.835 . . . . 0.0 114.308 174.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.422 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 4.8 mt -62.31 -50.09 81.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 C-N-CA 125.055 1.342 . . . . 0.0 113.943 171.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttm105 -68.31 -28.6 67.32 Favored 'General case' 0 C--N 1.361 1.085 0 CA-C-N 121.534 1.97 . . . . 0.0 115.056 176.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -76.21 -45.38 33.34 Favored 'General case' 0 C--N 1.37 1.489 0 O-C-N 119.776 -1.827 . . . . 0.0 110.331 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.6 -40.42 66.53 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.348 4.0 p -68.93 -39.04 79.84 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.617 1.167 . . . . 0.0 111.19 177.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 mmtp -66.32 -46.25 77.53 Favored 'General case' 0 C--N 1.376 1.758 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 167.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.93 71.93 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 126.114 1.766 . . . . 0.0 114.783 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.33 -13.89 60.81 Favored 'General case' 0 C--N 1.376 1.736 0 CA-C-N 119.411 1.005 . . . . 0.0 113.495 169.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.98 18.02 30.68 Favored Glycine 0 C--N 1.38 2.988 0 CA-C-N 119.567 1.076 . . . . 0.0 114.094 171.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.438 HG23 ' CD1' ' A' ' 81' ' ' LEU . 1.9 m -118.83 175.8 3.56 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 -175.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.316 3.6 m -52.44 162.04 0.59 Allowed 'General case' 0 N--CA 1.428 -1.546 1 C-N-CA 132.574 4.35 . . . . 0.0 118.966 176.86 . . . . . . . . 3 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.6 m -92.82 112.71 24.76 Favored 'General case' 0 CA--C 1.49 -1.335 0 C-N-CA 124.821 1.249 . . . . 0.0 107.632 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.481 ' CZ ' HG21 ' A' ' 77' ' ' VAL 0.277 42.9 p90 -114.0 144.53 42.95 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.056 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -118.35 163.12 17.19 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-O 123.601 1.667 . . . . 0.0 112.359 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -122.06 121.78 37.76 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 125.766 1.626 . . . . 0.0 114.403 -174.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -122.01 162.05 21.84 Favored 'General case' 0 C--N 1.373 1.621 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 171.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -116.34 172.55 7.12 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 170.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.9 m -97.59 117.84 32.76 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 102.893 -3.002 . . . . 0.0 102.893 159.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.554 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.529 0.0 OUTLIER -78.12 -10.16 59.5 Favored 'General case' 0 CA--C 1.556 1.18 0 O-C-N 120.004 -1.685 . . . . 0.0 115.281 -175.298 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.7 -38.82 46.57 Favored 'General case' 0 C--N 1.376 1.746 0 CA-C-O 126.127 2.87 . . . . 0.0 110.071 172.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 21.0 tp -64.45 -35.01 79.55 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 127.809 2.444 . . . . 0.0 111.213 168.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 47' ' ' GLN . 1.8 mp -74.71 -28.09 60.66 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.123 166.152 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.15 -30.6 64.6 Favored 'General case' 0 C--N 1.365 1.262 0 O-C-N 118.299 -2.75 . . . . 0.0 109.747 171.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -79.53 -55.43 5.04 Favored 'General case' 0 C--N 1.386 2.195 0 N-CA-C 117.821 2.526 . . . . 0.0 117.821 158.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.16 -30.69 70.55 Favored 'General case' 0 N--CA 1.502 2.15 1 CA-C-N 127.366 4.621 . . . . 0.0 118.852 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.438 ' CG1' HD23 ' A' ' 50' ' ' LEU . 42.1 mt -68.53 -46.49 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 128.08 2.552 . . . . 0.0 112.529 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -102.54 -18.98 15.04 Favored 'General case' 0 C--N 1.371 1.517 0 N-CA-C 119.031 2.975 . . . . 0.0 119.031 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -90.0 -7.41 54.05 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-N 123.168 2.713 . . . . 0.0 111.794 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -125.96 -65.25 1.0 Allowed 'General case' 0 C--N 1.354 0.786 0 C-N-CA 126.403 1.881 . . . . 0.0 108.93 -176.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.49 0.2 OUTLIER 71.47 147.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 128.574 2.75 . . . . 0.0 112.593 178.243 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.412 ' N ' ' HG ' ' A' ' 14' ' ' LEU . 22.0 t70 58.6 -61.52 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 129.409 3.084 . . . . 0.0 113.679 -175.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.431 ' HB2' ' HB ' ' A' ' 63' ' ' VAL 0.508 7.0 pt-20 27.69 61.56 0.1 Allowed 'General case' 0 C--O 1.205 -1.275 1 C-N-CA 133.799 4.84 . . . . 0.0 114.301 -178.101 . . . . . . . . 4 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.438 34.9 p -78.03 -10.82 59.79 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 118.171 -2.831 . . . . 0.0 114.043 -172.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -68.95 -33.49 73.8 Favored 'General case' 0 CA--C 1.552 1.032 1 C-N-CA 133.653 4.781 . . . . 0.0 110.56 164.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.431 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -67.52 -44.33 86.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.412 0 C-N-CA 129.785 3.234 . . . . 0.0 108.804 -178.518 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.418 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.292 28.1 m-85 -63.81 -43.94 94.74 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 130.591 3.556 . . . . 0.0 112.682 166.445 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -59.25 -44.91 92.36 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.259 2.3 . . . . 0.0 114.681 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.515 ' HG ' ' CD2' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -59.47 -50.72 72.83 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 129.4 3.08 . . . . 0.0 113.125 169.797 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.413 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.812 0.1 OUTLIER -77.67 -17.48 57.64 Favored 'General case' 0 C--N 1.377 1.779 0 O-C-N 119.201 -2.187 . . . . 0.0 114.64 176.842 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.5 ' CE1' HG12 ' A' ' 25' ' ' ILE . 52.9 m-70 -80.03 -16.29 55.42 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 126.852 2.061 . . . . 0.0 111.405 166.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -84.36 -40.93 17.27 Favored 'General case' 0 CA--C 1.556 1.201 0 O-C-N 120.38 -1.45 . . . . 0.0 110.488 160.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.413 ' HB ' ' HA ' ' A' ' 67' ' ' PHE 0.327 0.9 OUTLIER -58.51 -26.16 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.808 0 C-N-CA 128.521 2.728 . . . . 0.0 113.896 176.009 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -61.72 -11.95 14.39 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 129.615 3.166 . . . . 0.0 117.431 174.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.316 80.5 m-20 -89.18 -36.81 15.46 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 123.8 1.762 . . . . 0.0 109.987 -173.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.465 ' NE2' ' HG3' ' A' ' 151' ' ' LYS . 1.9 t-80 -87.46 24.14 1.73 Allowed 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 131.48 3.912 . . . . 0.0 116.206 -166.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.48 ' HA ' HG13 ' A' ' 77' ' ' VAL 0.283 95.7 t -41.95 -31.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 128.171 2.589 . . . . 0.0 114.118 161.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.97 -39.07 92.92 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 127.108 2.163 . . . . 0.0 115.748 171.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.368 63.9 mm-40 -76.24 -34.74 59.2 Favored 'General case' 0 C--N 1.366 1.324 0 O-C-N 118.908 -2.37 . . . . 0.0 113.698 170.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.481 HG21 ' CZ ' ' A' ' 41' ' ' PHE 0.404 1.9 p -70.81 -29.29 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.699 0 CA-C-O 124.084 1.897 . . . . 0.0 113.654 173.318 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -64.43 -45.37 87.79 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 130.36 3.464 . . . . 0.0 110.326 169.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.28 -30.28 71.13 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 126.187 1.795 . . . . 0.0 112.762 172.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.465 ' CE1' HG23 ' A' ' 77' ' ' VAL 0.609 0.2 OUTLIER -74.86 -29.6 61.08 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 169.381 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.438 ' CD1' HG23 ' A' ' 38' ' ' VAL 0.307 0.4 OUTLIER . . . . . 0 C--N 1.377 1.795 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 168.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.616 0 CA-C-O 122.562 1.09 . . . . 0.0 113.347 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.1 ptt180 -119.42 146.56 45.27 Favored 'General case' 0 C--N 1.349 0.546 0 C-N-CA 125.59 1.556 . . . . 0.0 111.695 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pp -140.16 150.42 44.2 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 126.423 1.889 . . . . 0.0 111.715 -175.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -130.16 130.87 45.29 Favored 'General case' 0 C--N 1.367 1.336 0 C-N-CA 127.277 2.231 . . . . 0.0 105.444 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 4.9 pt -134.51 138.68 49.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -101.64 106.97 18.09 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 173.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.39 143.77 34.14 Favored 'General case' 0 CA--C 1.477 -1.845 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 -168.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 81.71 -21.76 6.23 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.866 2.174 . . . . 0.0 112.23 178.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 116.53 -9.49 0.0 OUTLIER 'General case' 0 C--N 1.376 1.73 1 C-N-CA 135.653 5.581 . . . . 0.0 110.623 -167.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.515 ' CD2' ' HG ' ' A' ' 66' ' ' LEU 0.64 0.0 OUTLIER -78.82 138.2 38.07 Favored 'General case' 0 CA--C 1.481 -1.68 1 C-N-CA 135.025 5.33 . . . . 0.0 118.654 -178.649 . . . . . . . . 5 4 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . 0.465 ' HE1' ' ND2' ' A' ' 137' ' ' ASN . 54.8 m95 -90.45 98.48 11.8 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 103.191 -2.892 . . . . 0.0 103.191 172.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' A' ' 133' ' ' MET 0.369 0.1 OUTLIER -108.46 119.43 39.49 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.758 176.085 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -106.76 131.73 10.79 Favored Glycine 0 C--N 1.361 1.943 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -115.53 145.97 42.14 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 103.249 -2.871 . . . . 0.0 103.249 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -138.86 124.42 19.5 Favored 'General case' 0 CA--C 1.488 -1.42 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -79.57 145.03 9.94 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 120.116 1.326 . . . . 0.0 110.876 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 25.0 m -4.44 84.1 0.0 OUTLIER 'General case' 0 C--N 1.37 1.458 0 C-N-CA 130.353 3.461 . . . . 0.0 119.856 -172.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.266 19.0 tptm -43.39 -48.63 17.57 Favored Pre-proline 0 C--N 1.365 1.266 0 C-N-CA 129.955 3.302 . . . . 0.0 116.238 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -87.06 90.02 0.6 Allowed 'Trans proline' 0 CA--C 1.561 1.87 0 C-N-CA 123.464 2.776 . . . . 0.0 107.589 156.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.264 11.0 m120 -47.78 116.97 1.65 Allowed 'General case' 0 C--N 1.369 1.413 0 C-N-CA 131.19 3.796 . . . . 0.0 119.226 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -83.48 -7.41 59.55 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 130.927 3.691 . . . . 0.0 120.652 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.295 19.4 mmtm 53.51 46.69 25.63 Favored 'General case' 0 N--CA 1.434 -1.229 1 C-N-CA 132.017 4.127 . . . . 0.0 119.958 176.71 . . . . . . . . 3 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.271 38.1 m-85 -156.63 170.36 22.56 Favored 'General case' 0 CA--C 1.489 -1.384 0 CA-C-N 114.475 -1.238 . . . . 0.0 113.972 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.78 76.27 0.97 Allowed 'General case' 0 C--N 1.364 1.224 0 C-N-CA 127.575 2.35 . . . . 0.0 109.416 174.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -175.48 49.9 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.321 1 C-N-CA 137.937 6.495 . . . . 0.0 110.564 177.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.444 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 11.1 Cg_exo -98.7 -178.23 0.26 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.057 3.172 . . . . 0.0 114.182 -164.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.5 p -125.74 163.98 21.65 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.08 130.38 48.66 Favored 'General case' 0 C--N 1.361 1.104 0 N-CA-C 100.288 -3.967 . . . . 0.0 100.288 176.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -109.68 58.49 0.61 Allowed 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 -168.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 17.2 t 119.08 120.39 0.0 OUTLIER 'General case' 0 C--N 1.364 1.22 0 O-C-N 126.796 2.56 . . . . 0.0 106.259 -169.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -114.55 109.42 18.24 Favored 'General case' 0 C--N 1.357 0.907 1 N-CA-C 97.199 -5.112 . . . . 0.0 97.199 159.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' MET . . . . . 0.44 ' O ' ' HA ' ' A' ' 113' ' ' LEU . 0.0 OUTLIER -93.88 119.52 32.91 Favored 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 125.632 1.573 . . . . 0.0 107.87 -177.26 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -127.77 114.93 17.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 120.347 1.43 . . . . 0.0 108.422 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 5.3 mt -142.35 144.19 25.2 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.51 177.66 4.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.65 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -164.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.465 ' ND2' ' HE1' ' A' ' 112' ' ' TRP . 0.2 OUTLIER -133.14 117.5 17.56 Favored 'General case' 0 C--N 1.361 1.082 2 N-CA-C 98.023 -4.806 . . . . 0.0 98.023 162.202 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.99 -61.65 0.03 OUTLIER 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 103.838 -2.652 . . . . 0.0 103.838 -173.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.754 ' CD ' ' H ' ' A' ' 140' ' ' ARG 0.716 0.2 OUTLIER 94.88 132.09 0.02 OUTLIER 'General case' 0 C--N 1.369 1.417 0 CA-C-O 122.524 1.154 . . . . 0.0 112.704 -177.736 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.754 ' H ' ' CD ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER 124.5 -41.32 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.454 3 C-N-CA 135.705 5.602 . . . . 0.0 99.018 -144.388 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.599 ' H ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.38 1.893 2 N-CA-C 127.924 6.268 . . . . 0.0 127.924 171.046 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.533 HD11 ' HG2' ' A' ' 151' ' ' LYS 0.432 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 122.05 0.929 . . . . 0.0 109.783 . . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . 0.533 ' HG2' HD11 ' A' ' 150' ' ' ILE 0.381 7.2 ptmt -73.87 152.82 40.11 Favored 'General case' 0 CA--C 1.511 -0.523 1 C-N-CA 135.177 5.391 . . . . 0.0 105.095 175.73 . . . . . . . . 4 3 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' THR . . . . . 0.439 ' O ' ' CB ' ' A' ' 73' ' ' HIS . 82.8 p -86.21 93.64 9.1 Favored 'General case' 0 C--O 1.203 -1.38 2 O-C-N 114.173 -5.33 . . . . 0.0 109.077 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . 0.426 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 1 N-CA-C 126.395 5.702 . . . . 0.0 126.395 -162.303 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.37 3.4 m120 . . . . . 0 N--CA 1.466 0.347 0 N-CA-C 119.673 3.212 . . . . 0.0 119.673 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -50.75 72.8 Favored 'General case' 0 N--CA 1.445 -0.717 1 C-N-CA 133.341 4.656 . . . . 0.0 111.696 166.922 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -80.35 -16.83 53.64 Favored 'General case' 0 C--N 1.372 1.57 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.0 t -81.55 -39.42 17.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.213 0 C-N-CA 130.41 3.484 . . . . 0.0 108.828 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.56 -47.99 76.7 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.363 2.665 . . . . 0.0 110.339 173.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.81 -43.22 66.47 Favored 'Isoleucine or valine' 0 C--N 1.362 1.14 0 C-N-CA 125.708 1.603 . . . . 0.0 113.495 166.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.1 mtm180 -60.45 -50.78 72.19 Favored 'General case' 0 CA--C 1.56 1.345 0 C-N-CA 126.132 1.773 . . . . 0.0 114.086 171.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -60.47 -26.98 67.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 128.793 2.837 . . . . 0.0 117.634 167.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -77.72 -51.09 11.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 130.381 3.472 . . . . 0.0 110.991 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.8 mmtt -57.75 -29.75 65.04 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 128.907 2.883 . . . . 0.0 109.739 169.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.68 -49.75 65.11 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 114.233 -1.349 . . . . 0.0 113.887 164.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -57.64 -39.56 77.27 Favored 'General case' 0 C--N 1.371 1.533 0 CA-C-N 123.474 2.852 . . . . 0.0 114.452 171.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -61.18 -53.18 60.15 Favored 'General case' 0 C--N 1.379 1.85 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 167.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.293 50.1 m-70 -58.21 -48.73 79.45 Favored 'General case' 0 C--N 1.383 2.046 0 C-N-CA 129.157 2.983 . . . . 0.0 111.922 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . 0.287 0.9 OUTLIER -57.07 -55.64 32.04 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 128.372 2.669 . . . . 0.0 114.583 174.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.98 -35.46 62.05 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -176.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -67.96 -45.01 75.39 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 124.634 1.174 . . . . 0.0 112.806 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.518 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 38.1 mt-10 -77.56 -29.96 52.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.263 -1.523 . . . . 0.0 112.491 173.023 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.312 2.2 m-85 -67.38 -25.96 66.22 Favored 'General case' 0 C--N 1.383 2.05 0 O-C-N 118.706 -2.497 . . . . 0.0 112.362 169.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -66.31 -46.97 75.09 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-O 117.088 -1.434 . . . . 0.0 109.827 161.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -56.68 -47.61 79.47 Favored 'General case' 0 C--N 1.364 1.227 0 N-CA-C 118.842 2.904 . . . . 0.0 118.842 171.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.538 HG12 ' CE1' ' A' ' 68' ' ' HIS . 6.8 mt -70.21 -42.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 O-C-N 120.638 -1.289 . . . . 0.0 111.49 176.023 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.729 0.0 OUTLIER -74.75 -23.27 58.52 Favored 'General case' 0 C--N 1.373 1.59 0 O-C-N 119.224 -2.173 . . . . 0.0 115.345 177.186 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.61 -37.38 73.84 Favored 'General case' 0 C--N 1.383 2.026 0 C-N-CA 125.652 1.581 . . . . 0.0 110.724 167.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.93 -39.36 93.39 Favored 'General case' 0 C--N 1.388 2.245 0 O-C-N 118.961 -2.337 . . . . 0.0 112.013 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.483 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.6 mt -61.55 -42.0 92.34 Favored 'Isoleucine or valine' 0 C--N 1.373 1.59 0 CA-C-N 120.177 1.353 . . . . 0.0 114.321 172.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -59.71 -49.52 77.41 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 124.815 1.246 . . . . 0.0 114.356 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -77.06 -37.97 53.54 Favored 'General case' 0 C--N 1.372 1.58 0 C-N-CA 128.527 2.731 . . . . 0.0 113.912 -176.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.31 -29.16 38.09 Favored 'General case' 0 CA--C 1.494 -1.175 0 CA-C-O 122.49 1.138 . . . . 0.0 113.336 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.454 ' HB2' HD22 ' A' ' 78' ' ' ASN 0.344 23.2 p -79.11 -32.78 44.66 Favored 'General case' 0 C--N 1.357 0.904 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.727 173.277 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -60.43 -38.78 85.15 Favored 'General case' 0 C--N 1.374 1.647 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 163.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.09 -36.76 64.29 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.764 2.426 . . . . 0.0 112.843 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.61 61.25 Favored 'General case' 0 C--N 1.383 2.033 0 CA-C-N 119.342 0.974 . . . . 0.0 112.508 168.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.36 17.15 51.16 Favored Glycine 0 C--N 1.364 2.114 0 C-N-CA 127.161 2.315 . . . . 0.0 114.076 172.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.46 HG13 ' HB3' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -119.52 148.13 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.607 0 CA-C-O 124.482 2.086 . . . . 0.0 108.824 -174.776 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.322 0.1 OUTLIER -11.25 -58.77 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.655 2 C-N-CA 135.757 5.623 . . . . 0.0 121.846 -179.584 . . . . . . . . 4 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.302 90.8 p 100.23 171.28 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.743 0 C-N-CA 129.3 3.04 . . . . 0.0 108.542 -171.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.483 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 54.2 p90 -151.12 154.79 37.62 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 126.189 1.796 . . . . 0.0 107.195 176.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -116.33 124.15 49.41 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 122.296 1.046 . . . . 0.0 109.835 174.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -94.55 160.91 14.43 Favored 'General case' 0 C--N 1.338 0.105 0 O-C-N 118.275 -2.765 . . . . 0.0 114.356 -175.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -138.73 141.41 38.91 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.25 1.82 . . . . 0.0 106.631 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -108.56 154.61 21.7 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 125.445 1.498 . . . . 0.0 108.238 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 110.71 22.76 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 125.063 1.345 . . . . 0.0 113.067 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.631 ' HA ' ' CB ' ' A' ' 50' ' ' LEU 0.965 0.0 OUTLIER -72.73 -8.28 54.62 Favored 'General case' 0 C--N 1.355 0.816 1 C-N-CA 134.004 4.922 . . . . 0.0 120.656 -175.304 . . . . . . . . 5 4 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 -47.08 15.82 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 125.292 2.472 . . . . 0.0 109.707 167.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.8 tp -60.67 -36.07 77.83 Favored 'General case' 0 C--N 1.369 1.429 0 C-N-CA 128.339 2.656 . . . . 0.0 110.06 164.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.631 ' CB ' ' HA ' ' A' ' 47' ' ' GLN 0.367 0.2 OUTLIER -74.52 -28.51 61.0 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 113.203 -1.817 . . . . 0.0 111.443 170.414 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -59.93 -29.47 68.41 Favored 'General case' 0 CA--C 1.559 1.31 0 O-C-N 116.524 -3.86 . . . . 0.0 109.287 171.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -73.21 -50.93 19.72 Favored 'General case' 0 C--N 1.381 1.948 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 158.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.448 ' HB1' ' CD1' ' A' ' 50' ' ' LEU . . . -61.8 -29.48 70.18 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 123.945 3.066 . . . . 0.0 116.919 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.437 HG23 HD12 ' A' ' 54' ' ' ILE . 1.3 tt -75.58 -39.01 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.139 1 C-N-CA 132.754 4.422 . . . . 0.0 112.693 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.19 -26.28 15.0 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 118.525 -1.27 . . . . 0.0 112.8 172.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -74.03 -52.31 13.12 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 120.617 -1.302 . . . . 0.0 112.179 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -109.51 8.42 25.16 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 116.826 2.158 . . . . 0.0 116.826 -175.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.474 0.0 OUTLIER 23.83 -26.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.633 2 C-N-CA 136.656 5.982 . . . . 0.0 125.723 175.096 . . . . . . . . 4 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -112.92 -47.47 3.04 Favored 'General case' 0 CA--C 1.467 -2.214 1 C-N-CA 132.334 4.253 . . . . 0.0 108.706 176.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.46 ' HB2' ' HB ' ' A' ' 63' ' ' VAL 0.892 0.0 OUTLIER 15.47 55.61 0.01 OUTLIER 'General case' 0 C--N 1.359 0.995 0 N-CA-C 121.348 3.833 . . . . 0.0 121.348 -166.887 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.258 21.6 p -78.78 -19.07 53.08 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 129.605 3.162 . . . . 0.0 110.705 174.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . 0.266 40.5 t80 -65.48 -34.51 78.43 Favored 'General case' 0 CA--C 1.543 0.703 1 C-N-CA 132.458 4.303 . . . . 0.0 111.636 168.621 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.46 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.5 OUTLIER -60.66 -45.87 96.77 Favored 'Isoleucine or valine' 0 C--N 1.364 1.233 0 C-N-CA 130.231 3.413 . . . . 0.0 109.076 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.518 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 43.2 m-85 -62.61 -46.0 90.29 Favored 'General case' 0 CA--C 1.493 -1.241 1 C-N-CA 132.422 4.289 . . . . 0.0 112.79 170.078 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.89 -42.47 97.46 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 121.564 1.984 . . . . 0.0 114.902 177.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -65.02 -49.27 70.83 Favored 'General case' 0 CA--C 1.565 1.526 0 C-N-CA 127.797 2.439 . . . . 0.0 113.516 170.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.415 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.782 0.0 OUTLIER -78.5 -16.26 57.7 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 118.485 -2.634 . . . . 0.0 115.909 178.23 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.538 ' CE1' HG12 ' A' ' 25' ' ' ILE . 46.5 m-70 -76.81 -28.31 55.52 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 129.405 3.082 . . . . 0.0 106.797 164.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -70.08 -34.89 73.74 Favored 'General case' 0 CA--C 1.569 1.704 0 O-C-N 118.769 -2.457 . . . . 0.0 112.483 159.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.415 ' HB ' ' HA ' ' A' ' 67' ' ' PHE . 20.1 mm -72.1 -11.88 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.087 1 C-N-CA 132.258 4.223 . . . . 0.0 118.05 176.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.3 pttm -60.06 -26.94 66.55 Favored 'General case' 0 C--N 1.32 -0.699 2 N-CA-C 124.157 4.873 . . . . 0.0 124.157 -175.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.34 -20.26 15.93 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 127.239 2.215 . . . . 0.0 108.735 -172.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.565 ' CD2' ' HA ' ' A' ' 153' ' ' GLN . 2.1 m-70 -77.22 16.07 0.64 Allowed 'General case' 0 C--N 1.372 1.563 0 C-N-CA 129.174 2.99 . . . . 0.0 112.414 172.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.523 ' HA ' ' CG1' ' A' ' 77' ' ' VAL . 3.9 p -49.99 -27.93 4.08 Favored 'Isoleucine or valine' 0 C--N 1.378 1.82 0 C-N-CA 128.678 2.791 . . . . 0.0 111.569 157.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.24 -31.01 69.29 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 128.215 2.606 . . . . 0.0 113.22 174.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -76.28 -40.06 52.69 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 126.967 2.107 . . . . 0.0 112.324 172.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.523 ' CG1' ' HA ' ' A' ' 74' ' ' VAL 0.461 3.0 p -70.11 -27.82 33.81 Favored 'Isoleucine or valine' 0 C--N 1.367 1.353 0 CA-C-O 124.629 2.156 . . . . 0.0 111.636 171.405 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.46 ' HB3' HG13 ' A' ' 38' ' ' VAL . 9.1 m120 -70.12 -38.7 75.64 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.991 2.116 . . . . 0.0 114.39 167.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -30.43 70.0 Favored 'General case' 0 C--N 1.369 1.423 0 CA-C-N 121.075 1.761 . . . . 0.0 111.269 170.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -64.04 -36.17 83.11 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 129.139 2.976 . . . . 0.0 112.03 167.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.275 0.5 OUTLIER . . . . . 0 C--N 1.39 2.365 0 O-C-N 119.81 -1.806 . . . . 0.0 113.769 170.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.171 0 N-CA-C 119.017 2.367 . . . . 0.0 119.017 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -140.99 140.96 34.44 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 120.961 -1.317 . . . . 0.0 107.695 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 mt -115.95 129.3 56.33 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 127.004 2.122 . . . . 0.0 108.54 -176.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -129.89 110.87 12.04 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 18.0 pt -135.72 139.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 110.673 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -112.49 127.71 56.13 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 173.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -139.11 -174.54 3.88 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 100.625 -3.843 . . . . 0.0 100.625 -175.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.81 -59.44 3.01 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 121.468 3.347 . . . . 0.0 121.468 154.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . 0.272 1.1 m-80 129.74 -28.57 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 131.163 3.785 . . . . 0.0 104.403 -144.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.4 HD23 ' CG2' ' A' ' 63' ' ' VAL . 0.2 OUTLIER -79.47 132.47 36.36 Favored 'General case' 0 C--N 1.359 1.006 1 C-N-CA 132.412 4.285 . . . . 0.0 117.959 -171.853 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -92.02 101.48 14.02 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 167.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.294 1.4 mm? -95.09 121.53 36.82 Favored 'General case' 0 C--N 1.383 2.037 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 176.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -116.19 122.65 5.6 Favored Glycine 0 C--N 1.355 1.611 0 N-CA-C 106.484 -2.647 . . . . 0.0 106.484 171.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -117.6 147.0 43.25 Favored 'General case' 0 C--N 1.367 1.347 0 CA-C-N 121.402 2.601 . . . . 0.0 104.656 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.9 m -134.57 133.31 40.09 Favored 'General case' 0 C--N 1.367 1.334 0 N-CA-C 103.118 -2.919 . . . . 0.0 103.118 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -92.84 139.96 17.12 Favored 'Isoleucine or valine' 0 C--N 1.352 0.698 0 C-N-CA 125.497 1.519 . . . . 0.0 109.514 177.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.306 20.0 p -7.41 73.15 0.0 OUTLIER 'General case' 0 C--N 1.38 1.898 0 C-N-CA 131.571 3.948 . . . . 0.0 119.869 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.333 44.5 tttp -44.3 -53.68 13.56 Favored Pre-proline 0 C--N 1.363 1.161 1 C-N-CA 133.585 4.754 . . . . 0.0 116.959 -171.869 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.64 71.52 1.45 Allowed 'Trans proline' 0 CA--C 1.564 1.983 0 C-N-CA 123.368 2.712 . . . . 0.0 110.429 161.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -55.66 141.25 38.54 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 120.692 3.59 . . . . 0.0 120.692 -173.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.15 113.48 2.96 Favored 'General case' 0 N--CA 1.425 -1.706 2 N-CA-C 95.529 -5.73 . . . . 0.0 95.529 167.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 33.6 mmtm -71.43 55.98 0.24 Allowed 'General case' 0 C--N 1.345 0.382 0 C-N-CA 129.937 3.295 . . . . 0.0 117.241 -172.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -58.28 148.83 26.04 Favored 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.538 4.335 . . . . 0.0 117.586 177.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.307 0.0 OUTLIER -110.82 48.78 0.9 Allowed 'General case' 0 C--N 1.368 1.391 0 CA-C-O 123.816 1.769 . . . . 0.0 107.546 176.024 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -173.36 62.77 0.28 Allowed Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 130.789 3.635 . . . . 0.0 108.448 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -71.78 -177.07 2.32 Favored 'Trans proline' 0 C--N 1.355 0.88 1 C-N-CA 126.589 4.859 . . . . 0.0 118.838 -175.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 77.7 p -137.63 153.07 49.92 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-N 110.413 -3.085 . . . . 0.0 103.343 167.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 43.1 mt -103.24 130.68 50.53 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 101.329 -3.582 . . . . 0.0 101.329 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -126.34 67.4 1.22 Allowed 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -160.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 72.5 m 110.8 84.04 0.0 OUTLIER 'General case' 0 C--N 1.372 1.587 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -101.58 109.81 21.68 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 101.418 -3.549 . . . . 0.0 101.418 173.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.52 121.98 45.39 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 127.325 2.25 . . . . 0.0 107.355 -174.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.15 114.76 17.42 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 176.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -133.8 149.73 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-O 123.053 1.406 . . . . 0.0 109.211 -176.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.02 -179.7 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 C-N-CA 125.275 1.43 . . . . 0.0 108.597 -175.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.6 124.52 27.0 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 128.735 2.814 . . . . 0.0 116.863 -170.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.36 14.5 m 150.22 -83.8 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.089 1 C-N-CA 132.135 4.174 . . . . 0.0 102.926 176.561 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.645 ' H ' HD13 ' A' ' 141' ' ' LEU . 0.0 OUTLIER 153.83 152.23 0.01 OUTLIER 'General case' 0 CA--C 1.483 -1.596 1 N-CA-C 96.747 -5.279 . . . . 0.0 96.747 -166.309 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.453 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 39.77 -51.78 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.975 2 CA-C-N 129.347 5.522 . . . . 0.0 124.173 -178.657 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.645 HD13 ' H ' ' A' ' 139' ' ' ARG 0.416 0.0 OUTLIER . . . . . 0 N--CA 1.427 -1.621 1 C-N-CA 150.524 11.53 . . . . 0.0 118.821 178.175 . . . . . . . . 4 3 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . 0.543 0.0 OUTLIER . . . . . 0 N--CA 1.448 -0.537 0 CA-C-O 124.772 2.225 . . . . 0.0 110.089 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.12 158.31 33.29 Favored 'General case' 0 N--CA 1.416 -2.127 1 C-N-CA 145.279 9.432 . . . . 0.0 110.91 -171.888 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 14.6 t -74.18 113.88 11.89 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 128.003 3.763 . . . . 0.0 102.883 166.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.565 ' HA ' ' CD2' ' A' ' 73' ' ' HIS . 0.1 OUTLIER . . . . . 0 N--CA 1.402 -2.844 0 CA-C-N 109.582 -3.463 . . . . 0.0 108.841 -167.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.1 m120 . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 124.09 1.9 . . . . 0.0 114.264 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -58.23 1.93 Allowed 'General case' 0 N--CA 1.448 -0.557 1 C-N-CA 135.515 5.526 . . . . 0.0 106.768 164.557 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 13.5 mt-10 -66.21 -9.82 35.79 Favored 'General case' 0 C--N 1.369 1.449 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.31 -38.14 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 C-N-CA 129.561 3.145 . . . . 0.0 112.035 177.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -71.56 -47.4 55.29 Favored 'General case' 0 C--N 1.357 0.933 1 C-N-CA 132.148 4.179 . . . . 0.0 107.665 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.9 mt -58.72 -43.88 88.76 Favored 'Isoleucine or valine' 0 C--N 1.37 1.497 0 C-N-CA 125.254 1.422 . . . . 0.0 112.132 168.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.296 91.2 mtm-85 -64.09 -50.14 69.48 Favored 'General case' 0 C--N 1.376 1.739 0 O-C-N 120.046 -1.659 . . . . 0.0 114.33 169.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 29.7 mtp180 -57.5 -28.64 63.63 Favored 'General case' 0 C--N 1.374 1.639 0 CA-C-N 124.405 3.275 . . . . 0.0 119.165 172.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -77.6 -51.64 10.32 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 130.374 3.47 . . . . 0.0 112.006 172.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -57.44 -28.62 63.48 Favored 'General case' 0 C--N 1.378 1.809 0 C-N-CA 128.131 2.572 . . . . 0.0 110.742 170.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.5 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.2 OUTLIER -70.71 -45.36 65.08 Favored 'General case' 0 C--O 1.206 -1.215 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.544 167.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.446 HH21 ' HG3' ' A' ' 47' ' ' GLN . 24.4 ttt180 -55.81 -40.39 72.67 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.747 -1.221 . . . . 0.0 114.106 169.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 mmt-85 -63.45 -49.08 75.08 Favored 'General case' 0 C--N 1.374 1.654 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 166.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -56.77 -43.51 80.87 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 129.397 3.079 . . . . 0.0 110.875 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.473 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.76 -54.95 39.01 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 130.546 3.538 . . . . 0.0 112.174 175.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -75.82 -39.62 56.42 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 -178.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -73.2 -36.11 66.46 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.749 2.42 . . . . 0.0 112.426 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.526 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.341 33.4 mt-10 -77.64 -29.37 51.66 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 120.463 -1.398 . . . . 0.0 110.89 167.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.515 ' CZ ' ' CE2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -59.18 -32.58 70.04 Favored 'General case' 0 C--N 1.383 2.049 0 O-C-N 119.175 -2.203 . . . . 0.0 113.511 168.59 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -45.98 74.27 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 127.774 2.43 . . . . 0.0 109.527 167.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -57.47 -39.75 77.06 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 170.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.569 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.1 mt -72.07 -45.56 62.59 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 O-C-N 120.908 -1.12 . . . . 0.0 111.657 177.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.488 8.3 p30 -70.84 -24.16 62.48 Favored 'General case' 0 C--N 1.373 1.61 0 O-C-N 120.179 -1.575 . . . . 0.0 114.283 173.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -73.77 -29.99 62.52 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.159 2.184 . . . . 0.0 110.182 169.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.68 -38.46 64.9 Favored 'General case' 0 C--N 1.39 2.346 0 O-C-N 118.315 -2.741 . . . . 0.0 109.739 172.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.474 HG12 ' CE2' ' A' ' 41' ' ' PHE . 1.3 mt -64.62 -46.13 93.37 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 CA-C-O 118.04 -0.981 . . . . 0.0 111.101 167.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.8 tpp180 -55.38 -45.0 76.62 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 122.632 2.469 . . . . 0.0 116.705 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.59 -41.16 47.27 Favored 'General case' 0 CA--C 1.488 -1.418 0 C-N-CA 128.018 2.527 . . . . 0.0 112.639 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.13 -31.4 30.6 Favored 'General case' 0 C--N 1.355 0.835 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.297 25.6 p -75.4 -34.82 61.1 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.388 1.475 . . . . 0.0 108.722 177.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -71.15 -35.88 71.85 Favored 'General case' 0 C--N 1.368 1.395 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 165.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 -36.2 64.31 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.79 -14.74 60.31 Favored 'General case' 0 C--N 1.375 1.697 0 CA-C-N 120.761 1.619 . . . . 0.0 114.016 171.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.37 15.42 44.15 Favored Glycine 0 C--N 1.376 2.8 0 O-C-N 121.187 -0.945 . . . . 0.0 114.51 172.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.464 ' CG2' ' H ' ' A' ' 39' ' ' SER . 7.5 p -99.98 179.37 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 126.379 1.872 . . . . 0.0 107.026 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.524 ' HB3' HD21 ' A' ' 81' ' ' LEU 0.27 32.5 t -83.56 155.71 23.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 124.676 2.179 . . . . 0.0 110.957 167.444 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.9 m -92.89 130.1 38.59 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.935 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.474 ' CE2' HG12 ' A' ' 29' ' ' ILE . 5.0 p90 -113.41 152.73 29.66 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 129.09 2.956 . . . . 0.0 105.704 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -101.5 161.35 13.7 Favored 'General case' 0 C--N 1.354 0.795 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -121.41 120.3 34.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.146 -1.596 . . . . 0.0 111.281 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.55 141.46 51.36 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.566 ' CZ ' HD11 ' A' ' 50' ' ' LEU . 4.3 m-85 -101.48 150.16 23.33 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.892 1.277 . . . . 0.0 108.871 172.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.4 m -123.06 85.78 2.48 Favored 'General case' 0 C--N 1.349 0.587 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 165.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.446 ' HG3' HH21 ' A' ' 15' ' ' ARG . 4.7 mm-40 -48.24 -10.9 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 121.217 3.784 . . . . 0.0 121.217 -168.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.68 -37.55 79.09 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 125.948 3.976 . . . . 0.0 116.166 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -68.28 -43.38 77.86 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-O 125.968 2.794 . . . . 0.0 111.132 171.458 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.566 HD11 ' CZ ' ' A' ' 45' ' ' TYR . 2.7 tt -64.11 -38.72 92.07 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 118.62 -2.55 . . . . 0.0 109.533 176.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -60.43 -32.46 71.38 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 129.621 3.168 . . . . 0.0 109.585 171.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 78.0 mtm180 -63.02 -47.12 84.42 Favored 'General case' 0 C--N 1.391 2.383 0 O-C-N 120.357 -1.464 . . . . 0.0 113.625 161.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -28.59 68.47 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.336 0.1 OUTLIER -70.3 -39.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 131.698 3.999 . . . . 0.0 111.179 179.299 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -107.39 -26.48 10.96 Favored 'General case' 0 C--N 1.372 1.559 0 N-CA-C 117.24 2.311 . . . . 0.0 117.24 170.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -83.5 -18.6 37.92 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.801 2.091 . . . . 0.0 113.933 -175.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -115.21 -67.68 0.98 Allowed 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 127.528 2.331 . . . . 0.0 109.085 166.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.487 0.3 OUTLIER 74.91 135.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.429 -1.419 . . . . 0.0 111.121 -173.477 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.5 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 21.6 t70 44.88 45.19 8.4 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 130.922 3.689 . . . . 0.0 114.77 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.411 ' HB2' ' HB ' ' A' ' 63' ' ' VAL 0.399 10.4 pt-20 -74.33 62.26 0.95 Allowed 'General case' 0 CA--C 1.491 -1.308 0 C-N-CA 129.632 3.173 . . . . 0.0 114.436 179.43 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.39 14.0 p -79.0 -20.94 47.82 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.862 2.865 . . . . 0.0 113.18 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -64.21 -33.35 75.61 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.726 2.01 . . . . 0.0 111.151 166.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.438 HG12 ' CZ ' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -57.62 -46.48 86.42 Favored 'Isoleucine or valine' 0 C--N 1.37 1.466 0 C-N-CA 128.846 2.858 . . . . 0.0 109.392 -175.674 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.526 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 45.9 m-85 -61.68 -45.39 94.19 Favored 'General case' 0 CA--C 1.495 -1.171 1 C-N-CA 134.184 4.994 . . . . 0.0 112.65 169.527 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -66.12 -44.62 83.76 Favored 'General case' 0 C--N 1.35 0.597 0 CA-C-N 122.001 2.182 . . . . 0.0 114.503 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.432 ' CD1' HD13 ' A' ' 113' ' ' LEU . 1.4 tm? -63.09 -50.46 70.45 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.36 1.864 . . . . 0.0 114.177 166.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.438 ' CZ ' HG12 ' A' ' 63' ' ' VAL 0.742 0.0 OUTLIER -76.7 -29.15 56.16 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 118.979 -2.326 . . . . 0.0 111.59 -175.829 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.569 ' CE1' HG12 ' A' ' 25' ' ' ILE . 63.7 m-70 -64.17 -28.17 69.57 Favored 'General case' 0 C--N 1.367 1.353 0 C-N-CA 125.489 1.515 . . . . 0.0 112.147 162.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -77.27 -26.66 52.67 Favored 'General case' 0 C--N 1.377 1.786 0 O-C-N 121.214 -0.929 . . . . 0.0 112.017 171.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.322 0.0 OUTLIER -88.13 -44.29 15.68 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 C-N-CA 126.353 1.861 . . . . 0.0 115.054 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.553 9.1 mmpt? -49.02 0.21 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 1 C-N-CA 137.194 6.197 . . . . 0.0 120.365 -178.129 . . . . . . . . 3 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.455 ' C ' ' H ' ' A' ' 74' ' ' VAL . 37.1 t70 -64.62 -24.04 67.46 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 131.033 3.733 . . . . 0.0 107.859 157.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -42.07 1.55 0.0 OUTLIER 'General case' 0 C--N 1.389 2.315 1 C-N-CA 139.394 7.078 . . . . 0.0 119.207 176.659 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.455 ' H ' ' C ' ' A' ' 72' ' ' ASP . 46.2 t -50.03 -49.22 22.21 Favored 'Isoleucine or valine' 0 CA--C 1.461 -2.463 1 C-N-CA 135.864 5.666 . . . . 0.0 107.382 170.486 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -58.88 -29.26 66.88 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 117.468 2.395 . . . . 0.0 117.468 176.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -75.19 -50.84 14.96 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 127.523 2.329 . . . . 0.0 112.634 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.372 14.6 p -66.93 -29.55 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.043 0 C-N-CA 127.631 2.373 . . . . 0.0 111.545 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -75.11 -32.75 61.49 Favored 'General case' 0 C--N 1.365 1.255 1 C-N-CA 132.322 4.249 . . . . 0.0 112.826 169.135 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . 0.356 6.7 pt-20 -67.74 -29.81 69.13 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 122.407 2.367 . . . . 0.0 110.034 169.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -66.47 -47.66 72.37 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 163.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' A' ' 39' ' ' SER 0.381 15.9 tp . . . . . 0 C--N 1.373 1.595 0 C-N-CA 130.011 3.325 . . . . 0.0 119.762 176.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.899 0 N-CA-C 118.164 2.026 . . . . 0.0 118.164 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.2 ptt-85 -141.06 152.54 44.91 Favored 'General case' 0 N--CA 1.44 -0.974 0 O-C-N 121.067 -1.255 . . . . 0.0 109.024 177.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -109.24 125.84 52.68 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 126.37 1.868 . . . . 0.0 107.223 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -128.51 109.4 11.35 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.7 pt -135.97 140.59 43.76 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 C-N-CA 125.235 1.414 . . . . 0.0 112.61 -174.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.7 m -111.57 121.85 46.24 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 119.871 -1.768 . . . . 0.0 108.73 173.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.441 ' HB2' HG23 ' A' ' 150' ' ' ILE . 42.1 t0 -139.19 171.77 13.8 Favored 'General case' 0 CA--C 1.504 -0.826 1 N-CA-C 100.093 -4.04 . . . . 0.0 100.093 177.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.452 ' HA3' HD23 ' A' ' 111' ' ' LEU . . . 78.75 -68.37 3.03 Favored Glycine 0 N--CA 1.475 1.288 0 O-C-N 118.033 -2.917 . . . . 0.0 113.378 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.481 HD22 HD11 ' A' ' 141' ' ' LEU . 0.1 OUTLIER 156.01 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.366 1.294 2 C-N-CA 134.324 5.05 . . . . 0.0 109.474 -152.609 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.452 HD23 ' HA3' ' A' ' 109' ' ' GLY 0.476 1.1 pt? -78.22 137.4 38.11 Favored 'General case' 0 CA--C 1.507 -0.706 1 C-N-CA 134.978 5.311 . . . . 0.0 119.813 -177.543 . . . . . . . . 4 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.34 100.66 13.42 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.432 HD13 ' CD1' ' A' ' 66' ' ' LEU 0.314 0.0 OUTLIER -94.84 127.78 41.1 Favored 'General case' 0 C--N 1.38 1.907 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 176.191 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -125.16 130.43 7.34 Favored Glycine 0 C--N 1.352 1.464 0 N-CA-C 106.138 -2.785 . . . . 0.0 106.138 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -131.95 137.17 47.83 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.469 2.634 . . . . 0.0 105.671 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.0 m -124.99 102.05 7.34 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.841 1.655 . . . . 0.0 106.808 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.08 116.35 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 121.328 1.876 . . . . 0.0 107.276 172.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.404 ' HB2' HD22 ' A' ' 121' ' ' ASN . 1.6 m 3.66 104.58 0.0 OUTLIER 'General case' 0 C--N 1.38 1.921 0 C-N-CA 130.937 3.695 . . . . 0.0 117.677 -160.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.55 ' H ' ' HB2' ' A' ' 130' ' ' GLN . 34.4 ttpt -34.31 -44.25 0.56 Allowed Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 118.474 2.768 . . . . 0.0 118.474 -178.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -98.13 18.7 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.288 0 C-N-CA 123.47 2.78 . . . . 0.0 114.305 172.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.404 HD22 ' HB2' ' A' ' 118' ' ' CYS 0.461 0.6 OUTLIER -161.53 108.05 1.38 Allowed 'General case' 0 CA--C 1.562 1.417 0 N-CA-C 118.899 2.926 . . . . 0.0 118.899 -178.988 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -99.3 -45.05 6.0 Favored 'General case' 0 C--N 1.351 0.671 0 O-C-N 118.67 -2.519 . . . . 0.0 115.193 170.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.411 0.0 OUTLIER -40.2 -14.74 0.01 OUTLIER 'General case' 0 C--N 1.353 0.726 1 C-N-CA 136.278 5.831 . . . . 0.0 120.754 -172.347 . . . . . . . . 4 3 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -110.46 -6.07 15.01 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.773 2.029 . . . . 0.0 113.073 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' A' ' 81' ' ' LEU 0.416 0.0 OUTLIER 64.65 -51.71 0.31 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 128.379 2.672 . . . . 0.0 117.567 176.341 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.283 2.5 p30 -64.03 -15.97 0.33 Allowed Pre-proline 0 CA--C 1.551 1.004 1 C-N-CA 132.08 4.152 . . . . 0.0 119.562 173.386 . . . . . . . . 3 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.358 39.7 Cg_exo -37.78 -176.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.486 1 C-N-CA 128.771 6.314 . . . . 0.0 121.008 166.464 . . . . . . . . 3 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.0 m -99.61 164.3 12.13 Favored 'General case' 0 CA--C 1.486 -1.518 0 N-CA-C 104.113 -2.551 . . . . 0.0 104.113 -173.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.3 mp -100.12 129.04 46.11 Favored 'General case' 0 C--N 1.348 0.505 0 N-CA-C 100.208 -3.997 . . . . 0.0 100.208 176.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . 0.55 ' HB2' ' H ' ' A' ' 119' ' ' LYS . 0.6 OUTLIER -93.19 60.21 3.18 Favored 'General case' 0 C--N 1.364 1.198 0 C-N-CA 126.258 1.823 . . . . 0.0 107.635 -171.038 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.304 1.9 p 102.8 138.27 0.01 OUTLIER 'General case' 0 C--N 1.373 1.593 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 -171.113 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -114.87 133.69 55.76 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 100.796 -3.779 . . . . 0.0 100.796 163.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 7.7 ttp -109.29 120.36 42.27 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 127.263 2.225 . . . . 0.0 105.446 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -127.71 116.16 19.83 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.0 mm -139.8 138.44 38.66 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 CA-C-N 119.341 0.973 . . . . 0.0 109.495 178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -127.68 169.03 19.74 Favored 'Isoleucine or valine' 0 C--N 1.349 0.583 0 C-N-CA 128.164 2.586 . . . . 0.0 108.022 178.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -100.33 123.64 44.81 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.13 2.972 . . . . 0.0 114.398 -176.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' SER . . . . . 0.449 ' HB2' ' HD2' ' A' ' 139' ' ' ARG 0.261 2.5 p 171.86 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 123.934 1.825 . . . . 0.0 115.424 175.655 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.449 ' HD2' ' HB2' ' A' ' 138' ' ' SER . 0.7 OUTLIER 178.0 -50.32 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 109.628 -3.442 . . . . 0.0 107.871 -155.536 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 175.74 73.81 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.564 0 CA-C-O 126.005 2.812 . . . . 0.0 104.081 -170.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.481 HD11 HD22 ' A' ' 110' ' ' ASN 0.285 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.599 0 N-CA-C 117.764 2.505 . . . . 0.0 117.764 -162.62 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.441 HG23 ' HB2' ' A' ' 108' ' ' ASP 0.506 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.391 0 CA-C-O 126.722 3.153 . . . . 0.0 116.488 . . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.334 5.6 ptpt -78.02 149.6 33.99 Favored 'General case' 0 N--CA 1.423 -1.802 2 C-N-CA 138.292 6.637 . . . . 0.0 113.584 177.24 . . . . . . . . 3 2 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 20.2 p -96.33 97.73 9.72 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 118.314 -2.741 . . . . 0.0 107.809 169.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.257 1.472 1 C-N-CA 135.319 5.448 . . . . 0.0 109.155 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.427 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 14.1 m120 . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 122.32 1.057 . . . . 0.0 113.414 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -81.86 -62.56 1.6 Allowed 'General case' 0 C--N 1.348 0.516 1 C-N-CA 133.714 4.806 . . . . 0.0 110.3 176.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -71.29 -9.23 57.79 Favored 'General case' 0 C--N 1.368 1.387 0 C-N-CA 125.585 1.554 . . . . 0.0 112.279 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.427 ' CG1' ' HA ' ' A' ' 4' ' ' ASN 0.286 0.7 OUTLIER -88.41 -28.45 5.38 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 C-N-CA 126.877 2.071 . . . . 0.0 108.969 174.368 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -72.86 -38.96 66.87 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 125.7 1.6 . . . . 0.0 108.688 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 28.8 mt -61.68 -44.52 98.85 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 C-N-CA 125.051 1.34 . . . . 0.0 110.636 165.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.314 0.6 OUTLIER -58.85 -48.91 79.7 Favored 'General case' 0 C--N 1.367 1.336 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 173.301 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -57.74 -34.11 69.17 Favored 'General case' 0 C--N 1.374 1.636 0 N-CA-C 118.835 2.902 . . . . 0.0 118.835 166.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -77.08 -49.28 15.66 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 128.141 2.576 . . . . 0.0 111.917 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -58.18 -29.28 65.51 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 130.04 3.336 . . . . 0.0 109.375 170.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -76.14 -37.56 57.84 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 169.832 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -58.45 -44.19 89.1 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.767 1.227 . . . . 0.0 111.419 166.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -62.85 -45.14 93.98 Favored 'General case' 0 C--N 1.382 2.019 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 166.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.409 ' CD2' HG22 ' A' ' 61' ' ' THR . 0.6 OUTLIER -56.92 -42.92 80.85 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 129.542 3.137 . . . . 0.0 112.207 174.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.01 -54.41 26.34 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 128.509 2.724 . . . . 0.0 113.114 177.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -74.67 -36.03 62.81 Favored 'General case' 0 C--N 1.367 1.361 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.5 m -72.78 -40.81 65.63 Favored 'General case' 0 C--N 1.365 1.256 0 C-N-CA 125.958 1.703 . . . . 0.0 111.946 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.503 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.545 52.0 mt-10 -77.77 -29.92 51.19 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 119.982 -1.699 . . . . 0.0 114.066 169.519 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -59.32 -36.95 76.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 118.284 -2.76 . . . . 0.0 112.665 168.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.251 7.4 ptm180 -71.22 -33.35 69.8 Favored 'General case' 0 C--N 1.376 1.756 0 C-N-CA 124.031 0.933 . . . . 0.0 112.368 168.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -61.91 -48.22 81.41 Favored 'General case' 0 C--N 1.362 1.134 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 170.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.488 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.1 mt -72.33 -46.42 57.02 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 O-C-N 121.333 -0.855 . . . . 0.0 110.975 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.567 0.0 OUTLIER -74.23 -23.5 59.17 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 119.761 -1.837 . . . . 0.0 114.29 177.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -72.83 -32.78 65.73 Favored 'General case' 0 C--N 1.388 2.24 0 O-C-N 120.213 -1.554 . . . . 0.0 110.515 168.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.52 -40.73 85.1 Favored 'General case' 0 C--N 1.389 2.307 0 O-C-N 118.509 -2.619 . . . . 0.0 112.407 168.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.452 ' HB ' ' CZ ' ' A' ' 41' ' ' PHE 0.395 0.1 OUTLIER -64.77 -44.63 96.43 Favored 'Isoleucine or valine' 0 C--N 1.369 1.422 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 176.461 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -67.97 -38.84 83.23 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -76.51 -35.91 58.06 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 125.325 1.45 . . . . 0.0 111.463 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.8 -33.74 60.15 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 176.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.3 t -73.77 -37.3 65.04 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 125.512 1.525 . . . . 0.0 109.852 175.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp -68.66 -44.65 73.65 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 168.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.25 -30.47 64.91 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.094 1.758 . . . . 0.0 113.543 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.03 -17.53 60.49 Favored 'General case' 0 C--N 1.383 2.022 0 CA-C-N 119.307 0.958 . . . . 0.0 113.197 169.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.37 18.31 28.9 Favored Glycine 0 C--N 1.374 2.693 0 O-C-N 121.179 -0.95 . . . . 0.0 114.775 174.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.411 HG23 ' CD2' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -111.48 171.59 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 t -59.06 177.84 0.15 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 129.398 3.079 . . . . 0.0 115.979 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.6 m -96.86 126.39 41.97 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 125.689 1.596 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.452 ' CZ ' ' HB ' ' A' ' 29' ' ' ILE 0.286 41.8 p90 -113.6 141.02 47.69 Favored 'General case' 0 C--N 1.357 0.921 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 174.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -116.14 164.9 13.79 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 123.42 1.581 . . . . 0.0 113.326 -172.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -121.18 133.96 55.2 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.361 1.864 . . . . 0.0 113.872 -174.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -139.44 162.04 36.02 Favored 'General case' 0 C--N 1.37 1.496 0 N-CA-C 105.026 -2.212 . . . . 0.0 105.026 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.287 9.8 m-85 -125.31 161.34 27.19 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 126.688 1.995 . . . . 0.0 113.589 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.1 m -132.66 89.83 2.69 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 103.334 -2.839 . . . . 0.0 103.334 159.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' A' ' 51' ' ' ASP . 11.1 mp0 -47.45 -10.25 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 131.658 3.983 . . . . 0.0 118.354 -175.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.47 -37.12 56.39 Favored 'General case' 0 N--CA 1.503 2.212 1 CA-C-N 128.417 5.099 . . . . 0.0 119.201 -176.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.501 ' H ' ' HG ' ' A' ' 49' ' ' LEU . 0.4 OUTLIER -69.6 -41.37 75.82 Favored 'General case' 0 C--O 1.242 0.7 1 C-N-CA 134.415 5.086 . . . . 0.0 110.82 173.798 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.282 4.2 tt -74.8 -28.99 60.95 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 127.343 2.257 . . . . 0.0 110.707 171.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 47' ' ' GLN . 10.1 t70 -68.05 -31.95 71.96 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 130.323 3.449 . . . . 0.0 108.165 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -70.99 -40.79 71.66 Favored 'General case' 0 C--N 1.373 1.594 0 O-C-N 119.874 -1.766 . . . . 0.0 114.984 160.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.22 62.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.407 ' CG2' ' HA ' ' A' ' 51' ' ' ASP . 2.7 tt -72.89 -35.9 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 1 C-N-CA 132.064 4.146 . . . . 0.0 110.828 178.292 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -108.63 -30.14 8.37 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 119.155 3.02 . . . . 0.0 119.155 171.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -88.91 -5.24 58.13 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 119.701 -1.875 . . . . 0.0 114.067 -172.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -137.73 -64.58 0.54 Allowed 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 -178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 54' ' ' ILE 0.697 0.0 OUTLIER 119.55 -28.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.374 1.659 0 N-CA-C 121.768 3.988 . . . . 0.0 121.768 167.37 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.539 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 31.1 t70 -147.37 80.34 1.51 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 130.735 3.614 . . . . 0.0 105.992 -170.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' HB2' ' HB ' ' A' ' 63' ' ' VAL 0.54 12.5 pt-20 -79.77 59.1 3.0 Favored 'General case' 0 C--N 1.38 1.922 0 O-C-N 118.883 -2.386 . . . . 0.0 112.301 177.216 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.409 HG22 ' CD2' ' A' ' 17' ' ' HIS 0.369 36.0 p -79.56 -21.66 44.81 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 129.816 3.247 . . . . 0.0 113.955 177.238 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.402 ' HH ' ' HB2' ' A' ' 110' ' ' ASN . 78.9 t80 -67.45 -30.24 69.92 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 130.643 3.577 . . . . 0.0 111.132 167.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.457 HG11 ' CZ ' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -64.9 -44.68 96.17 Favored 'Isoleucine or valine' 0 C--N 1.367 1.328 0 C-N-CA 126.078 1.751 . . . . 0.0 110.579 178.773 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 59.5 m-85 -58.88 -43.33 90.91 Favored 'General case' 0 C--O 1.204 -1.293 1 C-N-CA 133.727 4.811 . . . . 0.0 111.542 170.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -67.57 -45.6 75.11 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 121.786 2.084 . . . . 0.0 115.954 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.458 ' CD2' ' HA3' ' A' ' 109' ' ' GLY . 2.8 tm? -62.19 -49.21 76.72 Favored 'General case' 0 CA--C 1.57 1.738 0 O-C-N 119.198 -2.189 . . . . 0.0 112.315 169.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.475 ' HA ' ' CG1' ' A' ' 70' ' ' ILE 0.859 0.0 OUTLIER -77.49 -16.28 58.82 Favored 'General case' 0 C--N 1.379 1.869 0 O-C-N 118.923 -2.361 . . . . 0.0 115.078 -178.657 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.488 ' CE1' HG12 ' A' ' 25' ' ' ILE 0.295 58.2 m-70 -75.65 -23.13 56.28 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.437 2.295 . . . . 0.0 109.896 163.331 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.44 71.6 mmtt -75.47 -40.19 57.67 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 114.767 -2.773 . . . . 0.0 114.28 153.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.475 ' CG1' ' HA ' ' A' ' 67' ' ' PHE . 16.1 mm -53.63 -25.87 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 C-N-CA 129.643 3.177 . . . . 0.0 115.126 175.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -52.91 -26.1 13.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 C-N-CA 131.056 3.742 . . . . 0.0 118.209 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -101.3 2.89 40.22 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 125.282 1.433 . . . . 0.0 107.551 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.417 ' CE1' ' HB2' ' A' ' 151' ' ' LYS 0.279 94.3 m-70 -86.17 13.22 8.19 Favored 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.622 2.769 . . . . 0.0 112.177 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 78.6 t -39.16 -55.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.576 1 C-N-CA 133.334 4.654 . . . . 0.0 109.55 157.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -58.59 -28.52 65.66 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.546 2.338 . . . . 0.0 115.996 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -75.47 -44.78 42.27 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 125.319 1.448 . . . . 0.0 112.23 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.341 0.3 OUTLIER -67.83 -32.11 55.1 Favored 'Isoleucine or valine' 0 C--N 1.371 1.54 0 CA-C-O 124.338 2.018 . . . . 0.0 112.684 175.56 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -74.98 -39.49 61.25 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 129.883 3.273 . . . . 0.0 114.319 173.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.41 -29.2 70.53 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-N 120.694 1.588 . . . . 0.0 112.191 166.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -70.74 -32.08 69.13 Favored 'General case' 0 CA--C 1.58 2.098 0 C-N-CA 126.046 1.739 . . . . 0.0 114.485 167.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.411 ' CD2' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.566 0 C-N-CA 128.814 2.846 . . . . 0.0 112.239 169.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.093 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -128.87 159.56 35.41 Favored 'General case' 0 CA--C 1.501 -0.91 0 CA-C-O 123.931 1.824 . . . . 0.0 113.265 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.5 128.8 53.77 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.311 2.645 . . . . 0.0 104.647 174.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -129.78 131.86 46.36 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 103.526 -2.768 . . . . 0.0 103.526 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.8 mt -131.54 133.37 61.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.886 0 C-N-CA 126.487 1.915 . . . . 0.0 108.266 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.6 m -134.1 115.51 14.35 Favored 'General case' 0 C--N 1.353 0.743 0 O-C-N 120.72 -1.237 . . . . 0.0 110.615 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.409 ' HB2' HG13 ' A' ' 150' ' ' ILE . 0.4 OUTLIER 176.14 -173.2 0.09 Allowed 'General case' 0 C--N 1.365 1.274 0 N-CA-C 100.217 -3.994 . . . . 0.0 100.217 173.098 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' CD2' ' A' ' 66' ' ' LEU . . . 72.6 9.23 73.77 Favored Glycine 1 CA--C 1.44 -4.597 0 O-C-N 118.285 -2.759 . . . . 0.0 117.29 175.375 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.402 ' HB2' ' HH ' ' A' ' 62' ' ' TYR . 1.5 m-80 70.61 9.24 6.84 Favored 'General case' 0 C--N 1.377 1.781 0 C-N-CA 128.624 2.77 . . . . 0.0 110.876 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.56 130.33 54.16 Favored 'General case' 0 N--CA 1.44 -0.946 1 C-N-CA 134.45 5.1 . . . . 0.0 114.601 -164.587 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -112.51 100.15 8.52 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 101.065 -3.68 . . . . 0.0 101.065 174.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.296 1.3 pt? -107.51 138.59 43.45 Favored 'General case' 0 C--N 1.368 1.381 0 O-C-N 120.554 -1.341 . . . . 0.0 109.894 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.76 142.35 13.44 Favored Glycine 0 C--N 1.355 1.616 0 N-CA-C 107.452 -2.259 . . . . 0.0 107.452 172.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.45 132.36 44.23 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 104.636 -2.357 . . . . 0.0 104.636 176.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.4 m -109.97 108.94 19.36 Favored 'General case' 0 C--N 1.367 1.342 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.03 105.31 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 C-N-CA 127.827 2.451 . . . . 0.0 111.663 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 16.7 m 42.83 72.58 0.17 Allowed 'General case' 0 C--N 1.368 1.408 0 C-N-CA 129.831 3.252 . . . . 0.0 115.282 -170.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.363 37.9 ttpt -30.81 -62.04 0.25 Allowed Pre-proline 0 C--N 1.361 1.095 1 C-N-CA 132.275 4.23 . . . . 0.0 118.768 -171.924 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -71.84 66.97 3.17 Favored 'Trans proline' 0 CA--C 1.556 1.621 0 C-N-CA 125.087 3.858 . . . . 0.0 111.039 169.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.345 7.9 m120 -36.53 149.73 0.02 OUTLIER 'General case' 0 C--N 1.363 1.153 2 N-CA-C 125.615 5.413 . . . . 0.0 125.615 -170.012 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -162.65 -46.23 0.04 OUTLIER 'General case' 0 C--N 1.358 0.955 0 C-N-CA 130.91 3.684 . . . . 0.0 113.96 -174.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.353 0.0 OUTLIER 75.54 100.27 0.07 Allowed 'General case' 0 N--CA 1.424 -1.763 1 C-N-CA 133.185 4.594 . . . . 0.0 113.246 -178.833 . . . . . . . . 4 3 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -105.62 16.68 25.01 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 117.86 2.541 . . . . 0.0 117.86 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.409 ' HD3' ' N ' ' A' ' 125' ' ' LYS 0.72 0.0 OUTLIER 19.86 55.11 0.01 OUTLIER 'General case' 0 C--N 1.366 1.289 0 N-CA-C 121.292 3.812 . . . . 0.0 121.292 174.17 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 170.59 46.42 0.0 OUTLIER Pre-proline 0 CA--C 1.568 1.667 1 C-N-CA 140.319 7.448 . . . . 0.0 105.785 -172.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -92.56 -179.25 1.03 Allowed 'Trans proline' 0 C--N 1.361 1.205 0 CA-C-N 127.349 3.66 . . . . 0.0 118.951 -158.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 12.1 p -124.62 150.08 46.39 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.675 -2.342 . . . . 0.0 104.675 174.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 mp -101.82 130.34 48.24 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 102.174 -3.269 . . . . 0.0 102.174 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -114.62 45.72 1.51 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 119.949 -1.72 . . . . 0.0 109.364 -170.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 45.4 t 141.81 126.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.522 0 C-N-CA 128.201 2.6 . . . . 0.0 105.194 -170.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -115.36 111.47 20.9 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 102.583 -3.117 . . . . 0.0 102.583 165.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 4.5 ttt -99.43 121.22 40.83 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.03 3.332 . . . . 0.0 108.505 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . 0.425 ' HB3' HG23 ' A' ' 63' ' ' VAL . . . -128.69 116.44 19.55 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.56 1.544 . . . . 0.0 109.174 178.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.5 mm -136.03 128.29 45.59 Favored 'Isoleucine or valine' 0 C--N 1.365 1.252 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 176.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.442 ' H ' ' HG ' ' A' ' 141' ' ' LEU . 0.0 OUTLIER -103.88 171.39 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 C-N-CA 127.723 2.409 . . . . 0.0 108.61 -179.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.72 -178.78 5.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.148 1.779 . . . . 0.0 106.398 163.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.744 52.6 p -65.24 75.8 0.06 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 117.644 2.461 . . . . 0.0 117.644 175.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ARG . . . . . 0.525 ' HD2' ' H ' ' A' ' 141' ' ' LEU . 0.0 OUTLIER -71.83 -21.49 61.68 Favored 'General case' 0 C--N 1.377 1.772 0 CA-C-N 110.989 -2.823 . . . . 0.0 106.614 148.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . 0.402 70.6 mtt85 165.8 -45.86 0.0 OUTLIER 'General case' 0 CA--C 1.473 -2.009 1 C-N-CA 144.85 9.26 . . . . 0.0 114.218 -179.217 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' LEU . . . . . 0.525 ' H ' ' HD2' ' A' ' 139' ' ' ARG 0.262 0.1 OUTLIER . . . . . 0 CA--C 1.55 0.946 0 C-N-CA 129.298 3.039 . . . . 0.0 117.513 -175.756 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 153' ' ' GLN 0.396 0.1 OUTLIER . . . . . 0 CA--C 1.568 1.646 1 N-CA-C 122.548 4.277 . . . . 0.0 122.548 . . . . . . . . . 4 3 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' LYS . . . . . 0.489 ' H ' ' CD ' ' A' ' 151' ' ' LYS . 0.0 OUTLIER -94.16 149.55 21.13 Favored 'General case' 0 CA--C 1.48 -1.744 2 C-N-CA 146.004 9.722 . . . . 0.0 97.652 167.87 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 152' ' ' THR 0.322 11.3 t -76.1 96.14 3.78 Favored 'General case' 0 CA--C 1.575 1.93 3 CA-C-O 130.563 4.982 . . . . 0.0 122.666 -162.49 . . . . . . . . 4 3 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' GLN . . . . . 0.421 ' HA ' HD13 ' A' ' 150' ' ' ILE 0.481 0.0 OUTLIER . . . . . 0 N--CA 1.381 -3.913 2 C-N-CA 136.099 5.759 . . . . 0.0 117.524 166.591 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.7 mmm . . . . . 0 C--O 1.231 0.129 0 CA-C-O 123.04 1.4 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.7 m -168.83 165.83 11.61 Favored 'General case' 0 C--N 1.357 0.924 0 N-CA-C 101.343 -3.577 . . . . 0.0 101.343 -173.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 mm -80.89 54.51 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.365 1.263 0 C-N-CA 128.651 2.78 . . . . 0.0 112.468 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.436 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 2.3 t-20 -44.67 -15.85 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 1 C-N-CA 136.564 5.946 . . . . 0.0 117.743 -176.813 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -58.76 6.66 Favored 'General case' 0 N--CA 1.445 -0.715 1 C-N-CA 132.95 4.5 . . . . 0.0 112.274 169.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.84 -25.87 62.14 Favored 'General case' 0 C--N 1.37 1.469 0 C-N-CA 126.907 2.083 . . . . 0.0 113.065 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.436 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.9 OUTLIER -77.01 -39.52 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.947 0 C-N-CA 129.721 3.208 . . . . 0.0 112.551 176.698 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.41 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 27.3 t80 -65.36 -45.05 85.69 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 129.039 2.935 . . . . 0.0 109.611 175.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.3 -43.73 86.72 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 126.625 1.97 . . . . 0.0 110.99 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' HE ' HD12 ' A' ' 58' ' ' ILE 0.257 9.2 ttp-105 -66.34 -47.32 73.84 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.8 mtm180 -61.17 -27.63 68.55 Favored 'General case' 0 C--N 1.377 1.762 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 167.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -77.12 -48.75 16.89 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 128.691 2.796 . . . . 0.0 110.139 173.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.526 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 27.6 mmtt -57.8 -28.44 64.02 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 127.529 2.331 . . . . 0.0 110.573 169.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.501 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.3 OUTLIER -66.68 -49.07 67.31 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.519 166.271 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 39.2 ttt85 -55.81 -34.68 65.55 Favored 'General case' 0 C--N 1.353 0.742 0 CA-C-N 121.15 1.795 . . . . 0.0 115.21 169.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.526 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.289 0.1 OUTLIER -73.7 -37.04 65.31 Favored 'General case' 0 C--N 1.386 2.17 0 O-C-N 120.065 -1.647 . . . . 0.0 113.812 170.088 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.13 -44.27 97.59 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 129.063 2.945 . . . . 0.0 111.041 172.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.429 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -61.17 -52.59 64.18 Favored 'General case' 0 C--N 1.371 1.508 1 C-N-CA 132.003 4.121 . . . . 0.0 110.315 175.598 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -74.56 -39.53 62.22 Favored 'General case' 0 C--N 1.373 1.608 0 N-CA-C 118.218 2.673 . . . . 0.0 118.218 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.411 ' HA ' ' HG3' ' A' ' 23' ' ' ARG . 7.4 t -73.16 -40.52 64.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.024 1.73 . . . . 0.0 112.18 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.307 4.1 mp0 -75.95 -28.92 58.12 Favored 'General case' 0 C--N 1.355 0.812 0 O-C-N 118.637 -2.539 . . . . 0.0 110.41 171.961 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.339 0.3 OUTLIER -65.18 -31.21 72.27 Favored 'General case' 0 C--N 1.384 2.077 0 O-C-N 119.824 -1.797 . . . . 0.0 113.688 166.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.411 ' HG3' ' HA ' ' A' ' 20' ' ' SER 0.394 0.0 OUTLIER -66.36 -35.49 80.49 Favored 'General case' 0 C--N 1.382 2.02 0 CA-C-N 119.033 0.833 . . . . 0.0 111.8 166.604 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.506 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 47.2 tt0 -62.55 -45.02 94.85 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 169.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.491 HG12 ' CE1' ' A' ' 68' ' ' HIS . 3.1 mt -69.77 -43.48 79.88 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 O-C-N 120.617 -1.302 . . . . 0.0 113.06 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER -70.34 -26.49 63.77 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 119.379 0.991 . . . . 0.0 113.004 176.205 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -69.41 -39.78 77.72 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 121.109 -0.994 . . . . 0.0 110.166 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HA ' ' HG2' ' A' ' 31' ' ' GLU 0.492 0.0 OUTLIER -67.07 -35.01 78.9 Favored 'General case' 0 C--N 1.403 2.911 0 CA-C-N 120.405 1.457 . . . . 0.0 113.21 168.575 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.422 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.7 mt -61.92 -44.73 99.29 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 120.797 1.635 . . . . 0.0 114.702 174.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -59.96 -47.31 86.31 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 172.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.429 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.1 pt-20 -77.34 -37.45 52.41 Favored 'General case' 0 C--N 1.372 1.553 0 C-N-CA 125.165 1.386 . . . . 0.0 114.265 -176.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.35 -34.01 36.87 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-O 121.638 0.732 . . . . 0.0 112.409 -178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.6 t -71.35 -36.15 71.41 Favored 'General case' 0 C--N 1.365 1.245 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 42.2 mmtt -64.14 -42.42 96.8 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 167.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.38 -32.11 66.14 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 126.881 2.073 . . . . 0.0 113.936 176.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.32 -19.36 58.3 Favored 'General case' 0 C--N 1.375 1.692 0 C-N-CA 125.382 1.473 . . . . 0.0 111.94 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.03 17.7 31.5 Favored Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.272 0.869 . . . . 0.0 115.272 171.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.413 HG21 HD12 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -123.76 147.18 28.24 Favored 'Isoleucine or valine' 0 C--N 1.358 0.974 0 CA-C-O 123.544 1.64 . . . . 0.0 108.998 -178.249 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.277 10.0 t 5.8 -79.88 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.302 1 C-N-CA 132.715 4.406 . . . . 0.0 119.736 -173.777 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.0 m 121.71 124.27 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.689 2 N-CA-C 98.863 -4.495 . . . . 0.0 98.863 -169.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.422 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 10.7 p90 -113.24 142.54 45.69 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -100.7 126.63 47.24 Favored 'General case' 0 C--N 1.361 1.103 0 C-N-CA 125.758 1.623 . . . . 0.0 108.039 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.78 128.29 42.53 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.838 -173.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -139.34 143.97 38.03 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 101.994 -3.335 . . . . 0.0 101.994 177.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.497 ' CD1' HD11 ' A' ' 50' ' ' LEU . 2.4 p90 -131.09 154.39 48.33 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.61 118.79 28.51 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 127.26 2.224 . . . . 0.0 107.585 173.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.476 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.502 0.0 OUTLIER -68.39 -10.32 54.33 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 129.224 3.01 . . . . 0.0 116.936 -174.404 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.64 -41.29 27.3 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 128.09 2.556 . . . . 0.0 111.489 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.46 ' CD1' ' HA ' ' A' ' 133' ' ' MET . 0.1 OUTLIER -59.42 -47.7 84.45 Favored 'General case' 0 C--N 1.375 1.675 0 CA-C-O 127.738 3.637 . . . . 0.0 109.102 170.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.497 HD11 ' CD1' ' A' ' 45' ' ' TYR 0.279 7.0 tt -74.11 -31.58 62.84 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-N 110.567 -3.015 . . . . 0.0 111.116 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -62.34 -34.33 76.44 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 125.821 1.648 . . . . 0.0 109.537 170.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -62.63 -47.86 81.91 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.53 -1.356 . . . . 0.0 113.232 167.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.48 -27.26 65.99 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 117.885 2.55 . . . . 0.0 117.885 171.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.302 0.1 OUTLIER -73.68 -42.93 54.87 Favored 'Isoleucine or valine' 0 C--N 1.347 0.496 0 C-N-CA 129.52 3.128 . . . . 0.0 110.884 178.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -103.2 -26.83 12.84 Favored 'General case' 0 C--N 1.38 1.912 0 N-CA-C 117.079 2.251 . . . . 0.0 117.079 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -87.44 -29.14 21.66 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 119.456 -2.028 . . . . 0.0 111.426 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -124.97 44.05 2.88 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 128.392 2.677 . . . . 0.0 107.491 -172.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.427 HD12 ' HE ' ' A' ' 10' ' ' ARG 0.393 0.5 OUTLIER -56.19 134.32 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 C-N-CA 125.986 1.714 . . . . 0.0 112.419 -177.331 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.501 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 24.9 t70 57.54 21.21 6.85 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 130.822 3.649 . . . . 0.0 113.202 -173.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.493 ' O ' ' HB ' ' A' ' 63' ' ' VAL 0.463 0.7 OUTLIER -73.97 80.52 1.68 Allowed 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.863 2.865 . . . . 0.0 109.626 170.0 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.3 p -82.06 -26.59 33.56 Favored 'General case' 0 N--CA 1.437 -1.089 2 C-N-CA 141.404 7.882 . . . . 0.0 110.92 162.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.94 -33.32 71.75 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 128.008 2.523 . . . . 0.0 109.582 172.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.493 ' HB ' ' O ' ' A' ' 60' ' ' GLU . 3.2 t -43.18 -57.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.993 1 C-N-CA 132.455 4.302 . . . . 0.0 111.572 165.195 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.439 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 47.8 m-85 -62.5 -36.74 83.5 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 131.452 3.901 . . . . 0.0 113.468 172.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -72.98 -45.29 58.82 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 126.259 1.823 . . . . 0.0 111.607 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.407 HD12 HD11 ' A' ' 70' ' ' ILE . 3.2 tm? -63.19 -38.44 91.17 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.559 1.544 . . . . 0.0 113.268 169.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.494 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.974 0.0 OUTLIER -78.27 -17.48 56.6 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 117.742 2.497 . . . . 0.0 117.742 170.739 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.506 ' CE1' ' HB3' ' A' ' 24' ' ' GLN . 25.4 m-70 -84.51 -19.13 33.74 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 129.014 2.926 . . . . 0.0 109.682 171.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -93.74 -27.34 16.55 Favored 'General case' 0 C--N 1.364 1.223 0 C-N-CA 126.434 1.894 . . . . 0.0 107.895 168.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.541 HD13 ' H ' ' A' ' 152' ' ' THR 0.356 0.9 OUTLIER -74.98 -12.13 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 C-N-CA 129.787 3.235 . . . . 0.0 112.684 178.327 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.313 19.2 ptmt -49.49 -35.32 19.45 Favored 'General case' 0 N--CA 1.428 -1.542 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 -169.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.276 26.6 m-20 -78.77 -15.05 58.9 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 127.448 2.299 . . . . 0.0 108.565 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.792 ' CD2' ' HA ' ' A' ' 152' ' ' THR 0.373 0.0 OUTLIER -66.8 -7.08 18.82 Favored 'General case' 0 C--N 1.379 1.859 0 C-N-CA 129.173 2.989 . . . . 0.0 109.379 167.62 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.0 p -43.57 -38.66 1.18 Allowed 'Isoleucine or valine' 1 C--N 1.428 4.016 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 151.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.74 -36.49 81.13 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 129.941 3.296 . . . . 0.0 115.419 172.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.507 ' HA ' ' HG3' ' A' ' 79' ' ' GLU . 71.1 mm-40 -75.26 -38.82 60.32 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 120.211 -1.555 . . . . 0.0 111.442 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.415 0.1 OUTLIER -71.47 -29.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 CA-C-O 124.472 2.082 . . . . 0.0 112.203 171.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.403 HD21 ' HA ' ' A' ' 78' ' ' ASN . 0.9 OUTLIER -70.01 -46.79 64.37 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 127.706 2.402 . . . . 0.0 116.782 168.407 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.507 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.333 0.8 OUTLIER -66.94 -29.51 69.4 Favored 'General case' 0 C--N 1.371 1.517 0 C-N-CA 127.332 2.253 . . . . 0.0 110.288 176.785 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -60.31 -45.66 92.61 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.02 2.528 . . . . 0.0 112.07 163.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 38' ' ' VAL . 3.3 tt -70.84 -35.17 72.33 Favored 'General case' 0 N--CA 1.502 2.152 0 CA-C-N 122.524 2.42 . . . . 0.0 115.546 168.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.6 m -66.09 3.87 0.78 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 129.325 3.05 . . . . 0.0 118.754 -170.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.54 166.59 42.65 Favored Pre-proline 0 C--N 1.359 1.012 0 C-N-CA 127.524 2.33 . . . . 0.0 113.497 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.99 -178.68 0.43 Allowed 'Trans proline' 0 CA--C 1.56 1.799 1 C-N-CA 125.818 4.346 . . . . 0.0 113.407 174.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -59.92 142.2 98.05 Favored 'Trans proline' 0 C--N 1.362 1.246 1 CA-C-N 128.724 4.152 . . . . 0.0 113.477 -177.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.508 ' HE ' ' HA ' ' A' ' 125' ' ' LYS 0.276 22.0 mmt180 -58.48 -59.99 11.73 Favored Pre-proline 0 C--N 1.376 1.742 0 C-N-CA 126.416 1.887 . . . . 0.0 111.042 -176.31 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.4 139.06 37.17 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 N-CA-C 118.19 2.342 . . . . 0.0 118.19 156.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.11 -11.46 8.45 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 111.402 -2.636 . . . . 0.0 110.244 169.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -165.61 176.09 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.755 1 C-N-CA 137.439 6.296 . . . . 0.0 102.995 -168.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -114.23 -14.69 12.27 Favored 'General case' 0 C--N 1.346 0.433 0 C-N-CA 124.89 1.276 . . . . 0.0 109.334 173.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.74 -49.28 18.67 Favored 'General case' 0 C--N 1.363 1.164 0 N-CA-C 116.593 2.071 . . . . 0.0 116.593 -177.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -119.22 -8.77 10.07 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 126.477 1.911 . . . . 0.0 110.897 -175.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.728 1.1 p90 38.7 -73.92 0.0 OUTLIER 'General case' 0 C--N 1.349 0.558 2 C-N-CA 132.936 4.495 . . . . 0.0 122.279 -174.301 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' A' ' 97' ' ' VAL . 1.8 pt -85.45 86.95 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 CA-C-O 127.747 3.641 . . . . 0.0 113.72 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -96.41 -27.69 14.8 Favored 'General case' 0 C--N 1.312 -1.04 2 CA-C-N 105.41 -5.359 . . . . 0.0 110.174 -177.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.55 -7.84 85.66 Favored Glycine 0 C--N 1.362 1.978 0 C-N-CA 125.786 1.66 . . . . 0.0 112.228 170.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.506 ' HB ' ' HB ' ' A' ' 94' ' ' ILE . 77.9 t -109.68 117.99 55.82 Favored 'Isoleucine or valine' 0 C--N 1.359 1.002 0 CA-C-O 123.862 1.792 . . . . 0.0 107.331 176.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -86.21 36.64 0.69 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 130.269 3.428 . . . . 0.0 113.846 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 8.5 t80 73.19 78.75 0.14 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 130.849 3.659 . . . . 0.0 113.451 -178.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -112.49 156.17 42.68 Favored Pre-proline 0 C--N 1.362 1.112 0 O-C-N 120.214 -1.554 . . . . 0.0 110.492 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -79.48 163.08 24.64 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 124.577 3.518 . . . . 0.0 112.703 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.85 8.21 67.15 Favored Glycine 0 C--N 1.355 1.627 0 C-N-CA 126.056 1.788 . . . . 0.0 117.345 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 ptt85 -140.99 160.04 40.93 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 123.194 1.473 . . . . 0.0 110.163 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.4 131.68 54.84 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 127.375 2.27 . . . . 0.0 104.992 177.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -128.53 116.43 19.65 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 -174.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.558 HD11 ' CE1' ' A' ' 73' ' ' HIS . 28.9 mm -122.33 130.15 74.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.009 1.324 . . . . 0.0 109.5 -172.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.657 HG21 ' H ' ' A' ' 149' ' ' VAL 0.436 10.5 t -139.5 150.84 45.61 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 117.088 -3.508 . . . . 0.0 112.396 178.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.475 ' HB2' ' HB2' ' A' ' 151' ' ' LYS . 0.3 OUTLIER 173.76 164.75 0.18 Allowed 'General case' 0 C--N 1.362 1.129 0 N-CA-C 103.459 -2.793 . . . . 0.0 103.459 162.905 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.416 ' O ' ' HB2' ' A' ' 110' ' ' ASN . . . 43.39 45.97 6.75 Favored Glycine 0 CA--C 1.454 -3.751 0 C-N-CA 129.547 3.451 . . . . 0.0 120.097 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 3.4 m-80 88.43 -9.66 0.49 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 130.057 3.343 . . . . 0.0 114.292 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 63' ' ' VAL . 18.2 tp -102.19 133.52 46.91 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 126.87 2.068 . . . . 0.0 114.819 -177.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -111.78 100.07 8.64 Favored 'General case' 0 C--N 1.366 1.307 0 N-CA-C 101.256 -3.609 . . . . 0.0 101.256 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.252 0.0 OUTLIER -115.36 119.85 37.64 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 119.83 -1.793 . . . . 0.0 106.578 -178.765 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -124.49 154.7 18.03 Favored Glycine 0 C--N 1.355 1.602 0 O-C-N 117.299 -3.376 . . . . 0.0 109.226 -174.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -132.44 134.11 44.68 Favored 'General case' 0 C--N 1.368 1.377 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 35.8 m -124.73 135.83 53.34 Favored 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 103.165 -2.902 . . . . 0.0 103.165 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 53.3 t -54.82 159.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 C-N-CA 129.167 2.987 . . . . 0.0 112.158 173.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 130' ' ' GLN 0.335 91.5 m -64.01 98.65 0.22 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 116.918 -1.913 . . . . 0.0 113.183 167.718 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -64.16 -36.67 20.9 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -175.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -85.14 72.71 4.47 Favored 'Trans proline' 0 CA--C 1.56 1.814 0 CA-C-N 126.005 3.18 . . . . 0.0 112.598 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.426 8.7 p30 -163.43 -136.6 0.03 OUTLIER 'General case' 0 C--N 1.377 1.796 0 N-CA-C 116.697 2.11 . . . . 0.0 116.697 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -95.84 -27.2 15.32 Favored 'General case' 0 C--N 1.376 1.732 0 C-N-CA 131.003 3.721 . . . . 0.0 113.919 174.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.452 0.0 OUTLIER 56.72 71.54 0.56 Allowed 'General case' 0 N--CA 1.423 -1.796 1 C-N-CA 134.745 5.218 . . . . 0.0 115.191 -176.243 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.41 ' HB3' ' HG3' ' A' ' 127' ' ' PRO . 1.8 t80 -63.52 52.5 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 130.116 3.367 . . . . 0.0 116.098 -177.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.508 ' HA ' ' HE ' ' A' ' 86' ' ' ARG 0.467 4.7 mptt 82.03 -68.38 0.08 Allowed 'General case' 0 N--CA 1.438 -1.045 1 C-N-CA 131.719 4.007 . . . . 0.0 110.498 176.977 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -172.3 82.6 0.45 Allowed Pre-proline 0 C--N 1.353 0.739 0 CA-C-O 115.779 -2.057 . . . . 0.0 111.314 168.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.41 ' HG3' ' HB3' ' A' ' 124' ' ' PHE . 1.6 Cg_endo -123.85 16.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.369 1.612 0 CA-C-N 127.056 3.556 . . . . 0.0 118.848 177.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.319 4.2 p -147.71 159.2 44.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 111.959 -2.382 . . . . 0.0 109.063 162.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -116.3 140.72 49.03 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 103.405 -2.813 . . . . 0.0 103.405 168.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.442 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 49.9 tp60 -130.41 72.02 1.48 Allowed 'General case' 0 C--N 1.361 1.082 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.437 ' HG ' HD21 ' A' ' 49' ' ' LEU . 49.4 t 128.99 115.73 0.0 OUTLIER 'General case' 0 C--N 1.362 1.13 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 -174.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 8.1 mmm180 -115.81 108.98 17.01 Favored 'General case' 0 N--CA 1.446 -0.672 1 N-CA-C 99.707 -4.183 . . . . 0.0 99.707 164.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.48 ' HE1' HG12 ' A' ' 135' ' ' ILE . 3.4 ttp -92.69 108.91 20.35 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 128.284 2.634 . . . . 0.0 109.15 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -116.9 113.98 23.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . 0.48 HG12 ' HE1' ' A' ' 133' ' ' MET . 47.3 mm -145.16 132.61 15.93 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.08 -175.83 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-O 125.326 2.488 . . . . 0.0 108.882 -174.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.473 ' HA ' HD21 ' A' ' 141' ' ' LEU 0.317 0.4 OUTLIER -134.42 132.41 39.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 108.955 -3.748 . . . . 0.0 106.713 160.772 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.497 ' HB2' ' HB2' ' A' ' 141' ' ' LEU 0.286 25.2 m -145.01 -119.85 0.08 Allowed 'General case' 0 N--CA 1.485 1.288 0 O-C-N 118.615 -2.553 . . . . 0.0 116.942 -174.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.519 ' CD ' ' H ' ' A' ' 140' ' ' ARG . 0.1 OUTLIER -108.57 -75.66 0.63 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 130.879 3.672 . . . . 0.0 110.71 -167.852 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.519 ' H ' ' CD ' ' A' ' 139' ' ' ARG . 14.5 ptp180 -79.66 -9.33 59.62 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 130.704 3.601 . . . . 0.0 111.685 170.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER -77.9 127.43 81.92 Favored Pre-proline 0 N--CA 1.415 -2.179 0 CA-C-N 112.744 -2.026 . . . . 0.0 116.445 -159.067 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -62.14 -0.93 1.97 Allowed 'Trans proline' 0 C--N 1.322 -0.866 1 C-N-CA 126.784 4.989 . . . . 0.0 121.607 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 33.34 110.73 0.0 OUTLIER Glycine 0 N--CA 1.477 1.372 2 C-N-CA 132.97 5.081 . . . . 0.0 125.458 170.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -104.45 152.63 22.1 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.411 1.885 . . . . 0.0 114.155 176.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -144.89 121.78 11.3 Favored 'General case' 0 C--N 1.367 1.341 0 C-N-CA 124.769 1.227 . . . . 0.0 109.32 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 14.5 m -91.02 -8.74 48.23 Favored 'General case' 0 C--N 1.364 1.226 0 N-CA-C 119.823 3.268 . . . . 0.0 119.823 -170.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.373 50.3 mmtm 110.5 -10.79 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 129.795 3.238 . . . . 0.0 110.353 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.45 . . 92.22 134.4 0.03 OUTLIER 'General case' 0 C--N 1.355 0.807 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 166.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.657 ' H ' HG21 ' A' ' 107' ' ' THR . 34.8 m -136.93 -161.33 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.369 1.424 0 C-N-CA 130.351 3.46 . . . . 0.0 110.224 -172.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.419 HD12 ' O ' ' A' ' 151' ' ' LYS 0.409 0.0 OUTLIER -131.92 144.7 36.46 Favored 'Isoleucine or valine' 0 C--N 1.373 1.607 0 N-CA-C 120.82 3.637 . . . . 0.0 120.82 -179.251 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . 0.475 ' HB2' ' HB2' ' A' ' 108' ' ' ASP 0.515 4.5 tptp -71.13 160.79 32.23 Favored 'General case' 0 CA--C 1.461 -2.463 1 C-N-CA 153.109 12.563 . . . . 0.0 103.913 -175.689 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.792 ' HA ' ' CD2' ' A' ' 73' ' ' HIS 0.398 9.8 t -71.44 97.23 1.6 Allowed 'General case' 0 CA--C 1.571 1.766 1 CA-C-O 130.546 4.974 . . . . 0.0 121.11 -173.12 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.406 HE21 ' C ' ' A' ' 153' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.686 2 CA-C-N 100.419 -7.628 . . . . 0.0 112.741 162.567 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 123.778 1.751 . . . . 0.0 113.963 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.3 p -97.73 138.06 35.67 Favored 'General case' 0 C--N 1.351 0.67 0 C-N-CA 130.112 3.365 . . . . 0.0 111.599 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 mm -76.47 48.81 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.371 1.52 0 O-C-N 118.955 -2.34 . . . . 0.0 114.793 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.428 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 5.5 t-20 -62.12 0.42 0.41 Allowed 'General case' 0 N--CA 1.476 0.834 1 C-N-CA 137.044 6.138 . . . . 0.0 115.314 -179.238 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.61 -62.74 1.27 Allowed 'General case' 0 C--N 1.352 0.698 1 C-N-CA 133.866 4.867 . . . . 0.0 112.395 172.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -72.92 -20.04 61.15 Favored 'General case' 0 C--N 1.374 1.668 0 O-C-N 120.146 -1.596 . . . . 0.0 112.847 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.428 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.3 m -76.27 -34.81 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 129.789 3.235 . . . . 0.0 111.215 173.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -66.99 -41.56 86.55 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 127.769 2.428 . . . . 0.0 108.513 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.7 mt -59.29 -43.91 91.0 Favored 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 124.538 1.135 . . . . 0.0 112.862 167.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.268 77.0 mtp85 -63.45 -49.11 74.94 Favored 'General case' 0 C--N 1.373 1.606 0 O-C-N 120.236 -1.54 . . . . 0.0 115.033 170.315 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -60.29 -27.31 67.19 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 171.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -76.99 -50.67 12.64 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 127.856 2.462 . . . . 0.0 110.678 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -57.3 -29.08 63.6 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 127.623 2.369 . . . . 0.0 110.856 171.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.0 tp -68.5 -49.09 62.28 Favored 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 125.637 1.575 . . . . 0.0 112.295 168.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -55.34 -39.21 69.73 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.353 -1.467 . . . . 0.0 112.213 172.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 64.8 mmt-85 -62.4 -48.71 78.52 Favored 'General case' 0 C--N 1.372 1.575 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 163.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.1 m80 -56.35 -46.49 79.95 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 129.644 3.178 . . . . 0.0 111.577 174.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.473 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -57.43 -53.05 62.57 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 131.472 3.909 . . . . 0.0 111.011 173.565 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -74.33 -43.98 54.37 Favored 'General case' 0 C--N 1.377 1.79 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 t -66.98 -38.03 85.31 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.515 2.326 . . . . 0.0 112.231 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.461 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.34 41.7 mt-10 -76.91 -29.17 55.58 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 125.369 1.468 . . . . 0.0 112.145 170.525 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -33.97 72.88 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 121.415 1.916 . . . . 0.0 113.037 167.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -66.38 -44.69 82.42 Favored 'General case' 0 C--N 1.377 1.797 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.894 164.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.458 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 17.5 tt0 -57.69 -40.25 79.04 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.805 2.15 . . . . 0.0 116.805 170.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.665 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -69.24 -45.64 78.96 Favored 'Isoleucine or valine' 0 C--N 1.366 1.317 0 C-N-CA 125.683 1.593 . . . . 0.0 111.106 178.043 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.758 0.0 OUTLIER -73.54 -23.26 59.96 Favored 'General case' 0 C--N 1.369 1.452 0 O-C-N 121.296 -0.878 . . . . 0.0 112.929 177.129 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.53 -41.15 66.17 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.945 1.698 . . . . 0.0 111.592 168.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.587 0.8 OUTLIER -63.65 -29.32 70.57 Favored 'General case' 0 C--N 1.403 2.908 0 O-C-N 119.507 -1.996 . . . . 0.0 113.426 169.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 7.2 mt -68.78 -50.5 54.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.416 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 166.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.1 mtm180 -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 121.152 1.796 . . . . 0.0 114.743 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.21 -45.23 27.23 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 125.228 1.411 . . . . 0.0 111.417 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.53 -31.91 60.27 Favored 'General case' 0 C--N 1.359 1.019 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -178.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.4 t -78.71 -34.18 46.21 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 127.138 2.175 . . . . 0.0 108.847 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -72.42 -43.25 64.13 Favored 'General case' 0 C--N 1.384 2.076 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 165.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.42 73.14 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 126.399 1.879 . . . . 0.0 114.601 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.28 -16.86 60.92 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 119.082 0.855 . . . . 0.0 112.495 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.83 17.75 40.08 Favored Glycine 0 C--N 1.376 2.764 0 C-N-CA 124.413 1.006 . . . . 0.0 114.12 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.486 HG21 ' HB3' ' A' ' 78' ' ' ASN . 2.3 t -102.16 179.76 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.239 0 C-N-CA 128.113 2.565 . . . . 0.0 111.106 -172.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.397 3.1 t -75.09 -144.93 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.436 2.294 . . . . 0.0 113.834 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.2 m -150.6 157.66 43.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 119.122 -2.236 . . . . 0.0 107.588 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 19.9 p90 -128.63 154.64 46.04 Favored 'General case' 0 C--N 1.349 0.554 0 C-N-CA 124.559 1.144 . . . . 0.0 109.727 -177.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -100.92 114.62 28.66 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 101.847 -3.39 . . . . 0.0 101.847 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.345 0.0 OUTLIER -115.4 128.75 56.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.256 -1.528 . . . . 0.0 107.572 -170.713 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -130.83 146.04 52.16 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 121.076 -1.015 . . . . 0.0 109.295 -178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.482 ' CD1' HD13 ' A' ' 50' ' ' LEU . 21.0 p90 -99.97 159.3 15.19 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 124.983 1.313 . . . . 0.0 110.588 177.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.1 p -108.72 118.83 37.81 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 124.46 1.104 . . . . 0.0 108.562 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.486 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.439 0.0 OUTLIER -74.8 -10.8 59.85 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 119.458 3.133 . . . . 0.0 119.458 -170.435 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.74 -48.6 24.84 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 122.161 2.255 . . . . 0.0 113.049 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.7 pp -67.14 -31.46 71.91 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 128.726 2.811 . . . . 0.0 112.93 173.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.486 ' HB3' ' HA ' ' A' ' 47' ' ' GLN 0.306 6.2 tt -75.56 -42.72 51.52 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 128.593 2.757 . . . . 0.0 109.848 173.408 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.54 -30.32 67.01 Favored 'General case' 0 C--N 1.378 1.831 0 C-N-CA 128.471 2.708 . . . . 0.0 111.246 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -77.96 -41.32 36.53 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 119.87 -1.769 . . . . 0.0 114.508 164.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.44 -34.36 78.11 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.0 tt -66.73 -39.02 82.73 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 C-N-CA 130.421 3.489 . . . . 0.0 112.793 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -104.56 -23.79 13.08 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 174.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.77 -22.71 39.9 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 119.023 -2.298 . . . . 0.0 112.894 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 60' ' ' GLU . 3.1 mm-40 -127.91 14.37 6.86 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -177.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.427 HD11 ' HE ' ' A' ' 10' ' ' ARG 0.478 0.3 OUTLIER 20.64 -28.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.985 2 C-N-CA 136.678 5.991 . . . . 0.0 126.621 177.628 . . . . . . . . 5 4 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -155.3 64.68 0.62 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 57' ' ' GLU 0.452 6.7 pt-20 -87.44 61.93 6.87 Favored 'General case' 0 CA--C 1.469 -2.143 0 CA-C-O 125.53 2.586 . . . . 0.0 110.71 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.319 59.6 p -78.96 -11.79 60.02 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 129.154 2.982 . . . . 0.0 112.492 178.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -65.68 -34.29 77.86 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 130.464 3.506 . . . . 0.0 111.185 164.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.89 -38.04 80.63 Favored 'Isoleucine or valine' 0 C--N 1.359 1.005 0 C-N-CA 126.363 1.865 . . . . 0.0 110.582 -174.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.473 ' CE2' ' HA ' ' A' ' 18' ' ' PHE . 37.6 m-85 -66.52 -46.66 75.45 Favored 'General case' 0 CA--C 1.47 -2.125 1 C-N-CA 133.224 4.61 . . . . 0.0 111.396 169.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -60.46 -38.28 83.7 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.815 1.643 . . . . 0.0 114.875 176.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.479 ' CD1' ' CD1' ' A' ' 111' ' ' LEU . 2.1 tm? -75.24 -47.98 25.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.97 3.308 . . . . 0.0 114.414 173.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.623 0.0 OUTLIER -77.31 -17.68 58.11 Favored 'General case' 0 C--N 1.377 1.763 0 O-C-N 118.304 -2.748 . . . . 0.0 112.001 174.278 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.665 ' CE1' HG12 ' A' ' 25' ' ' ILE . 41.3 m-70 -67.91 -38.11 82.52 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 127.288 2.235 . . . . 0.0 109.516 162.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.493 8.9 mttt -77.22 -16.7 58.94 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 122.135 2.243 . . . . 0.0 112.968 168.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.532 HD13 HE21 ' A' ' 153' ' ' GLN 0.331 0.8 OUTLIER -71.75 -40.03 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 C-N-CA 126.044 1.738 . . . . 0.0 113.47 172.914 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.866 11.5 mptt -67.44 -2.4 6.29 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 131.013 3.725 . . . . 0.0 118.683 176.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -87.43 -16.52 34.63 Favored 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 167.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.42 ' CD2' ' CG ' ' A' ' 151' ' ' LYS 0.288 3.0 m-70 -90.65 10.25 26.49 Favored 'General case' 0 C--N 1.379 1.873 0 C-N-CA 129.768 3.227 . . . . 0.0 111.103 174.268 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . 0.29 24.4 t -41.14 -40.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.414 3.396 0 C-N-CA 130.334 3.454 . . . . 0.0 111.096 160.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.64 -37.95 74.19 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.633 3.173 . . . . 0.0 115.565 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -75.58 -38.24 59.27 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 128.47 2.708 . . . . 0.0 109.904 172.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.385 1.9 m -69.99 -30.42 44.03 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 CA-C-O 124.188 1.946 . . . . 0.0 113.856 173.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.486 ' HB3' HG21 ' A' ' 38' ' ' VAL . 3.7 m120 -73.81 -34.11 64.47 Favored 'General case' 0 C--N 1.345 0.382 1 C-N-CA 132.45 4.3 . . . . 0.0 111.865 172.397 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -67.41 -30.46 70.23 Favored 'General case' 0 C--N 1.367 1.327 0 C-N-CA 125.957 1.703 . . . . 0.0 111.067 165.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.566 13.4 p90 -75.11 -29.92 60.71 Favored 'General case' 0 C--N 1.379 1.864 0 N-CA-C 116.264 1.95 . . . . 0.0 116.264 162.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.32 -38.15 84.47 Favored 'General case' 0 C--N 1.368 1.4 0 C-N-CA 128.05 2.54 . . . . 0.0 114.531 174.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.9 p -93.33 3.03 56.29 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 117.406 2.373 . . . . 0.0 117.406 -171.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.7 ptm -84.3 166.01 35.35 Favored Pre-proline 0 C--N 1.365 1.242 0 CA-C-O 117.168 -1.396 . . . . 0.0 110.427 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -57.2 161.04 11.84 Favored 'Trans proline' 0 CA--C 1.553 1.438 1 C-N-CA 125.723 4.282 . . . . 0.0 114.645 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.42 ' HA ' ' CD ' ' A' ' 125' ' ' LYS . 5.6 Cg_endo -50.44 143.62 26.86 Favored 'Trans proline' 0 C--N 1.364 1.375 1 C-N-CA 126.357 4.704 . . . . 0.0 119.89 -160.667 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -109.34 61.12 0.29 Allowed Pre-proline 0 N--CA 1.491 1.623 0 N-CA-C 119.033 2.975 . . . . 0.0 119.033 175.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -90.6 161.56 4.31 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 124.879 3.719 . . . . 0.0 113.565 -177.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.53 -17.43 8.38 Favored 'General case' 0 C--N 1.364 1.239 1 C-N-CA 132.21 4.204 . . . . 0.0 117.813 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.15 -175.35 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.351 0.655 0 C-N-CA 129.441 3.097 . . . . 0.0 115.611 177.041 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -132.55 -10.25 3.19 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.518 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -94.8 -39.03 10.48 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 116.482 2.03 . . . . 0.0 116.482 -177.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -123.62 12.8 9.3 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 128.614 2.765 . . . . 0.0 111.711 -173.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -139.84 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 120.205 3.409 . . . . 0.0 120.205 -175.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 1.9 pt -79.68 87.01 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.269 0 CA-C-O 128.107 3.813 . . . . 0.0 111.643 175.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -115.96 -26.1 7.45 Favored 'General case' 0 N--CA 1.433 -1.297 2 CA-C-N 104.699 -5.682 . . . . 0.0 109.692 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -103.32 14.8 54.65 Favored Glycine 0 C--N 1.361 1.947 0 C-N-CA 125.06 1.314 . . . . 0.0 111.488 176.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . 0.294 10.2 p -72.96 90.57 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.136 0 CA-C-O 125.357 2.503 . . . . 0.0 115.756 178.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -107.71 9.9 29.03 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 128.259 2.624 . . . . 0.0 111.81 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -132.03 -179.75 5.6 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 128.166 2.586 . . . . 0.0 105.009 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -89.44 163.06 34.9 Favored Pre-proline 0 C--N 1.36 1.058 0 O-C-N 119.986 -1.696 . . . . 0.0 112.676 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -69.06 156.12 66.16 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 124.363 3.375 . . . . 0.0 115.677 -177.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -54.94 27.45 0.01 OUTLIER Glycine 0 C--N 1.357 1.743 2 N-CA-C 124.371 4.508 . . . . 0.0 124.371 -174.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -129.97 138.53 50.89 Favored 'General case' 0 N--CA 1.431 -1.423 1 N-CA-C 98.2 -4.741 . . . . 0.0 98.2 167.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.41 144.61 49.96 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -129.46 130.29 45.7 Favored 'General case' 0 C--N 1.361 1.108 0 N-CA-C 105.596 -2.001 . . . . 0.0 105.596 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.527 ' HB ' ' HB3' ' A' ' 113' ' ' LEU . 1.0 OUTLIER -126.01 137.11 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 175.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.483 HG22 HG12 ' A' ' 149' ' ' VAL . 1.0 OUTLIER -136.49 107.35 6.64 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 172.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.482 ' HB3' ' H ' ' A' ' 109' ' ' GLY . 0.4 OUTLIER -162.98 -117.76 0.01 OUTLIER 'General case' 0 CA--C 1.448 -2.97 0 N-CA-C 103.131 -2.914 . . . . 0.0 103.131 -178.429 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.554 ' H ' ' HG3' ' A' ' 153' ' ' GLN . . . -52.04 75.4 0.01 OUTLIER Glycine 0 C--N 1.384 3.231 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -160.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 63.13 7.35 2.72 Favored 'General case' 0 C--N 1.369 1.437 1 C-N-CA 132.358 4.263 . . . . 0.0 113.192 179.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.479 ' CD1' ' CD1' ' A' ' 66' ' ' LEU . 0.5 OUTLIER -117.32 133.12 56.35 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 129.987 3.315 . . . . 0.0 112.683 -160.132 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -111.4 98.54 7.55 Favored 'General case' 0 C--N 1.363 1.163 1 N-CA-C 98.979 -4.452 . . . . 0.0 98.979 174.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.527 ' HB3' ' HB ' ' A' ' 106' ' ' ILE 0.287 0.8 OUTLIER -115.91 121.11 41.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.453 1.501 . . . . 0.0 107.205 -167.623 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.25 132.1 7.22 Favored Glycine 0 C--N 1.364 2.117 0 O-C-N 119.938 -1.726 . . . . 0.0 109.605 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 152.85 50.56 Favored 'General case' 0 C--N 1.372 1.548 0 CA-C-N 120.848 2.324 . . . . 0.0 107.744 174.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 m -130.1 142.17 50.63 Favored 'General case' 0 C--N 1.371 1.506 0 C-N-CA 125.797 1.639 . . . . 0.0 106.709 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 12.5 m -77.47 179.18 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.999 0 C-N-CA 125.566 1.546 . . . . 0.0 110.289 169.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.41 ' HA ' ' HG3' ' A' ' 130' ' ' GLN 0.267 0.5 OUTLIER -56.66 92.56 0.01 OUTLIER 'General case' 0 C--N 1.359 1.014 0 CA-C-O 124.194 1.949 . . . . 0.0 115.698 168.029 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.354 9.1 pttp -71.6 -40.21 8.32 Favored Pre-proline 0 C--N 1.345 0.383 1 C-N-CA 133.09 4.556 . . . . 0.0 114.028 -178.711 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -75.74 60.3 5.92 Favored 'Trans proline' 0 CA--C 1.568 2.176 0 C-N-CA 124.29 3.327 . . . . 0.0 108.205 160.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.561 0.6 OUTLIER 2.3 -3.24 0.0 OUTLIER 'General case' 0 C--N 1.354 0.764 2 N-CA-C 129.217 6.747 . . . . 0.0 129.217 -168.178 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 56.38 -16.21 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.984 1 N-CA-C 123.224 4.528 . . . . 0.0 123.224 167.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.371 10.0 mptt 72.19 18.66 4.7 Favored 'General case' 0 N--CA 1.421 -1.877 1 C-N-CA 134.821 5.248 . . . . 0.0 114.03 177.58 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -145.71 177.78 8.64 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 128.373 2.669 . . . . 0.0 107.36 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.45 ' H ' ' HE3' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -63.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.354 0.771 1 C-N-CA 132.14 4.176 . . . . 0.0 118.838 -170.466 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -109.8 -4.4 0.11 Allowed Pre-proline 0 N--CA 1.446 -0.636 1 CA-C-O 111.538 -4.077 . . . . 0.0 115.874 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.258 31.1 Cg_exo -69.0 23.61 0.15 Allowed 'Trans proline' 0 C--N 1.371 1.719 2 CA-C-N 133.963 6.022 . . . . 0.0 124.665 -166.898 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.292 19.3 m -145.41 149.55 34.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 C-N-CA 124.514 1.125 . . . . 0.0 108.916 158.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.25 130.42 55.94 Favored 'General case' 0 C--N 1.36 1.026 1 N-CA-C 98.903 -4.48 . . . . 0.0 98.903 159.675 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.41 ' HG3' ' HA ' ' A' ' 118' ' ' CYS . 61.0 mm-40 -125.08 71.99 1.22 Allowed 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -164.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.262 64.0 m 98.15 106.57 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 125.059 1.475 . . . . 0.0 110.405 178.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -115.32 140.78 48.82 Favored 'General case' 0 C--N 1.359 1.002 0 CA-C-N 113.983 -1.462 . . . . 0.0 110.423 171.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 10.1 ttt -107.38 123.51 48.47 Favored 'General case' 0 N--CA 1.436 -1.144 1 C-N-CA 133.815 4.846 . . . . 0.0 110.002 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.66 114.76 17.06 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 169.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.7 mm -136.7 135.16 48.82 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.44 ' CD1' HD22 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -112.35 176.46 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.662 0 CA-C-O 124.423 2.058 . . . . 0.0 107.759 -177.389 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -72.19 103.87 3.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 130.242 3.417 . . . . 0.0 106.024 161.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.42 87.3 p -74.73 77.46 2.06 Favored 'General case' 0 C--N 1.357 0.892 0 N-CA-C 116.155 1.909 . . . . 0.0 116.155 -171.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.461 ' O ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -79.97 -57.67 3.53 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.31 167.796 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 139' ' ' ARG 0.293 32.7 mtt180 109.56 66.16 0.0 OUTLIER 'General case' 0 C--N 1.365 1.272 1 C-N-CA 143.299 8.64 . . . . 0.0 102.788 -173.741 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.35 154.39 62.86 Favored Pre-proline 0 C--N 1.355 0.836 1 N-CA-C 126.158 5.614 . . . . 0.0 126.158 -145.13 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -75.93 -58.65 0.04 OUTLIER 'Trans proline' 0 C--N 1.372 1.813 1 C-N-CA 125.704 4.269 . . . . 0.0 118.358 -177.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -161.6 178.69 37.39 Favored Glycine 0 N--CA 1.436 -1.315 0 C-N-CA 129.204 3.288 . . . . 0.0 110.886 -169.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 8.6 pttp -84.31 174.57 10.03 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 131.096 3.758 . . . . 0.0 120.595 -171.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -170.52 161.34 7.74 Favored 'General case' 0 C--N 1.372 1.545 0 C-N-CA 127.613 2.365 . . . . 0.0 107.755 173.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . 0.415 85.6 p 78.72 148.55 0.1 Allowed 'General case' 0 C--N 1.367 1.333 0 N-CA-C 118.78 2.882 . . . . 0.0 118.78 178.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -175.28 132.9 0.3 Allowed 'General case' 0 C--N 1.357 0.911 0 C-N-CA 129.091 2.956 . . . . 0.0 103.466 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 170.36 -42.33 0.0 OUTLIER 'General case' 0 C--N 1.357 0.905 0 CA-C-O 124.01 1.862 . . . . 0.0 109.617 -172.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.483 HG12 HG22 ' A' ' 107' ' ' THR 0.256 0.2 OUTLIER -71.7 -74.06 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.654 1 C-N-CA 134.72 5.208 . . . . 0.0 111.946 179.138 . . . . . . . . 5 4 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.578 ' CD1' ' HB3' ' A' ' 151' ' ' LYS 0.442 0.3 OUTLIER -129.43 158.67 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.077 1 C-N-CA 147.432 10.293 . . . . 0.0 111.156 -160.742 . . . . . . . . 5 4 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . 0.578 ' HB3' ' CD1' ' A' ' 150' ' ' ILE 0.564 0.0 OUTLIER -71.48 147.18 48.06 Favored 'General case' 0 CA--C 1.502 -0.899 1 C-N-CA 140.219 7.408 . . . . 0.0 105.498 -177.464 . . . . . . . . 5 4 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . 0.473 12.4 t -78.31 93.03 4.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 128.318 3.913 . . . . 0.0 117.882 -163.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.554 ' HG3' ' H ' ' A' ' 109' ' ' GLY 0.251 2.0 pt20 . . . . . 0 N--CA 1.418 -2.026 0 N-CA-C 102.122 -3.288 . . . . 0.0 102.122 177.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 116.264 1.95 . . . . 0.0 116.264 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -123.42 -164.74 1.24 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 127.323 2.249 . . . . 0.0 108.028 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 mm -78.6 72.97 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.174 0 CA-C-O 126.629 3.109 . . . . 0.0 112.455 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.485 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 0.9 OUTLIER -108.19 12.46 26.62 Favored 'General case' 0 N--CA 1.442 -0.851 2 C-N-CA 132.959 4.503 . . . . 0.0 107.193 174.082 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -61.17 2.23 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 130.151 3.381 . . . . 0.0 114.764 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -75.6 -19.58 59.15 Favored 'General case' 0 C--N 1.376 1.734 0 CA-C-O 122.192 0.996 . . . . 0.0 112.227 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.485 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -74.32 -37.25 44.92 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 C-N-CA 129.912 3.285 . . . . 0.0 111.578 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.61 -44.26 82.57 Favored 'General case' 0 C--N 1.373 1.615 0 C-N-CA 128.731 2.812 . . . . 0.0 108.576 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.43 -43.52 77.91 Favored 'Isoleucine or valine' 0 C--N 1.368 1.381 0 C-N-CA 125.1 1.36 . . . . 0.0 112.847 167.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.27 0.9 OUTLIER -62.73 -50.86 69.41 Favored 'General case' 0 CA--C 1.564 1.507 0 C-N-CA 126.39 1.876 . . . . 0.0 115.123 173.184 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.494 ' HG2' HE22 ' A' ' 55' ' ' GLN . 32.6 mtp180 -59.29 -27.63 66.02 Favored 'General case' 0 C--N 1.372 1.546 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 163.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -77.08 -47.76 19.64 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 128.676 2.79 . . . . 0.0 110.563 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.499 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 9.5 mmpt? -58.77 -29.63 66.94 Favored 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.161 2.184 . . . . 0.0 109.571 169.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.07 -44.49 79.96 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 163.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 -60.87 -32.6 72.03 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 122.726 2.512 . . . . 0.0 113.837 171.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.499 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.29 0.5 OUTLIER -72.07 -38.46 69.44 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.498 -1.376 . . . . 0.0 112.289 171.728 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -65.23 -46.14 81.8 Favored 'General case' 0 C--N 1.386 2.154 0 C-N-CA 128.316 2.646 . . . . 0.0 111.06 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.47 ' HA ' ' CZ ' ' A' ' 64' ' ' PHE . 0.5 OUTLIER -63.2 -51.1 67.67 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 129.964 3.306 . . . . 0.0 112.201 -177.891 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -74.31 -42.96 58.64 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 126.983 2.113 . . . . 0.0 115.905 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.7 m -64.93 -42.88 94.28 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 124.428 2.061 . . . . 0.0 112.068 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.462 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.279 41.2 mt-10 -76.41 -29.79 57.2 Favored 'General case' 0 N--CA 1.439 -1.023 0 O-C-N 120.135 -1.603 . . . . 0.0 112.495 172.879 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -59.55 -31.39 69.38 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 122.348 2.34 . . . . 0.0 112.471 166.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -63.0 -46.26 88.5 Favored 'General case' 0 C--N 1.385 2.116 0 C-N-CA 124.585 1.154 . . . . 0.0 111.126 163.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.439 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 43.8 tt0 -56.08 -43.24 77.8 Favored 'General case' 0 C--N 1.371 1.53 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 169.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.7 mt -68.57 -45.79 81.12 Favored 'Isoleucine or valine' 0 C--N 1.357 0.93 0 C-N-CA 125.519 1.528 . . . . 0.0 113.888 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.726 0.1 OUTLIER -73.45 -22.93 60.06 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 174.46 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -67.73 -47.19 70.03 Favored 'General case' 0 C--N 1.377 1.78 0 CA-C-O 116.989 -1.482 . . . . 0.0 112.457 168.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.774 0.2 OUTLIER -69.77 -30.54 68.14 Favored 'General case' 0 C--N 1.406 3.028 0 CA-C-N 124.259 3.209 . . . . 0.0 113.92 171.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.47 -37.15 79.35 Favored 'Isoleucine or valine' 0 C--N 1.372 1.578 0 CA-C-N 121.85 2.114 . . . . 0.0 115.274 170.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 ttt-85 -70.59 -38.08 73.98 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 118.745 -2.472 . . . . 0.0 114.241 175.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -76.3 -41.2 49.43 Favored 'General case' 0 CA--C 1.485 -1.53 0 C-N-CA 126.493 1.917 . . . . 0.0 111.732 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.0 -32.09 45.01 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.369 11.3 p -78.51 -27.98 46.2 Favored 'General case' 0 C--N 1.359 0.987 0 O-C-N 120.823 -1.173 . . . . 0.0 110.125 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -71.36 -52.1 20.55 Favored 'General case' 0 C--N 1.371 1.522 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 158.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.03 -30.16 71.25 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.88 -11.97 60.01 Favored 'General case' 0 C--N 1.375 1.685 0 O-C-N 120.901 -1.124 . . . . 0.0 111.591 170.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.85 17.18 62.0 Favored Glycine 0 C--N 1.383 3.189 0 O-C-N 121.016 -1.052 . . . . 0.0 115.056 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.515 ' CG2' ' H ' ' A' ' 39' ' ' SER . 7.9 p -96.58 178.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.36 0 CA-C-O 125.035 2.35 . . . . 0.0 112.754 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.515 ' H ' ' CG2' ' A' ' 38' ' ' VAL . 41.9 t -23.88 -69.11 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 1 C-N-CA 136.859 6.064 . . . . 0.0 117.522 178.188 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.256 90.9 p 102.57 142.39 0.01 OUTLIER 'General case' 0 C--N 1.357 0.903 0 C-N-CA 131.007 3.723 . . . . 0.0 104.238 -166.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . 0.266 50.4 p90 -141.53 161.9 36.8 Favored 'General case' 0 C--N 1.345 0.399 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -111.12 149.58 30.65 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.847 1.659 . . . . 0.0 112.863 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.353 1.7 pp -126.84 158.38 36.82 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 119.44 -2.038 . . . . 0.0 112.861 167.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -140.41 150.25 43.63 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.347 3.059 . . . . 0.0 103.196 172.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.464 ' CD1' HD12 ' A' ' 50' ' ' LEU . 4.0 p90 -125.2 134.08 52.5 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 105.72 -1.956 . . . . 0.0 105.72 170.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.3 m -105.18 128.16 53.27 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 120.99 -1.069 . . . . 0.0 108.516 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.514 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.597 0.0 OUTLIER -73.68 -10.54 59.8 Favored 'General case' 0 C--N 1.363 1.187 1 N-CA-C 122.541 4.274 . . . . 0.0 122.541 -169.921 . . . . . . . . 5 4 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.27 -45.3 60.7 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 122.966 2.621 . . . . 0.0 111.762 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.0 tp -53.78 -48.61 69.62 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 131.138 3.775 . . . . 0.0 111.977 166.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 47' ' ' GLN . 8.3 tt -74.83 -28.65 60.78 Favored 'General case' 0 CA--C 1.487 -1.444 0 C-N-CA 125.837 1.655 . . . . 0.0 112.708 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -66.72 -30.64 70.92 Favored 'General case' 0 C--N 1.365 1.239 0 CA-C-N 120.177 1.353 . . . . 0.0 108.729 169.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -73.82 -28.69 61.75 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 167.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.82 -50.18 25.74 Favored 'General case' 0 C--O 1.207 -1.179 0 O-C-N 119.979 -1.7 . . . . 0.0 113.373 165.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.282 0.3 OUTLIER -50.95 -43.35 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 1 C-N-CA 132.939 4.496 . . . . 0.0 113.884 -177.297 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.494 HE22 ' HG2' ' A' ' 11' ' ' ARG 0.26 5.3 mm100 -84.18 -31.67 25.01 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 171.828 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -99.53 39.1 1.34 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 124.201 1.953 . . . . 0.0 109.456 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . 0.295 2.7 pt-20 -160.71 -52.07 0.05 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 127.946 2.498 . . . . 0.0 110.395 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.64 0.1 OUTLIER 19.83 108.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.524 3.241 0 C-N-CA 131.518 3.927 . . . . 0.0 113.249 -169.171 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 53.23 44.3 30.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 131.59 3.956 . . . . 0.0 112.089 -173.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.469 ' HG2' HG13 ' A' ' 136' ' ' ILE 0.652 3.8 tp10 -78.29 79.64 4.72 Favored 'General case' 0 C--N 1.372 1.577 0 CA-C-O 127.22 3.391 . . . . 0.0 110.666 175.024 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.313 62.2 p -78.23 -15.87 58.38 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 127.616 2.366 . . . . 0.0 112.569 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -67.59 -33.29 74.7 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 129.859 3.264 . . . . 0.0 109.33 165.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.425 ' CG1' ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -58.57 -44.33 89.15 Favored 'Isoleucine or valine' 0 C--N 1.372 1.551 0 C-N-CA 128.978 2.911 . . . . 0.0 110.332 179.892 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.47 ' CZ ' ' HA ' ' A' ' 18' ' ' PHE . 41.1 m-85 -64.98 -45.46 85.54 Favored 'General case' 0 CA--C 1.488 -1.434 1 C-N-CA 133.332 4.653 . . . . 0.0 111.229 170.612 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.39 -34.17 77.15 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-N 122.408 2.367 . . . . 0.0 114.187 178.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.445 ' CD1' HD21 ' A' ' 111' ' ' LEU . 2.9 tm? -76.35 -45.39 32.3 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 127.43 2.292 . . . . 0.0 116.522 168.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.87 0.1 OUTLIER -75.49 -16.36 60.31 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 122.334 2.333 . . . . 0.0 113.514 176.526 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.439 ' CE1' ' HB3' ' A' ' 24' ' ' GLN 0.253 24.9 m-70 -76.81 -36.34 56.99 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 128.669 2.788 . . . . 0.0 110.296 161.637 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -73.88 -18.17 60.95 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 122.335 2.334 . . . . 0.0 114.569 169.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 26.4 mm -57.8 -70.26 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.379 1.876 0 C-N-CA 129.067 2.947 . . . . 0.0 113.013 173.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.414 ' HE3' ' HD1' ' A' ' 68' ' ' HIS 0.846 0.0 OUTLIER -52.13 -2.1 0.02 OUTLIER 'General case' 0 CA--C 1.48 -1.726 1 C-N-CA 133.015 4.526 . . . . 0.0 120.996 179.163 . . . . . . . . 5 4 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -84.26 -18.77 35.34 Favored 'General case' 0 CA--C 1.564 1.483 0 O-C-N 119.944 -1.722 . . . . 0.0 107.409 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.477 ' CD2' ' HG1' ' A' ' 152' ' ' THR . 22.9 m-70 -99.16 21.23 12.13 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 130.118 3.367 . . . . 0.0 113.993 174.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.3 t -38.62 -43.73 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.397 2.652 0 C-N-CA 129.588 3.155 . . . . 0.0 112.99 163.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.93 -39.69 74.97 Favored 'General case' 0 C--O 1.214 -0.8 1 C-N-CA 132.546 4.339 . . . . 0.0 114.096 177.099 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.254 30.8 mt-10 -75.93 -32.11 59.42 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 126.315 1.846 . . . . 0.0 112.594 169.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.422 1.8 m -66.98 -31.12 52.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.505 0 CA-C-O 127.805 3.669 . . . . 0.0 112.379 168.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . 0.451 0.0 OUTLIER -71.93 -29.56 64.42 Favored 'General case' 0 C--N 1.351 0.67 1 C-N-CA 132.593 4.357 . . . . 0.0 112.067 168.718 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . 0.298 17.7 mt-10 -69.94 -30.11 67.41 Favored 'General case' 0 C--N 1.373 1.602 0 C-N-CA 129.248 3.019 . . . . 0.0 109.574 166.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -61.58 -47.26 86.31 Favored 'General case' 0 C--N 1.386 2.157 0 CA-C-N 119.295 0.952 . . . . 0.0 110.553 165.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 125' ' ' LYS 0.53 1.1 tm? -65.55 -10.85 38.62 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 119.612 3.19 . . . . 0.0 119.612 173.122 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 86.2 p -65.39 2.31 0.91 Allowed 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 121.414 3.857 . . . . 0.0 121.414 -169.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.472 ' HE1' ' CG2' ' A' ' 94' ' ' ILE . 6.6 ttp -124.18 154.0 68.42 Favored Pre-proline 0 N--CA 1.444 -0.731 0 C-N-CA 126.129 1.771 . . . . 0.0 107.259 177.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -62.27 162.31 23.94 Favored 'Trans proline' 0 C--N 1.376 1.975 1 C-N-CA 125.462 4.108 . . . . 0.0 114.14 176.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -57.71 144.98 91.91 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 124.782 3.655 . . . . 0.0 121.571 -161.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . 0.42 2.4 mtp85 -79.2 -10.77 0.16 Allowed Pre-proline 0 CA--C 1.557 1.235 0 N-CA-C 121.427 3.862 . . . . 0.0 121.427 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -12.69 160.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.37 1.675 2 C-N-CA 129.458 6.772 . . . . 0.0 125.889 158.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.01 -22.14 65.46 Favored 'General case' 0 C--N 1.359 0.997 1 C-N-CA 132.589 4.356 . . . . 0.0 119.024 -173.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -98.47 111.04 27.18 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.171 0 CA-C-O 125.849 2.738 . . . . 0.0 109.278 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.44 -11.15 59.72 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 130.736 3.614 . . . . 0.0 111.603 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -97.03 -27.66 14.51 Favored 'General case' 0 CA--C 1.507 -0.683 0 C-N-CA 126.779 2.032 . . . . 0.0 115.021 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.23 -11.1 10.13 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 124.736 1.214 . . . . 0.0 112.256 -176.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -146.01 179.89 7.17 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 122.84 1.305 . . . . 0.0 110.502 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.472 ' CG2' ' HE1' ' A' ' 83' ' ' MET 0.263 4.3 mt -84.9 131.12 34.84 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.117 1 C-N-CA 135.788 5.635 . . . . 0.0 107.189 175.496 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -147.24 -47.77 0.18 Allowed 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -167.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.33 8.79 58.97 Favored Glycine 0 C--N 1.349 1.282 0 N-CA-C 108.564 -1.814 . . . . 0.0 108.564 175.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.44 ' CG1' HG12 ' A' ' 94' ' ' ILE 0.361 4.5 p -114.96 136.4 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.621 0 C-N-CA 127.048 2.139 . . . . 0.0 112.097 176.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . 0.25 28.2 tt0 73.76 21.2 2.8 Favored 'General case' 0 N--CA 1.436 -1.139 1 C-N-CA 135.758 5.623 . . . . 0.0 108.419 -172.282 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -48.52 50.73 0.0 OUTLIER 'General case' 0 C--N 1.371 1.533 0 N-CA-C 121.763 3.986 . . . . 0.0 121.763 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 68.5 mtt85 -112.48 154.11 44.69 Favored Pre-proline 0 C--N 1.351 0.659 0 C-N-CA 127.83 2.452 . . . . 0.0 108.877 177.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -81.4 144.25 14.27 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.71 2.94 . . . . 0.0 111.719 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.55 45.53 0.65 Allowed Glycine 0 C--N 1.364 2.108 0 C-N-CA 126.952 2.215 . . . . 0.0 118.112 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -124.83 139.41 53.87 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 103.822 -2.659 . . . . 0.0 103.822 176.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.51 139.1 45.2 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -174.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -128.26 130.82 48.49 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 102.564 -3.124 . . . . 0.0 102.564 178.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.33 138.71 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 124.477 1.111 . . . . 0.0 108.115 -171.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -137.6 114.4 10.55 Favored 'General case' 0 C--N 1.38 1.928 0 N-CA-C 116.412 2.005 . . . . 0.0 116.412 -167.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.553 ' HB3' ' H ' ' A' ' 151' ' ' LYS 0.329 0.9 OUTLIER -132.32 -157.99 0.86 Allowed 'General case' 0 C--N 1.386 2.16 0 CA-C-N 122.576 2.444 . . . . 0.0 108.064 177.853 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -47.2 67.06 0.0 OUTLIER Glycine 0 CA--C 1.453 -3.84 1 C-N-CA 134.494 5.807 . . . . 0.0 118.771 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 93.41 5.01 0.05 OUTLIER 'General case' 0 CA--C 1.492 -1.277 1 C-N-CA 134.568 5.147 . . . . 0.0 111.825 169.288 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.445 HD21 ' CD1' ' A' ' 66' ' ' LEU . 16.0 tp -106.96 133.99 50.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.727 1.211 . . . . 0.0 111.383 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -110.59 99.63 8.57 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 102.13 -3.285 . . . . 0.0 102.13 171.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -106.76 131.68 53.6 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 124.625 1.17 . . . . 0.0 108.12 -177.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -135.27 138.43 9.98 Favored Glycine 0 C--N 1.348 1.25 0 O-C-N 118.938 -2.351 . . . . 0.0 108.133 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.89 152.81 50.8 Favored 'General case' 0 C--N 1.364 1.203 0 CA-C-N 120.876 2.338 . . . . 0.0 107.182 174.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 p -127.32 140.79 51.96 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 106.33 -1.729 . . . . 0.0 106.33 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.5 t -85.84 134.86 26.24 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 102.411 -3.181 . . . . 0.0 102.411 169.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.517 ' HG ' ' ND2' ' A' ' 121' ' ' ASN 0.418 14.2 p -14.64 64.41 0.0 OUTLIER 'General case' 0 C--N 1.375 1.705 0 C-N-CA 131.674 3.99 . . . . 0.0 120.29 -171.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.436 2.0 ptmt -15.77 -56.75 0.04 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 137.796 6.439 . . . . 0.0 117.215 -172.201 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -68.94 48.18 0.48 Allowed 'Trans proline' 0 CA--C 1.574 2.508 0 C-N-CA 123.143 2.562 . . . . 0.0 115.174 166.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.517 ' ND2' ' HG ' ' A' ' 118' ' ' CYS 0.402 0.0 OUTLIER 156.45 -171.89 0.0 OUTLIER 'General case' 0 C--N 1.376 1.75 0 C-N-CA 131.356 3.863 . . . . 0.0 110.576 176.159 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -152.35 -77.41 0.12 Allowed 'General case' 0 N--CA 1.423 -1.779 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 157.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.502 0.0 OUTLIER 19.35 59.53 0.02 OUTLIER 'General case' 0 C--N 1.356 0.855 1 C-N-CA 135.417 5.487 . . . . 0.0 119.176 -170.496 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 171.14 -168.7 0.02 OUTLIER 'General case' 0 CA--C 1.507 -0.698 1 C-N-CA 132.322 4.249 . . . . 0.0 104.299 -172.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 81' ' ' LEU 0.489 0.0 OUTLIER -125.22 -71.41 0.71 Allowed 'General case' 0 C--N 1.358 0.944 0 CA-C-N 119.457 1.026 . . . . 0.0 113.631 -179.763 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.476 ' HB3' ' HG ' ' A' ' 81' ' ' LEU . 9.3 p-10 -43.71 -59.57 3.37 Favored Pre-proline 0 C--N 1.355 0.831 0 N-CA-C 121.78 3.993 . . . . 0.0 121.78 172.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.619 0.0 OUTLIER 55.49 -178.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.392 2.82 1 N-CA-C 123.061 4.216 . . . . 0.0 123.061 163.648 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 24.6 t -105.26 140.61 38.15 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 102.053 -3.314 . . . . 0.0 102.053 171.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mp -100.29 130.15 46.37 Favored 'General case' 0 C--N 1.347 0.486 1 N-CA-C 99.157 -4.386 . . . . 0.0 99.157 -177.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -123.3 74.29 1.23 Allowed 'General case' 0 CA--C 1.479 -1.756 0 N-CA-C 105.655 -1.979 . . . . 0.0 105.655 -161.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.365 0.5 OUTLIER 95.35 115.65 0.02 OUTLIER 'General case' 0 C--N 1.368 1.389 0 CA-C-O 123.482 1.611 . . . . 0.0 110.598 -176.487 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -114.75 129.93 56.76 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 171.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.9 ttt -93.73 122.02 35.76 Favored 'General case' 0 N--CA 1.439 -0.986 1 C-N-CA 132.998 4.519 . . . . 0.0 107.729 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.274 . . -127.91 114.44 17.17 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -144.4 122.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 O-C-N 119.849 -1.782 . . . . 0.0 108.634 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.469 HG13 ' HG2' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -118.14 -179.67 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 C-N-CA 127.67 2.388 . . . . 0.0 112.72 -166.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.326 0.2 OUTLIER -140.23 153.13 46.46 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 111.314 -2.676 . . . . 0.0 109.169 162.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.483 ' HB2' ' HB2' ' A' ' 141' ' ' LEU . 68.0 m -162.5 -122.35 0.02 OUTLIER 'General case' 0 C--N 1.354 0.789 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -169.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.584 ' CG ' ' H ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -84.76 -81.52 0.19 Allowed 'General case' 0 C--N 1.362 1.138 1 C-N-CA 136.118 5.767 . . . . 0.0 114.661 -171.677 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.584 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 0.5 OUTLIER -87.71 -1.16 57.78 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 129.521 3.128 . . . . 0.0 110.428 171.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.483 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.7 OUTLIER -76.62 177.66 2.46 Favored Pre-proline 0 N--CA 1.42 -1.94 0 C-N-CA 125.951 1.7 . . . . 0.0 111.004 -170.814 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.14 -84.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.727 0 CA-C-N 127.246 3.624 . . . . 0.0 116.472 174.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 133.06 134.9 3.55 Favored Glycine 0 N--CA 1.467 0.762 0 C-N-CA 126.334 1.921 . . . . 0.0 113.461 -171.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -140.89 -173.43 3.71 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.571 2.348 . . . . 0.0 109.136 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -85.88 -162.86 0.78 Allowed 'General case' 0 C--N 1.363 1.155 0 C-N-CA 129.053 2.941 . . . . 0.0 113.904 -179.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 75.5 m -162.99 130.9 3.72 Favored 'General case' 0 C--N 1.353 0.759 0 O-C-N 119.997 -1.69 . . . . 0.0 107.973 175.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.302 8.3 ptpp? -159.14 39.77 0.21 Allowed 'General case' 0 CA--C 1.483 -1.61 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 176.54 148.63 0.12 Allowed 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 103.86 -2.645 . . . . 0.0 103.86 -176.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 4.6 m -145.22 39.66 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.199 0 C-N-CA 125.249 1.42 . . . . 0.0 113.294 -177.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.582 ' CD1' ' H ' ' A' ' 152' ' ' THR . 5.0 tp -130.36 103.04 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 C-N-CA 125.189 1.396 . . . . 0.0 114.492 170.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . 0.553 ' H ' ' HB3' ' A' ' 108' ' ' ASP 0.292 0.0 OUTLIER -127.92 111.24 13.36 Favored 'General case' 0 CA--C 1.459 -2.536 1 O-C-N 115.916 -4.24 . . . . 0.0 115.568 118.886 . . . . . . . . 5 4 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.582 ' H ' ' CD1' ' A' ' 150' ' ' ILE 0.28 74.5 p -118.71 99.11 6.57 Favored 'General case' 0 N--CA 1.435 -1.196 1 N-CA-C 97.58 -4.97 . . . . 0.0 97.58 130.755 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.681 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -175.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 117.262 2.319 . . . . 0.0 117.262 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.9 p -104.08 48.87 0.83 Allowed 'General case' 0 C--N 1.353 0.733 0 C-N-CA 129.69 3.196 . . . . 0.0 108.68 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.92 63.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.912 0 C-N-CA 129.401 3.081 . . . . 0.0 117.956 -173.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.489 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 15.3 m-80 -71.34 0.62 7.68 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 130.956 3.702 . . . . 0.0 115.964 178.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.5 m -61.22 -55.47 31.72 Favored 'General case' 0 C--N 1.349 0.581 0 C-N-CA 130.458 3.503 . . . . 0.0 112.104 174.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -72.74 -21.16 61.07 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 128.222 2.609 . . . . 0.0 112.656 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.489 ' CG1' ' HA ' ' A' ' 4' ' ' ASN 0.267 0.7 OUTLIER -82.41 -38.13 15.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.074 0 C-N-CA 126.798 2.039 . . . . 0.0 111.049 178.156 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.82 -44.47 85.53 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 129.857 3.263 . . . . 0.0 108.885 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.88 -43.84 89.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 C-N-CA 126.048 1.739 . . . . 0.0 110.765 168.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.266 2.7 tpt85 -62.33 -50.29 72.22 Favored 'General case' 0 C--N 1.371 1.511 0 N-CA-C 116.153 1.909 . . . . 0.0 116.153 170.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -59.11 -29.18 67.18 Favored 'General case' 0 C--N 1.373 1.596 0 N-CA-C 118.486 2.773 . . . . 0.0 118.486 170.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -77.21 -51.45 10.93 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.13 3.372 . . . . 0.0 110.719 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -57.44 -29.21 64.0 Favored 'General case' 0 C--N 1.382 1.993 0 C-N-CA 128.271 2.628 . . . . 0.0 111.042 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tp -71.22 -46.68 60.63 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 114.878 -1.056 . . . . 0.0 112.569 167.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -55.32 -43.43 74.89 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 120.18 1.354 . . . . 0.0 112.722 172.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -57.91 -47.75 81.91 Favored 'General case' 0 C--N 1.371 1.543 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 165.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -50.15 74.53 Favored 'General case' 0 C--N 1.38 1.912 0 C-N-CA 128.28 2.632 . . . . 0.0 115.113 175.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.501 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -65.33 -51.44 60.55 Favored 'General case' 0 C--N 1.357 0.91 1 C-N-CA 131.942 4.097 . . . . 0.0 110.226 177.46 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -72.95 -44.84 60.68 Favored 'General case' 0 C--N 1.381 1.952 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 176.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.4 m -63.71 -42.93 97.87 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.352 1.861 . . . . 0.0 112.792 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.407 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.453 4.9 mp0 -76.75 -28.41 55.74 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 120.073 -1.642 . . . . 0.0 111.029 174.163 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -60.45 -32.53 71.47 Favored 'General case' 0 C--N 1.386 2.156 0 CA-C-N 122.467 2.394 . . . . 0.0 113.023 167.88 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -65.12 -45.33 85.54 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 124.347 1.059 . . . . 0.0 111.761 163.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -56.63 -47.04 80.56 Favored 'General case' 0 C--N 1.378 1.806 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 171.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.448 ' CD1' ' CD1' ' A' ' 67' ' ' PHE . 1.2 mt -68.57 -43.85 83.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 124.929 1.291 . . . . 0.0 112.767 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.58 1.4 p30 -73.41 -23.95 60.21 Favored 'General case' 0 C--N 1.376 1.75 0 CA-C-N 121.631 2.014 . . . . 0.0 114.001 173.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -70.61 -41.32 72.41 Favored 'General case' 0 C--N 1.382 1.979 0 C-N-CA 125.059 1.343 . . . . 0.0 111.086 169.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -66.01 -37.68 86.54 Favored 'General case' 0 C--N 1.373 1.614 0 O-C-N 119.439 -2.038 . . . . 0.0 112.429 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -40.15 87.79 Favored 'Isoleucine or valine' 0 C--N 1.363 1.17 0 C-N-CA 124.619 1.168 . . . . 0.0 113.807 174.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -67.21 -39.96 86.39 Favored 'General case' 0 C--N 1.37 1.469 0 O-C-N 120.604 -1.31 . . . . 0.0 113.265 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -75.7 -38.57 58.51 Favored 'General case' 0 CA--C 1.484 -1.575 0 C-N-CA 126.37 1.868 . . . . 0.0 111.642 -176.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.35 -44.96 67.07 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 124.055 0.942 . . . . 0.0 113.175 174.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.484 ' HB2' HD22 ' A' ' 78' ' ' ASN 0.362 96.5 p -71.41 -31.38 67.18 Favored 'General case' 0 C--N 1.355 0.824 0 O-C-N 121.214 -0.929 . . . . 0.0 113.159 177.1 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -69.69 -48.49 59.47 Favored 'General case' 0 C--N 1.367 1.355 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 164.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.1 67.69 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 126.48 1.912 . . . . 0.0 114.612 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.9 -13.67 62.36 Favored 'General case' 0 C--N 1.378 1.805 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 164.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.22 18.05 30.03 Favored Glycine 0 C--N 1.375 2.731 0 O-C-N 120.823 -1.173 . . . . 0.0 113.576 171.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.491 HG12 ' HB3' ' A' ' 78' ' ' ASN 0.256 0.8 OUTLIER -113.25 169.08 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -174.603 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.5 t -30.37 -78.3 0.02 OUTLIER 'General case' 0 C--N 1.357 0.919 1 C-N-CA 132.825 4.45 . . . . 0.0 117.242 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.5 m 122.73 146.86 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 131.483 3.913 . . . . 0.0 102.521 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 30.5 p90 -122.98 154.6 38.21 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 124.713 1.205 . . . . 0.0 109.012 174.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -101.3 144.66 29.87 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.289 2.5 pp -125.86 159.6 32.07 Favored 'General case' 0 CA--C 1.49 -1.349 0 O-C-N 119.207 -2.183 . . . . 0.0 111.066 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -133.79 165.98 23.72 Favored 'General case' 0 CA--C 1.485 -1.537 0 N-CA-C 102.059 -3.311 . . . . 0.0 102.059 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 131' ' ' CYS . 0.1 OUTLIER -152.98 147.2 25.66 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -179.453 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -95.24 124.94 39.54 Favored 'General case' 0 C--N 1.359 0.994 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 176.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.49 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.325 0.4 OUTLIER -79.51 -11.03 59.9 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 117.975 -1.012 . . . . 0.0 113.342 -179.439 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.73 -37.98 48.11 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 127.639 2.375 . . . . 0.0 112.34 176.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.3 tp -62.79 -41.02 99.09 Favored 'General case' 0 C--N 1.359 1.007 0 CA-C-O 126.536 3.065 . . . . 0.0 111.544 168.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.501 ' HG ' ' CZ ' ' A' ' 18' ' ' PHE 0.401 6.8 tt -76.62 -41.43 45.98 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 110.299 -3.137 . . . . 0.0 109.231 -172.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -54.65 -38.24 66.66 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 129.147 2.979 . . . . 0.0 111.746 165.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -66.23 -42.29 88.85 Favored 'General case' 0 C--N 1.376 1.724 0 O-C-N 119.735 -1.853 . . . . 0.0 112.136 169.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.69 67.05 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 118.693 -2.504 . . . . 0.0 116.959 170.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.401 0.2 OUTLIER -69.29 -41.81 81.15 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 C-N-CA 131.582 3.953 . . . . 0.0 111.972 179.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.05 -28.86 10.79 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 171.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -83.54 -27.31 29.41 Favored 'General case' 0 C--N 1.371 1.517 0 CA-C-N 122.277 2.308 . . . . 0.0 111.422 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -103.55 -70.11 0.77 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.931 1.693 . . . . 0.0 111.384 173.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.566 0.0 OUTLIER 83.78 155.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 127.082 2.153 . . . . 0.0 111.568 -179.419 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . 0.257 47.0 p30 31.83 47.43 0.07 Allowed 'General case' 0 N--CA 1.519 3.011 1 C-N-CA 132.483 4.313 . . . . 0.0 116.675 -177.296 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.404 11.3 pt-20 -82.03 69.88 8.83 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-O 125.005 2.336 . . . . 0.0 113.358 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.414 1.2 p -81.67 -19.09 42.35 Favored 'General case' 0 N--CA 1.426 -1.637 0 C-N-CA 131.687 3.995 . . . . 0.0 113.819 164.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.488 ' CZ ' HG22 ' A' ' 136' ' ' ILE . 0.0 OUTLIER -65.42 -35.53 81.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 130.322 3.449 . . . . 0.0 109.157 171.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.52 ' HA ' HD12 ' A' ' 111' ' ' LEU . 3.0 t -58.71 -46.1 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.845 0 C-N-CA 129.668 3.187 . . . . 0.0 110.442 176.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.407 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.254 60.3 m-85 -60.55 -45.18 94.86 Favored 'General case' 0 C--O 1.212 -0.875 1 C-N-CA 131.812 4.045 . . . . 0.0 114.065 166.91 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -68.32 -37.98 81.1 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 121.507 1.958 . . . . 0.0 114.049 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.451 ' HG ' ' HG ' ' A' ' 111' ' ' LEU . 1.3 tm? -65.1 -52.4 55.69 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 125.116 1.366 . . . . 0.0 112.087 168.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.448 ' CD1' ' CD1' ' A' ' 25' ' ' ILE 0.677 0.0 OUTLIER -78.44 -17.76 55.89 Favored 'General case' 0 C--N 1.38 1.896 0 CA-C-N 121.967 2.167 . . . . 0.0 116.158 -177.299 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -78.08 -22.97 48.22 Favored 'General case' 0 C--N 1.355 0.826 0 C-N-CA 128.0 2.52 . . . . 0.0 109.576 165.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -76.91 -36.93 56.28 Favored 'General case' 0 C--N 1.381 1.96 0 O-C-N 120.379 -1.451 . . . . 0.0 110.46 170.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.641 HD12 ' HG1' ' A' ' 152' ' ' THR 0.356 0.0 OUTLIER -92.92 -7.55 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.295 0 N-CA-C 120.74 3.608 . . . . 0.0 120.74 -178.777 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -47.69 -1.45 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 1 C-N-CA 133.725 4.81 . . . . 0.0 116.998 -175.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.43 ' H ' ' C ' ' A' ' 70' ' ' ILE . 18.4 t70 -83.67 -43.23 15.79 Favored 'General case' 0 C--N 1.362 1.116 1 C-N-CA 139.079 6.952 . . . . 0.0 110.353 172.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.601 ' CG ' ' HA ' ' A' ' 153' ' ' GLN . 0.2 OUTLIER -62.57 -9.76 9.87 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 131.343 3.857 . . . . 0.0 115.895 -174.001 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 p -60.49 -20.73 21.47 Favored 'Isoleucine or valine' 0 C--N 1.375 1.702 0 C-N-CA 127.937 2.495 . . . . 0.0 110.959 166.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.99 -35.15 66.8 Favored 'General case' 0 C--N 1.378 1.812 0 C-N-CA 130.339 3.456 . . . . 0.0 111.362 171.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.334 36.2 mt-10 -76.85 -32.61 57.66 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.229 -1.544 . . . . 0.0 113.118 170.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.383 0.8 OUTLIER -68.95 -29.94 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 CA-C-O 126.66 3.124 . . . . 0.0 110.12 167.867 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.491 ' HB3' HG12 ' A' ' 38' ' ' VAL . 11.8 m120 -68.04 -32.5 72.91 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 117.921 -2.987 . . . . 0.0 113.583 165.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.56 -30.03 71.2 Favored 'General case' 0 C--N 1.378 1.82 0 C-N-CA 125.882 1.673 . . . . 0.0 111.534 165.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.425 ' CE2' HG22 ' A' ' 117' ' ' VAL 0.389 6.6 t80 -65.35 -32.05 73.5 Favored 'General case' 0 CA--C 1.583 2.226 0 C-N-CA 126.864 2.066 . . . . 0.0 112.733 164.082 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.9 tp -63.14 -39.53 94.94 Favored 'General case' 0 N--CA 1.523 3.214 0 CA-C-O 125.09 2.376 . . . . 0.0 114.071 162.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.8 t -65.48 4.19 0.59 Allowed 'General case' 0 CA--C 1.546 0.819 1 N-CA-C 122.208 4.151 . . . . 0.0 122.208 -168.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.414 ' HE2' ' N ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -70.51 166.75 32.49 Favored Pre-proline 0 CA--C 1.573 1.859 0 C-N-CA 126.086 1.754 . . . . 0.0 111.386 175.748 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.03 161.14 27.12 Favored 'Trans proline' 0 CA--C 1.56 1.785 1 C-N-CA 125.43 4.087 . . . . 0.0 113.89 175.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -69.22 150.79 71.94 Favored 'Trans proline' 0 CA--C 1.555 1.568 1 CA-C-N 129.952 4.59 . . . . 0.0 117.151 -170.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . 0.479 1.6 mmm180 -66.28 -2.43 0.05 OUTLIER Pre-proline 0 CA--C 1.576 1.974 1 N-CA-C 123.745 4.721 . . . . 0.0 123.745 176.641 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -21.99 161.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.371 1.763 2 C-N-CA 129.498 6.799 . . . . 0.0 127.16 161.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -66.77 -23.66 66.1 Favored 'General case' 0 C--N 1.364 1.198 0 C-N-CA 131.505 3.922 . . . . 0.0 116.381 174.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 121.34 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.601 0 C-N-CA 130.622 3.569 . . . . 0.0 112.136 174.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.76 -17.42 64.61 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 129.755 3.222 . . . . 0.0 115.442 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.17 -30.75 60.79 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 127.135 2.174 . . . . 0.0 112.122 172.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -97.49 -65.11 0.98 Allowed 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 125.48 1.512 . . . . 0.0 113.355 176.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.77 80.5 t80 26.68 -47.93 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.565 2 N-CA-C 127.369 6.063 . . . . 0.0 127.369 -173.643 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . 0.254 4.7 pt -119.93 136.13 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.102 0 N-CA-C 117.296 2.332 . . . . 0.0 117.296 -175.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.414 ' N ' ' HE2' ' A' ' 83' ' ' MET . 0.4 OUTLIER -155.37 161.79 40.96 Favored 'General case' 0 CA--C 1.508 -0.655 1 C-N-CA 138.025 6.53 . . . . 0.0 102.593 176.241 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 41.61 23.83 0.13 Allowed Glycine 0 C--N 1.359 1.822 0 C-N-CA 129.528 3.442 . . . . 0.0 119.671 172.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.6 p -68.09 142.3 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.903 0 C-N-CA 130.248 3.419 . . . . 0.0 117.942 -160.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -94.42 16.92 14.0 Favored 'General case' 0 N--CA 1.44 -0.972 1 C-N-CA 132.106 4.162 . . . . 0.0 115.022 -174.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -96.85 -20.89 17.84 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 127.865 2.466 . . . . 0.0 107.835 173.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -112.82 152.39 44.78 Favored Pre-proline 0 C--N 1.353 0.734 0 N-CA-C 102.783 -3.044 . . . . 0.0 102.783 169.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -75.32 138.12 21.88 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.809 3.006 . . . . 0.0 110.229 176.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.47 48.88 3.51 Favored Glycine 0 C--N 1.359 1.835 0 C-N-CA 126.142 1.83 . . . . 0.0 115.155 -172.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -141.06 151.7 44.23 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.286 -1.714 . . . . 0.0 107.902 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.0 mt -109.61 114.11 27.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -128.81 109.42 11.26 Favored 'General case' 0 CA--C 1.496 -1.107 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 -173.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.3 pp -136.63 141.01 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.075 0 C-N-CA 125.752 1.621 . . . . 0.0 111.837 -171.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.5 m -117.9 118.47 32.09 Favored 'General case' 0 C--N 1.351 0.641 0 O-C-N 119.652 -1.905 . . . . 0.0 111.873 177.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.263 0.4 OUTLIER -176.6 170.36 2.45 Favored 'General case' 0 CA--C 1.479 -1.762 0 N-CA-C 102.724 -3.065 . . . . 0.0 102.724 172.727 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.49 ' O ' ' HB2' ' A' ' 110' ' ' ASN . . . 94.0 -34.15 4.83 Favored Glycine 1 CA--C 1.417 -6.074 0 CA-C-O 115.044 -3.087 . . . . 0.0 110.753 -160.863 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 29.9 m-80 100.76 0.71 0.02 OUTLIER 'General case' 0 C--N 1.375 1.684 2 C-N-CA 132.232 4.213 . . . . 0.0 106.381 -157.448 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.52 HD12 ' HA ' ' A' ' 63' ' ' VAL 0.308 1.0 OUTLIER -86.72 137.03 32.79 Favored 'General case' 0 C--N 1.354 0.787 1 C-N-CA 138.103 6.561 . . . . 0.0 114.216 -178.681 . . . . . . . . 5 4 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.71 100.64 13.32 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 164.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -96.22 126.82 41.7 Favored 'General case' 0 C--N 1.382 1.981 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 175.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.66 123.71 5.32 Favored Glycine 0 C--N 1.351 1.391 0 N-CA-C 105.899 -2.881 . . . . 0.0 105.899 174.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -122.97 127.3 48.66 Favored 'General case' 0 C--N 1.369 1.446 1 N-CA-C 99.648 -4.204 . . . . 0.0 99.648 174.713 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.1 m -121.18 127.88 51.93 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 -171.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.425 HG22 ' CE2' ' A' ' 80' ' ' PHE . 13.4 t -80.24 138.73 19.31 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.558 10.9 p -54.41 67.7 0.0 OUTLIER 'General case' 0 C--N 1.378 1.84 0 N-CA-C 120.845 3.646 . . . . 0.0 120.845 -162.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.465 11.8 ttmm -22.48 -45.81 0.05 OUTLIER Pre-proline 0 C--N 1.359 0.997 1 C-N-CA 133.999 4.92 . . . . 0.0 121.795 -170.251 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -70.63 60.18 2.12 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 CA-C-N 125.647 3.053 . . . . 0.0 113.595 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 170.07 161.99 0.07 Allowed 'General case' 0 C--N 1.367 1.335 0 C-N-CA 128.038 2.535 . . . . 0.0 113.521 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.481 ' C ' ' H ' ' A' ' 124' ' ' PHE . 2.5 tt0 -85.28 -69.63 0.64 Allowed 'General case' 0 C--N 1.376 1.744 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 152.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 44.37 -10.76 0.0 OUTLIER 'General case' 0 C--N 1.363 1.173 1 C-N-CA 139.648 7.179 . . . . 0.0 118.018 -170.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.481 ' H ' ' C ' ' A' ' 122' ' ' GLU . 56.4 m-85 -138.9 -163.01 1.4 Allowed 'General case' 0 N--CA 1.414 -2.245 0 N-CA-C 121.212 3.782 . . . . 0.0 121.212 -161.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.364 0.0 OUTLIER -167.84 -56.4 0.02 OUTLIER 'General case' 0 C--N 1.359 1.019 2 C-N-CA 139.725 7.21 . . . . 0.0 105.484 179.051 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -89.31 85.26 0.13 Allowed Pre-proline 0 C--N 1.357 0.894 1 C-N-CA 131.999 4.119 . . . . 0.0 111.912 171.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -90.72 -176.08 0.94 Allowed 'Trans proline' 0 CA--C 1.488 -1.782 0 C-N-CA 124.136 3.224 . . . . 0.0 117.297 -161.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 16.6 m -112.41 136.07 52.34 Favored 'General case' 0 N--CA 1.439 -1.006 1 N-CA-C 100.192 -4.003 . . . . 0.0 100.192 162.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.5 mp -100.73 140.83 34.46 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 102.415 -3.18 . . . . 0.0 102.415 -175.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -100.28 -0.58 38.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.889 -1.132 . . . . 0.0 110.412 -166.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 45' ' ' TYR . 8.4 t 174.21 128.92 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -170.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -115.59 109.79 18.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 101.309 -3.589 . . . . 0.0 101.309 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 10.3 ttt -104.28 122.66 45.87 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.191 2.196 . . . . 0.0 107.423 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.301 . . -129.07 113.74 15.51 Favored 'General case' 0 N--CA 1.435 -1.213 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 173.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -144.24 159.98 15.37 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 C-N-CA 125.378 1.471 . . . . 0.0 111.836 -176.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.488 HG22 ' CZ ' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -140.11 -179.08 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 128.236 2.614 . . . . 0.0 108.989 -175.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.12 122.98 18.88 Favored 'General case' 0 CA--C 1.56 1.331 0 N-CA-C 117.938 2.57 . . . . 0.0 117.938 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.326 46.5 m 172.72 -76.01 0.0 OUTLIER 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.989 2.915 . . . . 0.0 105.486 177.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 168.45 -123.78 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.156 1 N-CA-C 95.722 -5.659 . . . . 0.0 95.722 -172.363 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -58.94 -24.72 62.82 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 130.979 3.711 . . . . 0.0 119.682 173.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.466 ' CD2' ' HB ' ' A' ' 136' ' ' ILE 0.359 0.0 OUTLIER 63.42 157.98 0.12 Allowed Pre-proline 0 N--CA 1.436 -1.125 2 C-N-CA 135.802 5.641 . . . . 0.0 124.276 178.991 . . . . . . . . 5 4 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -72.4 -20.33 24.19 Favored 'Trans proline' 0 C--N 1.366 1.46 1 C-N-CA 126.228 4.619 . . . . 0.0 116.85 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 32.62 55.14 0.48 Allowed Glycine 0 N--CA 1.472 1.058 1 C-N-CA 135.323 6.201 . . . . 0.0 122.583 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -141.57 137.96 32.31 Favored 'General case' 0 C--N 1.355 0.817 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 75.8 157.36 0.19 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 128.372 2.669 . . . . 0.0 116.288 -177.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 36.4 t -135.54 130.82 35.16 Favored 'General case' 0 C--N 1.363 1.189 0 O-C-N 119.351 -2.093 . . . . 0.0 105.834 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp 164.05 117.17 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.528 0 C-N-CA 128.726 2.81 . . . . 0.0 107.566 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -158.24 -82.35 0.05 Allowed 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 105.893 -1.891 . . . . 0.0 105.893 -172.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.8 -77.39 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.206 0 C-N-CA 125.88 1.672 . . . . 0.0 111.694 172.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -103.3 134.78 43.51 Favored 'Isoleucine or valine' 0 CA--C 1.466 -2.251 0 C-N-CA 127.273 2.229 . . . . 0.0 107.637 -161.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -77.82 115.24 17.41 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 105.433 -2.062 . . . . 0.0 105.433 176.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.641 ' HG1' HD12 ' A' ' 70' ' ' ILE . 11.0 t -75.38 143.84 42.57 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -124.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.601 ' HA ' ' CG ' ' A' ' 73' ' ' HIS . 3.1 tp60 . . . . . 0 C--O 1.263 1.764 0 C-N-CA 129.235 3.014 . . . . 0.0 109.841 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.0 mtp . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . 0.311 17.8 p 50.1 92.76 0.02 OUTLIER 'General case' 0 C--N 1.361 1.067 0 N-CA-C 121.097 3.74 . . . . 0.0 121.097 176.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.407 ' O ' ' HB ' ' A' ' 7' ' ' VAL . 0.0 OUTLIER -79.86 79.05 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.374 1.652 0 C-N-CA 126.58 1.952 . . . . 0.0 108.808 173.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.452 2.5 m120 -114.8 10.01 16.42 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 128.661 2.784 . . . . 0.0 114.441 -178.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 -58.21 1.92 Allowed 'General case' 0 C--O 1.246 0.906 1 C-N-CA 132.504 4.321 . . . . 0.0 105.465 160.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.436 6.7 mt-10 -63.99 -8.74 12.47 Favored 'General case' 0 C--O 1.205 -1.243 0 O-C-N 119.49 -2.006 . . . . 0.0 115.358 177.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.407 ' HB ' ' O ' ' A' ' 3' ' ' ILE . 5.5 p -67.93 -35.65 72.82 Favored 'Isoleucine or valine' 0 C--N 1.365 1.262 0 C-N-CA 131.488 3.915 . . . . 0.0 113.339 171.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -78.64 -43.81 25.32 Favored 'General case' 0 CA--C 1.497 -1.095 1 C-N-CA 133.062 4.545 . . . . 0.0 107.721 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.7 mt -64.39 -44.1 97.11 Favored 'Isoleucine or valine' 0 C--N 1.374 1.658 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.423 166.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' HE ' HD13 ' A' ' 58' ' ' ILE 0.267 26.5 mmm-85 -54.8 -50.34 68.76 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 130.576 3.55 . . . . 0.0 111.536 174.259 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -57.89 -36.72 72.8 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 118.596 2.813 . . . . 0.0 118.596 163.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -76.64 -44.43 34.09 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 118.17 -2.831 . . . . 0.0 113.259 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 30.6 mmmt -63.67 -30.43 71.54 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 131.075 3.75 . . . . 0.0 106.95 172.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.439 HD22 ' HB2' ' A' ' 17' ' ' HIS . 0.5 OUTLIER -67.87 -41.02 83.47 Favored 'General case' 0 C--N 1.373 1.619 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 162.334 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.4 mtp180 -60.15 -38.06 82.01 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.404 2.82 . . . . 0.0 112.425 171.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.8 mmt-85 -63.23 -53.25 55.97 Favored 'General case' 0 C--N 1.374 1.641 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.439 ' HB2' HD22 ' A' ' 14' ' ' LEU . 8.4 m-70 -59.07 -50.37 74.33 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 130.226 3.41 . . . . 0.0 112.343 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.483 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.62 -54.1 49.39 Favored 'General case' 0 C--N 1.378 1.819 0 C-N-CA 130.176 3.391 . . . . 0.0 111.165 176.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -73.57 -38.75 65.08 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -65.59 -43.73 88.8 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 125.438 1.495 . . . . 0.0 112.826 177.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.512 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.257 44.2 mt-10 -75.26 -28.99 60.03 Favored 'General case' 0 C--N 1.361 1.096 0 O-C-N 121.08 -1.012 . . . . 0.0 111.732 171.525 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.409 ' CE2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -67.89 -28.65 67.69 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 117.883 -3.011 . . . . 0.0 114.827 171.103 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -69.16 -37.04 78.02 Favored 'General case' 0 C--N 1.372 1.567 0 C-N-CA 125.629 1.572 . . . . 0.0 109.393 165.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.529 HE21 ' CE1' ' A' ' 68' ' ' HIS . 27.8 tt0 -58.9 -43.15 90.97 Favored 'General case' 0 C--N 1.369 1.451 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 169.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -72.42 -46.23 57.01 Favored 'Isoleucine or valine' 0 C--N 1.366 1.32 0 O-C-N 121.267 -0.896 . . . . 0.0 111.626 176.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.471 ' HA ' ' CG1' ' A' ' 29' ' ' ILE 0.634 17.7 p30 -71.98 -22.62 61.41 Favored 'General case' 0 C--N 1.372 1.586 0 O-C-N 119.733 -1.855 . . . . 0.0 115.447 175.837 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -74.37 -43.11 57.92 Favored 'General case' 0 C--N 1.373 1.591 0 O-C-N 119.754 -1.841 . . . . 0.0 110.508 166.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.433 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.312 0.3 OUTLIER -64.86 -32.73 74.57 Favored 'General case' 0 C--N 1.395 2.576 0 O-C-N 118.756 -2.465 . . . . 0.0 113.526 173.196 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.471 ' CG1' ' HA ' ' A' ' 26' ' ' ASN 0.262 1.5 pp -67.84 -43.45 86.11 Favored 'Isoleucine or valine' 0 C--N 1.375 1.681 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 174.03 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.0 ttm105 -62.84 -37.67 87.72 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 119.748 -1.845 . . . . 0.0 115.853 174.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -76.59 -48.66 18.48 Favored 'General case' 0 CA--C 1.478 -1.793 0 C-N-CA 127.756 2.423 . . . . 0.0 111.27 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.52 -34.74 76.41 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 t -73.45 -43.33 60.53 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.281 1.432 . . . . 0.0 110.73 175.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -70.74 -35.72 72.82 Favored 'General case' 0 C--N 1.375 1.711 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.75 -32.7 62.17 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 126.194 1.798 . . . . 0.0 113.748 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -16.54 60.54 Favored 'General case' 0 C--N 1.385 2.125 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.56 18.38 28.25 Favored Glycine 0 C--N 1.37 2.426 0 O-C-N 121.123 -0.985 . . . . 0.0 115.289 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.442 ' CG2' ' N ' ' A' ' 39' ' ' SER . 0.6 OUTLIER -104.1 166.93 2.85 Favored 'Isoleucine or valine' 0 C--N 1.357 0.917 0 N-CA-C 101.722 -3.436 . . . . 0.0 101.722 176.03 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.442 ' N ' ' CG2' ' A' ' 38' ' ' VAL 0.298 0.0 OUTLIER -39.18 160.87 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.115 1 C-N-CA 134.417 5.087 . . . . 0.0 118.011 159.925 . . . . . . . . 5 4 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.9 p -103.89 117.76 35.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 118.808 -2.433 . . . . 0.0 110.034 -173.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -118.28 153.24 34.28 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-O 122.034 0.921 . . . . 0.0 110.372 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -113.83 105.8 13.7 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.485 ' HA ' ' HB2' ' A' ' 129' ' ' LEU 0.356 0.1 OUTLIER -94.58 120.71 35.24 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 118.845 -2.409 . . . . 0.0 111.671 -169.347 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -132.55 145.23 50.97 Favored 'General case' 0 C--N 1.4 2.801 0 CA-C-N 120.64 1.564 . . . . 0.0 109.426 -170.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.409 ' CD2' ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -92.65 147.32 22.97 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.582 3.153 . . . . 0.0 114.897 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.4 p -108.45 96.81 6.6 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 128.625 2.77 . . . . 0.0 105.543 175.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -48.03 -8.43 0.02 OUTLIER 'General case' 0 C--O 1.2 -1.508 1 C-N-CA 132.056 4.142 . . . . 0.0 119.773 -174.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.34 81.43 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 125.383 3.72 . . . . 0.0 116.695 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.488 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.2 -38.96 92.93 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 129.726 3.21 . . . . 0.0 112.997 171.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.488 ' H ' HD22 ' A' ' 49' ' ' LEU . 5.9 tt -72.01 -36.59 69.76 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 127.456 2.303 . . . . 0.0 111.062 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.58 -30.41 71.13 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 129.642 3.177 . . . . 0.0 108.82 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -69.4 -45.68 68.67 Favored 'General case' 0 C--N 1.37 1.499 0 CA-C-O 124.306 2.003 . . . . 0.0 115.315 164.325 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.482 ' HA ' HD21 ' A' ' 141' ' ' LEU . . . -75.52 -27.83 58.89 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 117.574 2.435 . . . . 0.0 117.574 -172.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.412 ' HB ' HD23 ' A' ' 50' ' ' LEU . 5.2 tt -74.35 -37.61 45.48 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.845 1 C-N-CA 132.941 4.496 . . . . 0.0 110.587 176.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -107.94 -29.17 9.18 Favored 'General case' 0 C--N 1.38 1.904 0 N-CA-C 117.862 2.541 . . . . 0.0 117.862 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.81 -45.32 17.12 Favored 'General case' 0 C--N 1.357 0.933 0 CA-C-N 121.663 2.029 . . . . 0.0 114.35 -172.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.518 ' HB3' ' HA ' ' A' ' 141' ' ' LEU 0.276 0.0 OUTLIER -103.35 -44.05 5.26 Favored 'General case' 0 CA--C 1.48 -1.749 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 171.423 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.444 HD13 ' HE ' ' A' ' 10' ' ' ARG 0.488 0.0 OUTLIER 74.82 -168.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.854 1 C-N-CA 131.984 4.114 . . . . 0.0 112.638 179.132 . . . . . . . . 5 4 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . 0.252 50.2 p30 21.94 49.54 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 1 C-N-CA 131.909 4.083 . . . . 0.0 117.786 179.002 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.458 ' O ' ' HB ' ' A' ' 63' ' ' VAL 0.5 11.4 pt-20 -80.76 62.99 5.0 Favored 'General case' 0 C--N 1.362 1.12 0 CA-C-O 127.308 3.432 . . . . 0.0 112.227 -172.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.561 1.4 p -80.64 -15.67 56.0 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.223 2.609 . . . . 0.0 116.994 176.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.406 ' CE2' HD11 ' A' ' 111' ' ' LEU . 4.0 t80 -71.44 -33.28 69.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.823 2.449 . . . . 0.0 107.871 167.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.458 ' HB ' ' O ' ' A' ' 60' ' ' GLU . 94.0 t -69.61 -36.21 69.66 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 128.059 2.544 . . . . 0.0 108.945 175.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.512 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 31.5 m-85 -66.92 -34.91 78.82 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.498 1.919 . . . . 0.0 115.826 164.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -83.01 -36.72 24.79 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-N 122.032 2.196 . . . . 0.0 112.086 -176.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 108' ' ' ASP . 2.8 tt -65.41 -42.61 92.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.648 1.579 . . . . 0.0 110.934 167.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.403 ' HA ' HG12 ' A' ' 70' ' ' ILE 0.926 0.0 OUTLIER -77.84 -15.15 59.27 Favored 'General case' 0 C--N 1.368 1.387 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 173.596 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.529 ' CE1' HE21 ' A' ' 24' ' ' GLN 0.283 41.6 m-70 -83.77 -15.83 47.03 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 127.221 2.209 . . . . 0.0 112.042 166.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.489 0.0 OUTLIER -82.91 -27.49 30.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 119.973 -1.705 . . . . 0.0 109.107 155.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.666 HD11 ' CE1' ' A' ' 73' ' ' HIS . 18.7 mm -67.57 -9.55 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 C-N-CA 127.502 2.321 . . . . 0.0 113.537 170.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HB2' ' CD ' ' A' ' 28' ' ' GLU . 62.2 pttt -49.98 -33.84 19.1 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 120.609 3.559 . . . . 0.0 120.609 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -101.62 8.41 41.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.517 -1.364 . . . . 0.0 107.454 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.666 ' CE1' HD11 ' A' ' 70' ' ' ILE . 10.7 m170 -66.87 -8.88 32.32 Favored 'General case' 0 C--N 1.395 2.569 0 C-N-CA 129.125 2.97 . . . . 0.0 110.988 171.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -41.38 -46.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 128.968 2.907 . . . . 0.0 112.02 157.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.46 -23.88 64.65 Favored 'General case' 0 C--N 1.36 1.045 0 N-CA-C 117.563 2.431 . . . . 0.0 117.563 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -75.47 -46.63 31.34 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.541 1.536 . . . . 0.0 111.686 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.39 14.7 p -66.3 -29.0 45.25 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.4 0 C-N-CA 127.474 2.31 . . . . 0.0 110.206 172.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.417 ' HB3' HG21 ' A' ' 38' ' ' VAL . 73.0 m-20 -74.19 -38.69 63.55 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 128.285 2.634 . . . . 0.0 116.67 169.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -30.42 71.16 Favored 'General case' 0 C--N 1.372 1.555 0 C-N-CA 126.156 1.782 . . . . 0.0 110.896 172.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.22 -38.96 82.42 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 128.577 2.751 . . . . 0.0 112.283 166.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.5 tp -73.24 -15.66 61.42 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 128.551 2.74 . . . . 0.0 118.134 171.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.5 t -90.53 2.57 55.63 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 131.143 3.777 . . . . 0.0 115.222 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.456 ' HE2' ' CG2' ' A' ' 97' ' ' VAL . 3.0 ppp? -110.51 163.79 16.39 Favored Pre-proline 0 C--N 1.356 0.861 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 178.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -69.77 177.66 5.37 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 124.483 3.456 . . . . 0.0 113.258 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -72.8 135.03 22.88 Favored 'Trans proline' 0 C--N 1.358 1.037 0 CA-C-N 125.412 2.969 . . . . 0.0 110.021 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.2 mtt180 -45.86 106.69 0.58 Allowed Pre-proline 0 CA--C 1.564 1.507 0 N-CA-C 119.729 3.233 . . . . 0.0 119.729 -174.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -61.55 162.62 20.48 Favored 'Trans proline' 0 C--N 1.361 1.22 1 C-N-CA 127.131 5.221 . . . . 0.0 119.809 -174.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.23 -10.34 19.66 Favored 'General case' 0 C--N 1.375 1.685 0 CA-C-O 123.277 1.513 . . . . 0.0 114.678 -173.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -89.0 -173.36 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 C-N-CA 130.636 3.574 . . . . 0.0 113.975 -176.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -130.94 -12.12 3.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 113.048 -1.887 . . . . 0.0 111.297 177.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -87.02 -48.33 8.19 Favored 'General case' 0 C--N 1.356 0.87 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -177.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -120.57 26.36 9.2 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.171 2.188 . . . . 0.0 110.969 -176.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.357 0.0 OUTLIER -69.86 -135.69 0.0 OUTLIER 'General case' 0 C--N 1.363 1.182 1 N-CA-C 122.398 4.221 . . . . 0.0 122.398 -171.719 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.436 HG22 ' HB ' ' A' ' 97' ' ' VAL . 8.2 mt -80.74 128.82 38.39 Favored 'Isoleucine or valine' 0 C--N 1.358 0.954 0 C-N-CA 128.893 2.877 . . . . 0.0 115.462 -177.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -144.18 -47.08 0.26 Allowed 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 113.228 -1.806 . . . . 0.0 111.392 -172.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -87.41 25.84 7.72 Favored Glycine 0 C--N 1.36 1.875 0 O-C-N 120.381 -1.449 . . . . 0.0 113.238 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.456 ' CG2' ' HE2' ' A' ' 83' ' ' MET . 70.5 t -111.02 111.0 34.27 Favored 'Isoleucine or valine' 0 C--N 1.351 0.646 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -106.9 7.91 30.32 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 126.181 1.792 . . . . 0.0 112.948 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -132.46 -137.18 0.19 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.425 1.89 . . . . 0.0 113.917 -173.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.9 mmm180 -113.04 167.67 8.89 Favored Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 127.74 2.416 . . . . 0.0 113.078 -172.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -59.15 70.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 1 C-N-CA 127.051 5.167 . . . . 0.0 122.453 -176.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 95.77 -4.16 65.76 Favored Glycine 0 N--CA 1.467 0.729 0 C-N-CA 127.306 2.384 . . . . 0.0 110.919 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.54 147.63 34.97 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 127.193 2.197 . . . . 0.0 113.975 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.7 tt -135.38 123.74 23.27 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -129.54 130.25 45.52 Favored 'General case' 0 C--N 1.365 1.279 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . 0.493 0.0 OUTLIER -135.27 140.72 44.4 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.294 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.9 t -124.71 143.6 50.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 119.223 -2.173 . . . . 0.0 113.213 -173.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.405 ' HB3' HD22 ' A' ' 66' ' ' LEU . 27.0 t70 -124.64 82.77 2.08 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 120.018 -1.677 . . . . 0.0 108.322 174.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.52 -47.0 0.05 OUTLIER Glycine 0 C--N 1.368 2.339 0 C-N-CA 129.78 3.562 . . . . 0.0 119.419 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -119.24 -49.17 2.4 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 128.219 2.608 . . . . 0.0 107.421 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.406 HD11 ' CE2' ' A' ' 62' ' ' TYR 0.318 5.6 mp -80.05 134.45 36.21 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 122.382 2.355 . . . . 0.0 117.062 179.234 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -104.81 101.64 11.23 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 104.987 -2.227 . . . . 0.0 104.987 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.491 ' HG ' HG13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -102.87 122.01 43.67 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 177.616 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.79 135.38 12.49 Favored Glycine 0 C--N 1.356 1.671 0 N-CA-C 106.76 -2.536 . . . . 0.0 106.76 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.9 135.58 48.52 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' A' ' 131' ' ' CYS . 48.5 m -135.5 134.62 39.69 Favored 'General case' 0 C--N 1.371 1.523 0 O-C-N 119.049 -2.282 . . . . 0.0 105.248 179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 14.9 m -66.48 166.46 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.572 0 C-N-CA 125.385 1.474 . . . . 0.0 111.936 177.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.371 24.4 p -67.45 63.19 0.07 Allowed 'General case' 0 C--N 1.35 0.63 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -24.43 -47.0 0.09 OUTLIER Pre-proline 0 C--N 1.353 0.756 1 C-N-CA 137.356 6.262 . . . . 0.0 118.988 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -73.72 53.06 2.66 Favored 'Trans proline' 0 CA--C 1.566 2.109 0 C-N-CA 123.718 2.945 . . . . 0.0 113.364 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -159.23 152.34 22.22 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.914 2.086 . . . . 0.0 110.706 -175.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -126.09 11.25 7.61 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 120.472 1.487 . . . . 0.0 112.465 170.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.314 0.0 OUTLIER -95.34 2.83 54.81 Favored 'General case' 0 C--N 1.364 1.215 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 -176.361 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.458 ' HB2' ' HD3' ' A' ' 125' ' ' LYS 0.53 0.0 OUTLIER -45.66 149.75 0.57 Allowed 'General case' 0 C--N 1.353 0.741 1 N-CA-C 122.074 4.101 . . . . 0.0 122.074 178.427 . . . . . . . . 5 4 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.593 ' H ' ' HD3' ' A' ' 127' ' ' PRO 0.816 10.8 mmtt 125.01 92.79 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.594 1 C-N-CA 134.606 5.162 . . . . 0.0 103.787 169.766 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.455 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.8 t70 112.51 13.48 0.0 OUTLIER Pre-proline 0 CA--C 1.592 2.572 1 C-N-CA 131.706 4.002 . . . . 0.0 113.49 -156.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.593 ' HD3' ' H ' ' A' ' 125' ' ' LYS . 85.0 Cg_endo -63.88 -175.44 0.29 Allowed 'Trans proline' 0 C--N 1.387 2.556 2 C-N-CA 127.987 5.791 . . . . 0.0 119.364 175.23 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 38.4 m -101.99 164.52 11.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 109.905 -3.316 . . . . 0.0 104.467 170.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 43' ' ' LEU . 5.8 mp -102.48 143.5 32.11 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 102.406 -3.183 . . . . 0.0 102.406 171.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.02 53.99 1.97 Allowed 'General case' 0 CA--C 1.484 -1.583 0 N-CA-C 104.243 -2.503 . . . . 0.0 104.243 -170.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.408 ' HB2' ' HB ' ' A' ' 116' ' ' THR . 1.8 m 147.28 104.2 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 104.587 -2.375 . . . . 0.0 104.587 -175.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -117.39 112.76 21.12 Favored 'General case' 0 N--CA 1.439 -0.992 1 N-CA-C 99.667 -4.198 . . . . 0.0 99.667 166.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.0 ttt -109.07 126.83 53.58 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.28 114.91 17.51 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 171.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -137.57 157.58 33.83 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.205 1.802 . . . . 0.0 108.092 178.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.08 175.08 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 N-CA-C 100.546 -3.872 . . . . 0.0 100.546 173.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -115.08 137.86 51.53 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.592 3.157 . . . . 0.0 106.194 168.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.413 ' HB2' ' HD2' ' A' ' 139' ' ' ARG . 17.5 m -140.63 -127.09 0.1 Allowed 'General case' 0 CA--C 1.502 -0.875 0 CA-C-N 121.009 1.731 . . . . 0.0 112.872 -178.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.511 ' CD ' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -92.82 -85.11 0.27 Allowed 'General case' 0 N--CA 1.428 -1.55 1 C-N-CA 134.184 4.994 . . . . 0.0 105.671 179.97 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.511 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 5.5 ptp180 -94.23 -9.06 37.43 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 128.376 2.67 . . . . 0.0 112.907 174.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.518 ' HA ' ' HB3' ' A' ' 57' ' ' GLU 0.508 0.4 OUTLIER -69.65 115.52 33.95 Favored Pre-proline 0 C--N 1.382 1.984 0 C-N-CA 129.407 3.083 . . . . 0.0 110.315 -177.688 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -88.1 109.3 0.61 Allowed 'Trans proline' 0 C--N 1.297 -2.173 0 CA-C-N 122.244 1.837 . . . . 0.0 113.479 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -176.86 66.88 0.09 OUTLIER Glycine 0 N--CA 1.477 1.432 0 N-CA-C 117.803 1.881 . . . . 0.0 117.803 163.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.09 114.03 7.0 Favored 'General case' 0 C--N 1.367 1.357 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -175.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 175.1 -173.81 0.08 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 131.437 3.895 . . . . 0.0 101.739 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . 0.314 74.1 m 149.92 134.35 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 129.245 3.018 . . . . 0.0 112.984 174.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 81.7 tttt 177.91 178.83 0.33 Allowed 'General case' 0 C--N 1.368 1.399 1 N-CA-C 99.714 -4.18 . . . . 0.0 99.714 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 59.81 118.42 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.969 1 N-CA-C 124.405 4.965 . . . . 0.0 124.405 156.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 38.2 t -112.62 110.62 32.86 Favored 'Isoleucine or valine' 0 C--N 1.37 1.466 0 O-C-N 118.712 -2.493 . . . . 0.0 115.784 -174.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.55 117.48 42.49 Favored 'Isoleucine or valine' 0 C--N 1.359 1.006 0 C-N-CA 127.803 2.441 . . . . 0.0 106.483 173.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.5 0.0 OUTLIER -122.69 153.88 38.82 Favored 'General case' 0 CA--C 1.478 -1.818 1 C-N-CA 132.527 4.331 . . . . 0.0 104.652 167.956 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . 0.339 9.2 t -70.65 97.9 1.42 Allowed 'General case' 0 N--CA 1.431 -1.375 1 CA-C-O 131.763 5.554 . . . . 0.0 117.932 -150.787 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.638 HE22 ' CE1' ' A' ' 73' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.42 -1.958 3 C-N-CA 148.359 10.663 . . . . 0.0 121.009 166.411 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ptt? . . . . . 0 C--O 1.233 0.21 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.3 m -156.82 133.29 9.97 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 175.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.3 mm -90.34 50.41 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.382 0 O-C-N 119.4 -2.062 . . . . 0.0 111.504 -175.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -49.41 -3.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.969 1 C-N-CA 135.435 5.494 . . . . 0.0 118.252 -175.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -60.81 2.05 Favored 'General case' 0 C--N 1.353 0.72 1 C-N-CA 133.602 4.761 . . . . 0.0 110.253 171.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -73.17 -17.28 61.39 Favored 'General case' 0 C--N 1.373 1.588 0 C-N-CA 126.815 2.046 . . . . 0.0 112.571 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . 0.253 0.6 OUTLIER -80.7 -36.61 15.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 127.133 2.173 . . . . 0.0 110.598 175.153 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -64.63 -46.25 83.39 Favored 'General case' 0 C--N 1.375 1.674 0 C-N-CA 128.344 2.657 . . . . 0.0 108.657 175.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.8 mt -54.59 -43.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.362 1.118 0 C-N-CA 126.279 1.831 . . . . 0.0 112.968 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.38 11.0 ttt180 -67.48 -42.91 82.2 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 171.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -60.27 -27.52 67.32 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 165.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -76.91 -50.72 12.66 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 130.315 3.446 . . . . 0.0 109.99 173.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -57.25 -29.22 63.63 Favored 'General case' 0 C--N 1.378 1.814 0 C-N-CA 128.234 2.614 . . . . 0.0 110.666 170.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.0 tp -72.08 -44.14 63.72 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 124.319 1.048 . . . . 0.0 113.664 168.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -54.9 -43.66 73.46 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.319 -1.488 . . . . 0.0 110.607 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.2 mtp85 -63.39 -46.1 87.99 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 166.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.38 -47.84 82.55 Favored 'General case' 0 C--N 1.384 2.077 0 C-N-CA 130.111 3.364 . . . . 0.0 113.268 175.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.514 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.91 -46.71 83.6 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 130.407 3.483 . . . . 0.0 110.732 176.212 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.93 -42.66 57.29 Favored 'General case' 0 C--N 1.377 1.765 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.7 m -68.31 -43.09 78.4 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 127.023 2.129 . . . . 0.0 112.281 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.507 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.409 43.8 mt-10 -74.55 -28.72 61.07 Favored 'General case' 0 C--N 1.364 1.208 0 O-C-N 120.442 -1.411 . . . . 0.0 112.223 169.334 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.256 0.6 OUTLIER -60.71 -34.07 73.83 Favored 'General case' 0 C--N 1.38 1.924 0 O-C-N 119.035 -2.291 . . . . 0.0 112.978 165.384 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.7 mtt85 -66.23 -35.81 81.38 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 120.648 -1.283 . . . . 0.0 112.101 166.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.44 ' CG ' ' CE1' ' A' ' 68' ' ' HIS . 8.6 tp-100 -60.8 -46.74 89.32 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 116.879 2.178 . . . . 0.0 116.879 166.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.557 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.2 mt -70.98 -45.07 74.81 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 O-C-N 120.657 -1.277 . . . . 0.0 111.756 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.646 0.5 OUTLIER -71.28 -23.68 62.01 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 119.346 -2.097 . . . . 0.0 114.929 175.203 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -73.11 -35.2 66.53 Favored 'General case' 0 C--N 1.384 2.085 0 O-C-N 121.244 -0.91 . . . . 0.0 110.822 169.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -66.51 -39.74 88.84 Favored 'General case' 0 C--N 1.391 2.408 0 O-C-N 119.127 -2.233 . . . . 0.0 112.002 169.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 1.4 mp -61.99 -46.32 96.75 Favored 'Isoleucine or valine' 0 C--N 1.37 1.457 0 CA-C-N 119.52 1.055 . . . . 0.0 113.567 172.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 -59.46 -39.96 85.33 Favored 'General case' 0 C--N 1.357 0.92 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 173.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -76.49 -44.71 34.19 Favored 'General case' 0 CA--C 1.487 -1.45 0 O-C-N 119.428 -2.045 . . . . 0.0 111.183 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.88 -44.84 60.83 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 124.764 1.226 . . . . 0.0 114.031 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.2 t -69.38 -28.8 66.49 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 120.106 -1.621 . . . . 0.0 110.899 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -75.75 -41.0 54.45 Favored 'General case' 0 C--N 1.389 2.309 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 165.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.22 -31.93 64.45 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 127.059 2.144 . . . . 0.0 114.809 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.67 -12.34 59.99 Favored 'General case' 0 C--N 1.382 1.99 0 O-C-N 121.107 -0.996 . . . . 0.0 111.691 166.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.66 18.16 60.58 Favored Glycine 0 C--N 1.381 3.065 0 O-C-N 120.813 -1.179 . . . . 0.0 114.813 168.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . 0.394 0.7 OUTLIER -99.2 178.88 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.168 0 C-N-CA 126.917 2.087 . . . . 0.0 110.344 -172.871 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 t -29.23 -55.11 0.14 Allowed 'General case' 0 N--CA 1.488 1.439 1 C-N-CA 132.127 4.171 . . . . 0.0 116.984 -174.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.29 3.2 t 82.46 111.65 0.06 Allowed 'General case' 0 C--N 1.359 1.009 0 C-N-CA 131.652 3.981 . . . . 0.0 108.638 -174.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.441 ' CZ ' HG11 ' A' ' 77' ' ' VAL . 3.9 p90 -113.24 158.42 20.51 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 122.347 1.07 . . . . 0.0 111.065 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -100.72 155.66 17.77 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 127.536 2.334 . . . . 0.0 105.371 175.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -119.34 126.02 50.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 O-C-N 120.442 -1.411 . . . . 0.0 108.596 -174.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -115.27 169.92 8.77 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-O 124.298 1.999 . . . . 0.0 108.038 174.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.546 ' CD2' HD11 ' A' ' 50' ' ' LEU 0.293 14.1 m-30 -107.99 172.13 7.01 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.3 2.24 . . . . 0.0 108.623 176.209 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.34 91.36 3.49 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 101.963 -3.347 . . . . 0.0 101.963 153.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . 0.321 0.0 OUTLIER -56.25 -10.46 0.88 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 127.631 2.373 . . . . 0.0 115.654 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.67 -38.74 28.47 Favored 'General case' 0 C--N 1.374 1.652 0 C-N-CA 129.031 2.932 . . . . 0.0 111.222 171.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -46.07 90.04 Favored 'General case' 0 C--N 1.372 1.552 0 CA-C-O 125.297 2.475 . . . . 0.0 108.377 167.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.546 HD11 ' CD2' ' A' ' 45' ' ' TYR 0.298 0.1 OUTLIER -62.9 -37.54 87.35 Favored 'General case' 0 C--O 1.21 -1.017 0 C-N-CA 127.474 2.31 . . . . 0.0 110.192 172.534 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -54.91 -32.74 61.42 Favored 'General case' 0 C--N 1.37 1.472 0 O-C-N 117.603 -3.186 . . . . 0.0 111.876 168.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -74.94 -58.01 3.55 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 158.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.4 -27.47 66.02 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 119.096 2.999 . . . . 0.0 119.096 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.485 ' CG1' HD22 ' A' ' 50' ' ' LEU . 29.8 mt -75.15 -48.62 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.761 0 C-N-CA 129.977 3.311 . . . . 0.0 110.709 172.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.62 -12.12 15.66 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -176.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -78.44 -3.5 43.66 Favored 'General case' 0 C--N 1.365 1.261 0 CA-C-N 122.347 2.339 . . . . 0.0 114.305 -174.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -157.86 -48.99 0.06 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.766 1.626 . . . . 0.0 111.346 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.542 0.2 OUTLIER 83.59 160.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.372 1.587 1 C-N-CA 131.97 4.108 . . . . 0.0 112.036 178.142 . . . . . . . . 4 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.5 t70 38.14 54.29 1.7 Allowed 'General case' 0 N--CA 1.513 2.685 0 C-N-CA 131.465 3.906 . . . . 0.0 114.642 -176.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.543 ' HA ' HH22 ' A' ' 139' ' ' ARG 0.484 10.4 pt-20 -75.92 66.03 2.09 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 125.499 2.571 . . . . 0.0 113.822 178.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.374 18.2 p -79.26 -16.85 55.82 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.925 2.89 . . . . 0.0 114.108 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -65.55 -33.95 77.12 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 129.652 3.181 . . . . 0.0 110.188 166.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.481 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -65.77 -46.68 88.24 Favored 'Isoleucine or valine' 0 C--N 1.362 1.116 0 C-N-CA 127.567 2.347 . . . . 0.0 109.888 -174.403 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.507 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 48.7 m-85 -62.41 -39.54 93.6 Favored 'General case' 0 C--O 1.21 -0.996 1 C-N-CA 132.572 4.349 . . . . 0.0 112.473 168.031 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -66.53 -45.41 79.54 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.724 2.056 . . . . 0.0 112.787 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.406 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.9 tm? -64.79 -49.3 71.22 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.974 1.309 . . . . 0.0 113.104 168.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.883 0.0 OUTLIER -76.38 -16.55 59.69 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 118.818 -2.426 . . . . 0.0 114.996 -176.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.557 ' CE1' HG12 ' A' ' 25' ' ' ILE . 54.5 m-70 -78.69 -27.57 45.1 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.729 2.412 . . . . 0.0 110.249 162.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -79.92 -18.98 49.15 Favored 'General case' 0 C--N 1.366 1.317 0 O-C-N 119.578 -1.951 . . . . 0.0 111.972 166.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.282 0.0 OUTLIER -97.62 -16.23 7.17 Favored 'Isoleucine or valine' 0 C--N 1.369 1.444 0 C-N-CA 127.168 2.187 . . . . 0.0 114.052 -177.348 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -52.15 -4.12 0.03 OUTLIER 'General case' 0 C--N 1.363 1.161 1 C-N-CA 133.973 4.909 . . . . 0.0 119.536 -175.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.262 29.7 t70 -95.77 -3.92 44.89 Favored 'General case' 0 N--CA 1.416 -2.146 1 C-N-CA 133.261 4.624 . . . . 0.0 108.373 178.783 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -57.56 -8.24 0.81 Allowed 'General case' 0 C--N 1.385 2.113 0 C-N-CA 130.282 3.433 . . . . 0.0 114.149 177.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.3 t -42.05 -32.04 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 128.654 2.782 . . . . 0.0 115.225 157.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.52 -37.46 50.89 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.856 2.462 . . . . 0.0 113.326 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.08 -35.81 72.0 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 119.471 -2.018 . . . . 0.0 111.21 172.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.441 HG11 ' CZ ' ' A' ' 41' ' ' PHE 0.541 16.4 t -72.33 -28.55 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.16 0 C-N-CA 129.933 3.293 . . . . 0.0 112.199 173.254 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.01 -43.89 81.72 Favored 'General case' 0 C--N 1.379 1.876 0 C-N-CA 129.914 3.286 . . . . 0.0 111.278 168.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -63.45 -35.77 81.54 Favored 'General case' 0 C--N 1.381 1.973 0 C-N-CA 126.273 1.829 . . . . 0.0 112.182 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.32 -39.14 89.41 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 127.023 2.129 . . . . 0.0 114.539 169.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -75.15 -13.91 60.51 Favored 'General case' 0 C--N 1.373 1.591 0 C-N-CA 130.464 3.506 . . . . 0.0 113.559 173.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . 0.307 22.6 p -75.45 -1.48 24.24 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 118.617 2.821 . . . . 0.0 118.617 -171.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.78 144.93 29.27 Favored Pre-proline 0 C--N 1.359 0.988 0 O-C-N 121.049 -1.032 . . . . 0.0 109.887 175.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -64.86 157.17 58.0 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 124.981 3.787 . . . . 0.0 110.291 166.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.427 ' HA ' ' HE3' ' A' ' 125' ' ' LYS 0.281 1.1 Cg_endo -48.83 144.72 14.48 Favored 'Trans proline' 0 C--N 1.36 1.154 1 C-N-CA 125.528 4.152 . . . . 0.0 122.446 -152.469 . . . . . . . . 4 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 91.4 mtm-85 -114.69 80.94 6.73 Favored Pre-proline 0 C--N 1.361 1.083 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 177.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -71.9 163.52 38.57 Favored 'Trans proline' 0 C--N 1.36 1.175 1 C-N-CA 128.25 5.967 . . . . 0.0 111.545 168.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -47.57 -22.46 0.49 Allowed 'General case' 0 C--N 1.357 0.914 1 C-N-CA 133.477 4.711 . . . . 0.0 116.491 177.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.2 pt -94.39 87.49 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.905 0 C-N-CA 131.4 3.88 . . . . 0.0 108.543 170.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . 0.413 ' HA ' ' HB ' ' A' ' 94' ' ' ILE . 1.3 m-20 -70.42 -8.08 48.12 Favored 'General case' 0 C--N 1.315 -0.901 2 CA-C-N 106.505 -4.861 . . . . 0.0 109.687 170.45 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -98.24 -31.94 11.81 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 126.268 1.827 . . . . 0.0 115.204 177.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -98.05 -10.94 23.52 Favored 'General case' 0 C--N 1.35 0.603 0 O-C-N 121.342 -0.849 . . . . 0.0 113.048 -177.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -125.38 -51.47 1.63 Allowed 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -176.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.413 ' HB ' ' HA ' ' A' ' 90' ' ' ASP 0.299 87.3 mt -78.81 94.3 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 CA-C-O 127.208 3.385 . . . . 0.0 114.355 -172.766 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -139.24 -38.0 0.5 Allowed 'General case' 0 CA--C 1.491 -1.308 1 CA-C-N 107.332 -4.485 . . . . 0.0 110.038 -173.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.51 7.05 65.75 Favored Glycine 0 C--N 1.359 1.845 0 C-N-CA 124.142 0.877 . . . . 0.0 110.943 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.41 ' CG1' ' CG2' ' A' ' 94' ' ' ILE 0.396 11.3 p -113.41 90.73 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.359 1.006 0 CA-C-O 125.724 2.678 . . . . 0.0 111.248 178.258 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -135.07 16.98 3.47 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 110.643 -2.98 . . . . 0.0 106.221 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -123.29 -51.74 1.86 Allowed 'General case' 0 C--N 1.346 0.44 0 C-N-CA 126.524 1.93 . . . . 0.0 113.19 -173.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 14.4 mtt-85 -99.5 115.84 65.37 Favored Pre-proline 0 C--N 1.358 0.975 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -170.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -76.2 156.01 37.61 Favored 'Trans proline' 0 C--N 1.363 1.33 1 C-N-CA 125.314 4.009 . . . . 0.0 111.987 171.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.53 -9.94 82.3 Favored Glycine 0 C--N 1.365 2.173 0 C-N-CA 127.062 2.268 . . . . 0.0 117.518 -173.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -141.31 155.14 46.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 126.363 1.865 . . . . 0.0 107.483 173.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.0 mt -110.66 140.46 44.99 Favored 'General case' 0 C--N 1.348 0.505 0 C-N-CA 127.011 2.125 . . . . 0.0 110.034 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -129.29 110.85 12.29 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 103.877 -2.638 . . . . 0.0 103.877 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 13.9 pt -134.9 139.68 46.91 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.4 m -126.69 111.16 13.95 Favored 'General case' 0 C--N 1.367 1.339 0 N-CA-C 104.234 -2.506 . . . . 0.0 104.234 -176.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -136.78 161.18 36.68 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 103.618 -2.734 . . . . 0.0 103.618 -171.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.406 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 82.65 -58.01 5.02 Favored Glycine 0 N--CA 1.484 1.846 0 O-C-N 120.072 -1.642 . . . . 0.0 116.837 169.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 162.11 -29.77 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.276 1 C-N-CA 136.344 5.858 . . . . 0.0 106.691 -167.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.408 ' HB3' HG22 ' A' ' 136' ' ' ILE 0.588 0.9 OUTLIER -79.67 137.42 37.07 Favored 'General case' 0 C--N 1.375 1.714 2 C-N-CA 132.33 4.252 . . . . 0.0 122.131 -176.858 . . . . . . . . 5 4 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -89.74 101.21 13.91 Favored 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 103.668 -2.716 . . . . 0.0 103.668 171.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.343 22.8 mt -94.23 137.49 33.34 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.1 2.16 . . . . 0.0 106.404 -178.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.82 132.69 8.51 Favored Glycine 0 C--N 1.349 1.268 0 O-C-N 119.761 -1.837 . . . . 0.0 110.372 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . 0.266 1.7 m-30 -120.47 140.13 51.86 Favored 'General case' 0 C--N 1.368 1.408 0 N-CA-C 101.407 -3.553 . . . . 0.0 101.407 172.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 92.5 m -124.82 151.84 44.7 Favored 'General case' 0 CA--C 1.49 -1.347 1 N-CA-C 99.833 -4.136 . . . . 0.0 99.833 171.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 45.4 t -74.33 156.61 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 126.47 1.908 . . . . 0.0 107.931 169.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.511 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.29 72.2 m -68.54 95.49 0.64 Allowed 'General case' 0 C--N 1.362 1.133 0 CA-C-O 123.849 1.785 . . . . 0.0 109.097 164.76 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -71.94 -40.09 7.58 Favored Pre-proline 0 N--CA 1.432 -1.374 0 C-N-CA 130.795 3.638 . . . . 0.0 112.875 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -74.29 59.74 4.69 Favored 'Trans proline' 0 CA--C 1.559 1.73 0 CA-C-N 127.028 3.546 . . . . 0.0 114.122 174.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.403 ' CG ' ' H ' ' A' ' 122' ' ' GLU 0.361 4.3 p30 -162.54 -80.55 0.04 OUTLIER 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.405 2.282 . . . . 0.0 110.502 173.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.403 ' H ' ' CG ' ' A' ' 121' ' ' ASN 0.403 23.9 tt0 19.52 88.29 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.7 2 C-N-CA 137.796 6.438 . . . . 0.0 122.498 -174.741 . . . . . . . . 4 3 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -118.66 0.51 11.51 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 129.821 3.248 . . . . 0.0 107.661 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -114.88 -144.46 0.39 Allowed 'General case' 0 C--N 1.349 0.567 0 C-N-CA 128.298 2.639 . . . . 0.0 112.791 -165.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.427 ' HE3' ' HA ' ' A' ' 85' ' ' PRO 0.264 7.9 mptt -116.84 -73.72 0.63 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 -178.593 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -152.98 92.03 3.36 Favored Pre-proline 0 C--N 1.353 0.752 0 CA-C-O 112.797 -3.478 . . . . 0.0 109.427 171.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -125.59 17.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.243 1 CA-C-N 130.678 4.849 . . . . 0.0 120.615 -174.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.6 t -147.56 148.21 30.91 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 156.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.2 mt -103.32 133.11 48.94 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 170.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 20.8 tt0 -91.29 44.04 1.17 Allowed 'General case' 0 C--N 1.369 1.427 0 CA-C-N 122.247 2.294 . . . . 0.0 112.355 -173.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 30.7 p 129.13 140.39 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 129.087 2.955 . . . . 0.0 106.748 -175.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -116.02 109.54 17.67 Favored 'General case' 0 N--CA 1.441 -0.914 1 N-CA-C 97.407 -5.034 . . . . 0.0 97.407 157.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.17 132.07 40.52 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 127.501 2.321 . . . . 0.0 107.662 -176.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.16 115.03 17.07 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.8 mt -141.58 129.78 22.35 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 CA-C-O 123.868 1.794 . . . . 0.0 106.397 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.408 HG22 ' HB3' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -118.88 179.39 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 124.829 2.252 . . . . 0.0 114.27 -170.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -143.5 136.07 27.27 Favored 'General case' 0 N--CA 1.442 -0.846 2 C-N-CA 134.994 5.318 . . . . 0.0 98.251 171.068 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.486 ' HB3' ' H ' ' A' ' 139' ' ' ARG . 1.0 OUTLIER -158.71 -110.45 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -169.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.614 ' CG ' ' H ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -113.04 -83.68 0.59 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.184 2.593 . . . . 0.0 111.041 -166.403 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.614 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 1.0 OUTLIER -86.16 7.84 23.37 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 131.556 3.942 . . . . 0.0 109.695 169.161 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.422 ' HG ' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER -76.56 163.65 64.59 Favored Pre-proline 0 CA--C 1.572 1.827 0 CA-C-O 115.82 -2.038 . . . . 0.0 106.741 -169.364 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -51.57 -33.84 49.88 Favored 'Trans proline' 0 N--CA 1.477 0.534 3 C-N-CA 125.736 4.291 . . . . 0.0 122.686 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -174.55 -163.05 27.18 Favored Glycine 0 N--CA 1.432 -1.61 0 C-N-CA 126.198 1.856 . . . . 0.0 109.898 -177.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -120.79 149.42 42.58 Favored 'General case' 0 N--CA 1.433 -1.322 1 C-N-CA 134.209 5.004 . . . . 0.0 111.555 -176.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -126.68 -154.96 0.66 Allowed 'General case' 0 C--N 1.357 0.894 0 C-N-CA 128.446 2.698 . . . . 0.0 110.208 -179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 83.5 p -98.69 -138.38 0.3 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 126.608 1.963 . . . . 0.0 112.668 -177.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -165.35 109.47 0.86 Allowed 'General case' 0 C--N 1.359 0.998 0 O-C-N 119.59 -1.944 . . . . 0.0 108.504 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.331 . . -135.5 32.4 3.07 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 29.3 m -66.69 116.31 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.072 1 C-N-CA 133.95 4.9 . . . . 0.0 118.199 -169.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 1.4 pt -94.37 143.32 11.94 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 C-N-CA 130.411 3.484 . . . . 0.0 106.455 170.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.412 46.4 mtpt -120.56 148.67 43.56 Favored 'General case' 0 CA--C 1.496 -1.115 1 N-CA-C 96.977 -5.194 . . . . 0.0 96.977 162.804 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 6.4 t -74.61 144.06 44.08 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 121.035 3.717 . . . . 0.0 121.035 -131.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 . . . . . 0 C--O 1.264 1.852 2 CA-C-N 105.926 -5.125 . . . . 0.0 110.655 -172.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.8 mtt . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.0 m -69.5 117.74 11.5 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 126.842 2.057 . . . . 0.0 113.755 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.8 mm -81.27 66.61 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.31 0 CA-C-O 125.054 2.359 . . . . 0.0 113.006 -177.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.45 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 6.2 t-20 -97.47 9.37 42.56 Favored 'General case' 0 C--O 1.222 -0.363 1 C-N-CA 133.533 4.733 . . . . 0.0 109.442 178.154 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -64.7 0.84 Allowed 'General case' 0 C--N 1.355 0.826 0 C-N-CA 130.583 3.553 . . . . 0.0 112.058 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -71.45 -12.02 61.18 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 125.554 1.541 . . . . 0.0 113.241 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.45 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.6 OUTLIER -81.2 -39.31 17.32 Favored 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 127.829 2.452 . . . . 0.0 110.22 174.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -66.1 -42.81 88.76 Favored 'General case' 0 C--N 1.371 1.505 0 C-N-CA 129.047 2.939 . . . . 0.0 109.114 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.2 -43.36 89.45 Favored 'Isoleucine or valine' 0 C--N 1.377 1.766 0 C-N-CA 125.348 1.459 . . . . 0.0 111.297 165.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.25 0.0 OUTLIER -58.52 -50.61 73.15 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 169.52 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -56.34 -26.14 51.54 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 117.915 -2.991 . . . . 0.0 115.404 166.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -77.12 -38.23 52.57 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 118.928 -2.358 . . . . 0.0 113.731 165.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.467 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 8.4 mmmt -65.07 -27.78 69.01 Favored 'General case' 0 C--N 1.372 1.557 1 CA-C-O 129.078 4.275 . . . . 0.0 107.376 170.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.45 HD11 HG13 ' A' ' 54' ' ' ILE . 0.3 OUTLIER -71.55 -46.38 59.65 Favored 'General case' 0 C--O 1.206 -1.219 0 O-C-N 116.634 -3.791 . . . . 0.0 112.479 166.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -55.76 -27.6 51.67 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.632 2.086 . . . . 0.0 116.632 167.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.467 ' HG3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -69.88 -49.79 48.82 Favored 'General case' 0 C--N 1.397 2.647 0 CA-C-N 121.842 2.11 . . . . 0.0 112.896 168.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.55 -28.67 30.83 Favored 'General case' 0 C--N 1.364 1.218 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -177.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.447 ' CE1' ' CD1' ' A' ' 50' ' ' LEU . 0.5 OUTLIER -67.67 -53.92 23.81 Favored 'General case' 0 C--O 1.204 -1.339 0 C-N-CA 127.746 2.418 . . . . 0.0 106.547 172.45 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -74.14 -39.77 63.06 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 119.969 3.322 . . . . 0.0 119.969 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 t -73.21 -41.94 63.21 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.531 -1.356 . . . . 0.0 113.858 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . 0.522 3.4 tt0 -77.86 -28.51 50.07 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 120.109 -1.62 . . . . 0.0 112.803 176.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -72.6 -27.81 62.4 Favored 'General case' 0 C--N 1.381 1.955 0 O-C-N 118.772 -2.455 . . . . 0.0 112.828 170.152 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.8 mtt85 -66.93 -36.84 83.14 Favored 'General case' 0 C--N 1.378 1.807 0 C-N-CA 125.612 1.565 . . . . 0.0 110.156 164.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -63.02 -43.02 99.89 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 8.0 mt -69.83 -45.34 77.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.396 0 CA-C-N 120.009 1.277 . . . . 0.0 111.859 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.526 13.2 p30 -69.12 -24.22 64.09 Favored 'General case' 0 C--N 1.379 1.883 0 O-C-N 119.842 -1.786 . . . . 0.0 115.335 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -73.84 -47.21 40.01 Favored 'General case' 0 C--N 1.378 1.839 0 C-N-CA 126.926 2.09 . . . . 0.0 110.044 169.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -30.9 70.94 Favored 'General case' 0 C--N 1.398 2.716 0 O-C-N 117.697 -3.127 . . . . 0.0 112.95 174.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.407 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 3.2 mt -63.3 -48.63 86.51 Favored 'Isoleucine or valine' 0 C--N 1.378 1.835 0 C-N-CA 124.675 1.19 . . . . 0.0 112.508 171.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.4 ttt85 -64.37 -37.87 89.03 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 122.34 2.336 . . . . 0.0 115.465 176.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -76.5 -38.16 55.66 Favored 'General case' 0 CA--C 1.473 -1.984 0 C-N-CA 127.157 2.183 . . . . 0.0 112.344 -177.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.56 -43.51 14.43 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.391 1.5 p -66.79 -30.73 71.01 Favored 'General case' 0 C--N 1.359 1.01 0 O-C-N 120.583 -1.323 . . . . 0.0 112.85 -179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -72.04 -46.58 56.47 Favored 'General case' 0 C--N 1.375 1.68 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 162.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.72 -26.16 66.02 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 116.058 1.873 . . . . 0.0 116.058 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.57 -14.49 62.87 Favored 'General case' 0 C--N 1.376 1.738 0 C-N-CA 127.031 2.132 . . . . 0.0 112.489 166.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.41 17.63 30.81 Favored Glycine 0 C--N 1.377 2.826 0 O-C-N 121.317 -0.864 . . . . 0.0 113.291 169.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.466 HG23 HD11 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -115.82 164.1 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 -176.479 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.308 0.3 OUTLIER -26.4 -57.52 0.08 Allowed 'General case' 0 C--N 1.361 1.105 1 C-N-CA 133.764 4.826 . . . . 0.0 119.429 -175.441 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.8 t 103.47 122.19 0.01 OUTLIER 'General case' 0 C--N 1.352 0.686 1 C-N-CA 132.103 4.161 . . . . 0.0 107.263 -172.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.407 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 44.8 p90 -113.65 160.53 18.5 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-O 123.037 1.399 . . . . 0.0 112.558 -173.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -110.79 145.76 37.57 Favored 'General case' 0 C--N 1.352 0.681 0 C-N-CA 127.319 2.248 . . . . 0.0 109.481 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 15.8 tp -126.35 154.89 42.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 118.897 -2.377 . . . . 0.0 106.665 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -132.37 172.66 12.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 O-C-N 120.202 -1.561 . . . . 0.0 111.016 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.611 ' CD2' HD11 ' A' ' 50' ' ' LEU 0.269 4.3 m-30 -93.49 172.02 8.53 Favored 'General case' 0 CA--C 1.558 1.262 0 CA-C-O 123.125 1.44 . . . . 0.0 109.197 168.17 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.3 t -127.03 98.62 5.39 Favored 'General case' 0 C--N 1.349 0.551 0 N-CA-C 101.562 -3.495 . . . . 0.0 101.562 157.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.489 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.486 0.0 OUTLIER -61.58 -10.54 8.37 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 -177.217 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.05 -46.6 13.69 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.851 2.46 . . . . 0.0 111.001 171.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -48.49 81.53 Favored 'General case' 0 C--N 1.373 1.625 0 C-N-CA 127.401 2.28 . . . . 0.0 110.153 170.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.611 HD11 ' CD2' ' A' ' 45' ' ' TYR 0.252 6.2 tt -64.25 -33.4 75.72 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 112.54 -2.118 . . . . 0.0 112.553 172.56 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -56.82 -30.09 63.4 Favored 'General case' 0 C--N 1.368 1.395 0 CA-C-N 121.033 1.742 . . . . 0.0 112.109 166.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -84.29 -45.14 13.14 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 162.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.24 75.18 Favored 'General case' 0 C--N 1.371 1.501 0 CA-C-N 123.05 2.659 . . . . 0.0 114.005 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.45 HG13 HD11 ' A' ' 14' ' ' LEU . 1.2 tt -48.51 -34.45 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 131.075 3.75 . . . . 0.0 116.658 177.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.418 ' HA ' HG22 ' A' ' 58' ' ' ILE . 9.8 mt-30 -92.16 -9.44 42.41 Favored 'General case' 0 C--N 1.362 1.127 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 173.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -94.28 -47.22 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 127.213 2.205 . . . . 0.0 108.733 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -85.86 -3.27 58.87 Favored 'General case' 0 CA--C 1.492 -1.287 1 C-N-CA 132.003 4.121 . . . . 0.0 117.997 -176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.418 HG22 ' HA ' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -17.82 -3.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.063 2 N-CA-C 125.71 5.448 . . . . 0.0 125.71 -177.738 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 44.6 t0 142.86 37.91 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.5 1 C-N-CA 134.798 5.239 . . . . 0.0 105.15 -166.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.323 54.7 mm-40 -89.67 85.36 6.43 Favored 'General case' 0 CA--C 1.472 -2.032 0 C-N-CA 131.142 3.777 . . . . 0.0 105.933 175.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.475 0.1 OUTLIER -79.7 -11.32 59.86 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 127.908 2.483 . . . . 0.0 114.086 176.021 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . 0.281 0.7 OUTLIER -61.83 -34.76 76.53 Favored 'General case' 0 N--CA 1.479 1.021 1 C-N-CA 133.896 4.878 . . . . 0.0 111.347 169.233 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . 0.303 0.5 OUTLIER -73.42 -49.76 34.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 C-N-CA 131.373 3.869 . . . . 0.0 106.993 -167.313 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.524 ' HA ' ' CD2' ' A' ' 67' ' ' PHE 0.257 30.7 m-85 -71.23 -29.82 65.59 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 130.928 3.691 . . . . 0.0 112.899 168.5 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.1 -41.74 94.65 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 122.018 2.19 . . . . 0.0 112.185 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.512 HD22 ' HZ2' ' A' ' 151' ' ' LYS . 1.9 tm? -64.17 -40.31 95.85 Favored 'General case' 0 CA--C 1.578 2.024 0 C-N-CA 126.246 1.818 . . . . 0.0 112.113 167.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.524 ' CD2' ' HA ' ' A' ' 64' ' ' PHE . 2.2 m-85 -74.36 -17.53 60.81 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 117.925 -2.984 . . . . 0.0 113.351 174.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CD2' ' O ' ' A' ' 64' ' ' PHE 0.355 57.8 m-70 -85.83 -17.04 36.8 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 128.211 2.604 . . . . 0.0 109.671 172.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -75.25 -40.27 59.05 Favored 'General case' 0 C--N 1.371 1.513 0 CA-C-O 118.07 -0.967 . . . . 0.0 111.652 156.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.414 HD13 ' HB2' ' A' ' 151' ' ' LYS . 1.6 mm -52.68 -46.24 49.69 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.787 0 C-N-CA 129.251 3.02 . . . . 0.0 114.617 172.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.6 pttp -50.66 -7.95 0.04 OUTLIER 'General case' 0 CA--C 1.491 -1.296 1 C-N-CA 132.591 4.356 . . . . 0.0 121.232 -160.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -106.62 -16.74 14.43 Favored 'General case' 0 N--CA 1.44 -0.975 0 O-C-N 119.932 -1.73 . . . . 0.0 107.854 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.676 ' CD2' ' HB ' ' A' ' 152' ' ' THR 0.286 1.0 OUTLIER -80.57 16.85 1.24 Allowed 'General case' 0 C--N 1.383 2.062 0 C-N-CA 128.229 2.611 . . . . 0.0 113.484 -178.497 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 78.6 t -40.2 -42.64 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.97 0 C-N-CA 129.658 3.183 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.64 -31.39 70.6 Favored 'General case' 0 C--N 1.364 1.217 0 C-N-CA 127.354 2.262 . . . . 0.0 116.205 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -76.25 -45.64 31.81 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 129.037 2.935 . . . . 0.0 113.139 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.363 4.9 p -66.3 -29.63 47.26 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.321 0 CA-C-O 126.562 3.077 . . . . 0.0 111.221 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.415 ' HB3' HG12 ' A' ' 38' ' ' VAL . 5.5 m120 -73.77 -31.37 63.27 Favored 'General case' 0 C--N 1.354 0.762 0 O-C-N 118.622 -2.548 . . . . 0.0 115.353 169.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -67.08 -30.51 70.57 Favored 'General case' 0 C--N 1.37 1.469 0 CA-C-N 120.734 1.606 . . . . 0.0 110.697 168.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.28 -36.33 83.76 Favored 'General case' 0 CA--C 1.572 1.812 0 C-N-CA 125.029 1.332 . . . . 0.0 113.205 167.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.466 HD11 HG23 ' A' ' 38' ' ' VAL . 10.1 tt -75.37 -44.58 44.19 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 168.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.8 m -64.9 3.43 0.56 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 120.623 3.564 . . . . 0.0 120.623 -162.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.486 ' HE1' ' H ' ' A' ' 96' ' ' GLY . 5.8 ptm -68.33 166.77 22.32 Favored Pre-proline 0 CA--C 1.563 1.48 0 C-N-CA 127.586 2.355 . . . . 0.0 114.498 174.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -64.25 -178.35 0.62 Allowed 'Trans proline' 0 CA--C 1.564 1.977 1 C-N-CA 126.483 4.789 . . . . 0.0 111.933 167.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -60.1 134.26 55.1 Favored 'Trans proline' 0 C--N 1.382 2.309 1 CA-C-N 134.504 6.216 . . . . 0.0 113.868 -171.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.5 tpt180 -26.8 -55.37 0.21 Allowed Pre-proline 0 C--N 1.367 1.34 1 C-N-CA 131.877 4.071 . . . . 0.0 116.168 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -72.76 162.61 40.73 Favored 'Trans proline' 0 N--CA 1.447 -1.216 1 C-N-CA 125.578 4.185 . . . . 0.0 122.322 172.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.269 0.5 OUTLIER -107.95 -45.51 3.96 Favored 'General case' 0 N--CA 1.47 0.53 1 CA-C-N 106.404 -4.907 . . . . 0.0 106.259 134.288 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.509 ' H ' ' HB2' ' A' ' 93' ' ' PHE . 2.3 mt -119.73 -22.33 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.0 1 C-N-CA 132.798 4.439 . . . . 0.0 114.126 -178.21 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.7 t70 75.44 -39.67 0.4 Allowed 'General case' 0 C--N 1.317 -0.822 1 C-N-CA 133.433 4.693 . . . . 0.0 112.657 -170.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -87.18 -22.48 25.27 Favored 'General case' 0 C--N 1.36 1.024 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -175.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -123.17 -4.14 8.46 Favored 'General case' 0 N--CA 1.436 -1.161 0 C-N-CA 125.066 1.346 . . . . 0.0 110.74 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.509 ' HB2' ' H ' ' A' ' 89' ' ' ILE . 14.4 m-85 -147.91 110.4 4.67 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 124.122 0.969 . . . . 0.0 113.497 -174.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.48 HG21 ' HB ' ' A' ' 97' ' ' VAL 0.385 31.5 mt -116.31 89.45 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.113 0 C-N-CA 130.018 3.327 . . . . 0.0 103.218 170.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -45.32 -56.15 5.22 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 121.101 3.741 . . . . 0.0 121.101 -167.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.486 ' H ' ' HE1' ' A' ' 83' ' ' MET . . . -102.42 33.77 6.28 Favored Glycine 0 C--N 1.347 1.175 0 C-N-CA 125.84 1.685 . . . . 0.0 110.463 172.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.48 ' HB ' HG21 ' A' ' 94' ' ' ILE 0.26 0.4 OUTLIER -113.69 142.27 26.81 Favored 'Isoleucine or valine' 0 C--N 1.365 1.246 0 CA-C-O 123.909 1.814 . . . . 0.0 109.788 174.928 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -64.44 22.95 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.687 1 C-N-CA 133.036 4.534 . . . . 0.0 116.906 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.419 13.8 p90 50.31 31.3 5.14 Favored 'General case' 0 C--N 1.356 0.887 1 C-N-CA 132.299 4.24 . . . . 0.0 118.742 175.621 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -112.06 168.04 8.24 Favored Pre-proline 0 N--CA 1.442 -0.864 0 C-N-CA 129.631 3.172 . . . . 0.0 106.252 176.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.71 152.13 47.28 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.063 3.175 . . . . 0.0 111.444 169.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.92 45.3 0.55 Allowed Glycine 0 C--N 1.358 1.778 0 C-N-CA 127.22 2.343 . . . . 0.0 118.15 -172.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -131.36 140.31 49.68 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 126.544 1.938 . . . . 0.0 108.877 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mp -122.56 150.63 42.34 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 127.7 2.4 . . . . 0.0 113.451 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -129.52 113.08 14.42 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 127.432 2.293 . . . . 0.0 105.397 -174.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.463 HD12 ' CE1' ' A' ' 115' ' ' PHE 0.283 1.2 pt -134.85 132.83 53.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -175.045 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.511 ' H ' ' C ' ' A' ' 150' ' ' ILE 0.255 0.4 OUTLIER -139.73 127.59 22.05 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 119.973 -1.704 . . . . 0.0 111.416 -175.211 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 171.41 169.62 0.09 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 101.431 -3.544 . . . . 0.0 101.431 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.466 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.97 -33.97 4.62 Favored Glycine 0 N--CA 1.491 2.328 0 O-C-N 120.038 -1.663 . . . . 0.0 112.855 -173.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 121.05 -13.47 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.17 1 C-N-CA 137.659 6.384 . . . . 0.0 108.004 -168.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.418 ' CD2' ' HG ' ' A' ' 66' ' ' LEU 0.788 0.0 OUTLIER -83.12 135.19 34.91 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 119.752 3.241 . . . . 0.0 119.752 -179.036 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -91.87 100.78 13.39 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 104.872 -2.269 . . . . 0.0 104.872 171.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.43 HD12 ' CE1' ' A' ' 67' ' ' PHE 0.269 3.5 mm? -95.98 132.89 40.83 Favored 'General case' 0 CA--C 1.558 1.268 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 174.28 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -118.36 128.78 7.88 Favored Glycine 0 C--N 1.351 1.392 0 N-CA-C 105.131 -3.188 . . . . 0.0 105.131 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.463 ' CE1' HD12 ' A' ' 106' ' ' ILE 0.258 6.0 m-30 -125.92 151.33 47.1 Favored 'General case' 0 C--N 1.366 1.289 0 CA-C-N 122.465 3.133 . . . . 0.0 102.797 -179.437 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.8 m -151.02 131.67 13.96 Favored 'General case' 0 CA--C 1.481 -1.697 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.401 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 13.6 t -69.05 142.85 15.63 Favored 'Isoleucine or valine' 0 C--N 1.371 1.511 0 C-N-CA 128.871 2.869 . . . . 0.0 107.494 172.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.362 87.4 m -51.05 110.91 0.48 Allowed 'General case' 0 C--N 1.375 1.692 0 CA-C-O 125.317 2.484 . . . . 0.0 116.99 -177.443 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.04 -39.12 7.89 Favored Pre-proline 0 N--CA 1.442 -0.863 0 CA-C-O 115.45 -2.214 . . . . 0.0 114.072 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.95 52.37 4.23 Favored 'Trans proline' 0 CA--C 1.556 1.601 0 CA-C-N 127.049 3.553 . . . . 0.0 114.786 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.97 177.22 3.8 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -173.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.423 ' C ' ' H ' ' A' ' 124' ' ' PHE . 12.8 tt0 -87.5 -67.25 0.84 Allowed 'General case' 0 C--N 1.371 1.526 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 156.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.441 5.3 mptp? 50.39 -19.28 0.0 OUTLIER 'General case' 0 N--CA 1.424 -1.732 1 C-N-CA 138.666 6.786 . . . . 0.0 118.421 -178.668 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.423 ' H ' ' C ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER 107.34 -143.13 0.0 OUTLIER 'General case' 0 C--N 1.369 1.423 1 C-N-CA 132.754 4.422 . . . . 0.0 109.734 175.718 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.495 0.0 OUTLIER -102.82 -54.37 2.65 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.58 1.552 . . . . 0.0 110.481 -177.057 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.333 0.0 OUTLIER -26.73 -74.96 0.03 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 133.786 4.834 . . . . 0.0 117.858 166.145 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.659 0.0 OUTLIER 52.45 -177.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.384 2.406 1 N-CA-C 122.97 4.181 . . . . 0.0 122.97 145.328 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 2.1 p -124.88 152.7 43.69 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.401 ' HA ' ' HA ' ' A' ' 117' ' ' VAL . 1.0 OUTLIER -102.03 128.69 48.36 Favored 'General case' 0 C--N 1.359 1.021 1 N-CA-C 97.105 -5.146 . . . . 0.0 97.105 172.641 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.484 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 30.9 tt0 -80.6 1.81 28.25 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 128.048 2.539 . . . . 0.0 113.11 -154.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 21.8 p 163.49 146.08 0.01 OUTLIER 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 32.8 ttt85 -115.05 122.04 44.93 Favored 'General case' 0 N--CA 1.429 -1.484 1 N-CA-C 99.892 -4.114 . . . . 0.0 99.892 162.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 3.6 ttt -93.14 125.28 37.66 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 102.192 -3.262 . . . . 0.0 102.192 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.18 112.84 14.98 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.77 144.48 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.131 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.89 175.84 5.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 115.629 1.715 . . . . 0.0 115.629 -170.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.401 ' HA ' ' HB2' ' A' ' 141' ' ' LEU . 0.4 OUTLIER -158.94 71.76 0.54 Allowed 'General case' 0 C--N 1.367 1.354 1 C-N-CA 136.694 5.998 . . . . 0.0 108.105 172.546 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.424 ' H ' ' HG ' ' A' ' 141' ' ' LEU . 7.5 t -67.7 -50.0 59.8 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-O 124.038 1.875 . . . . 0.0 110.085 174.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.27 -56.63 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 110.648 -2.978 . . . . 0.0 109.267 -175.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -109.21 14.98 23.53 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.183 2.593 . . . . 0.0 115.603 -173.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.481 ' CD2' ' N ' ' A' ' 141' ' ' LEU . 0.1 OUTLIER -103.95 102.6 32.54 Favored Pre-proline 0 C--N 1.369 1.437 0 C-N-CA 128.01 2.524 . . . . 0.0 107.163 -163.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -68.3 49.71 0.48 Allowed 'Trans proline' 0 CA--C 1.541 0.872 1 C-N-CA 126.578 4.852 . . . . 0.0 121.181 -166.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -93.62 -121.07 3.16 Favored Glycine 0 C--N 1.313 -0.747 1 C-N-CA 131.619 4.438 . . . . 0.0 117.425 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -109.18 -178.27 3.52 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 127.039 2.136 . . . . 0.0 112.744 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -138.31 97.75 3.45 Favored 'General case' 0 C--N 1.357 0.921 0 O-C-N 120.275 -1.515 . . . . 0.0 106.966 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 22.5 t -179.85 -166.63 0.08 Allowed 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 -175.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 54.0 tttp 173.02 133.62 0.03 OUTLIER 'General case' 0 C--N 1.349 0.576 1 C-N-CA 132.8 4.44 . . . . 0.0 103.583 178.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -150.53 -80.3 0.12 Allowed 'General case' 0 C--N 1.359 0.984 0 N-CA-C 117.87 2.544 . . . . 0.0 117.87 -169.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . 0.311 29.1 m -90.32 -142.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.334 0 N-CA-C 118.833 2.901 . . . . 0.0 118.833 -172.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.516 HD11 ' H ' ' A' ' 152' ' ' THR . 0.0 OUTLIER -131.16 127.14 60.26 Favored 'Isoleucine or valine' 0 C--N 1.376 1.722 0 N-CA-C 121.25 3.796 . . . . 0.0 121.25 -178.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . 0.512 ' HZ2' HD22 ' A' ' 66' ' ' LEU 0.458 0.0 OUTLIER -123.15 101.51 7.44 Favored 'General case' 0 C--N 1.401 2.813 2 N-CA-C 126.64 5.792 . . . . 0.0 126.64 153.488 . . . . . . . . 5 4 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.676 ' HB ' ' CD2' ' A' ' 73' ' ' HIS 0.451 68.2 p -121.8 100.57 7.07 Favored 'General case' 0 CA--C 1.457 -2.621 2 O-C-N 115.382 -4.574 . . . . 0.0 105.764 152.316 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.493 HE21 ' C ' ' A' ' 153' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.389 -3.5 0 N-CA-C 103.759 -2.682 . . . . 0.0 103.759 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.5 mtt . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 106.44 -1.689 . . . . 0.0 106.44 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.9 p -85.95 81.49 8.5 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.506 2.323 . . . . 0.0 113.757 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.4 mm -84.77 -57.03 4.73 Favored 'Isoleucine or valine' 0 C--N 1.367 1.337 0 N-CA-C 117.084 2.253 . . . . 0.0 117.084 -171.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.44 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 13.2 m-80 24.28 16.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 2 C-N-CA 137.666 6.386 . . . . 0.0 122.228 -178.047 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.2 p -91.25 -68.17 0.81 Allowed 'General case' 0 N--CA 1.466 0.34 1 C-N-CA 133.071 4.548 . . . . 0.0 112.702 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.64 -13.51 62.11 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 127.261 2.225 . . . . 0.0 111.858 176.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.44 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -82.19 -36.26 13.74 Favored 'Isoleucine or valine' 0 C--N 1.359 1.006 0 C-N-CA 129.814 3.246 . . . . 0.0 108.965 175.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -68.07 -42.67 80.1 Favored 'General case' 0 C--N 1.373 1.627 0 C-N-CA 128.553 2.741 . . . . 0.0 109.144 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.3 mt -61.64 -43.1 96.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.386 0 C-N-CA 126.945 2.098 . . . . 0.0 110.722 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.315 0.7 OUTLIER -62.88 -44.66 95.52 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 171.279 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -62.97 -30.38 71.54 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 166.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -76.65 -50.97 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 128.316 2.646 . . . . 0.0 111.794 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.535 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmtt -62.32 -29.71 70.64 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.518 2.727 . . . . 0.0 109.92 174.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.42 ' CD1' ' HA ' ' A' ' 54' ' ' ILE . 0.7 OUTLIER -66.64 -51.79 52.32 Favored 'General case' 0 C--N 1.369 1.442 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.789 164.475 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -54.62 -37.77 66.01 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 120.173 1.351 . . . . 0.0 112.63 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.535 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.28 0.9 OUTLIER -71.88 -41.64 67.75 Favored 'General case' 0 C--N 1.392 2.44 0 O-C-N 120.407 -1.433 . . . . 0.0 112.508 171.48 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -57.92 -44.64 86.99 Favored 'General case' 0 C--N 1.388 2.242 0 C-N-CA 129.116 2.966 . . . . 0.0 111.775 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.46 ' HA ' ' CE1' ' A' ' 64' ' ' PHE . 0.4 OUTLIER -66.54 -55.28 16.25 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 128.773 2.829 . . . . 0.0 111.513 -178.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -75.12 -32.98 61.53 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 177.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -73.68 -40.81 63.39 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 126.047 1.739 . . . . 0.0 113.513 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.42 -28.78 62.17 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 125.666 1.586 . . . . 0.0 108.626 170.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.481 ' CZ ' ' CE2' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -57.24 -42.27 81.16 Favored 'General case' 0 C--N 1.377 1.774 0 C-N-CA 124.789 1.236 . . . . 0.0 113.901 165.545 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -59.56 -37.92 79.72 Favored 'General case' 0 C--N 1.377 1.803 0 C-N-CA 124.613 1.165 . . . . 0.0 111.612 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -58.3 -49.27 77.75 Favored 'General case' 0 C--N 1.372 1.581 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.0 mt -66.32 -42.52 90.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 O-C-N 120.53 -1.356 . . . . 0.0 111.709 176.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -73.97 -27.08 60.81 Favored 'General case' 0 C--N 1.372 1.561 0 O-C-N 121.459 -0.776 . . . . 0.0 111.652 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -70.82 -35.98 72.73 Favored 'General case' 0 C--N 1.375 1.703 0 C-N-CA 126.084 1.754 . . . . 0.0 110.687 172.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -69.83 -37.29 76.17 Favored 'General case' 0 C--N 1.383 2.058 0 O-C-N 120.722 -1.236 . . . . 0.0 113.538 170.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.481 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 5.2 mt -65.11 -50.29 75.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 C-N-CA 124.707 1.203 . . . . 0.0 113.322 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -63.01 -32.79 74.23 Favored 'General case' 0 C--N 1.361 1.101 0 CA-C-N 121.778 2.081 . . . . 0.0 114.429 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -77.33 -43.64 32.33 Favored 'General case' 0 C--N 1.376 1.748 0 O-C-N 118.521 -2.612 . . . . 0.0 111.699 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.12 -41.05 64.42 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 124.316 1.046 . . . . 0.0 113.643 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -71.42 -28.84 64.27 Favored 'General case' 0 C--N 1.352 0.705 0 C-N-CA 125.484 1.513 . . . . 0.0 111.448 175.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -77.92 -38.29 45.85 Favored 'General case' 0 C--N 1.387 2.234 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 166.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.86 62.48 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 126.838 2.055 . . . . 0.0 114.592 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.8 -10.04 59.1 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 124.531 1.133 . . . . 0.0 111.753 166.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.11 17.96 56.67 Favored Glycine 0 C--N 1.379 2.93 0 O-C-N 121.122 -0.986 . . . . 0.0 114.675 167.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . 0.504 0.6 OUTLIER -94.37 -179.46 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.74 0 C-N-CA 125.814 1.646 . . . . 0.0 114.169 -173.346 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -43.87 -50.43 7.98 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 130.645 3.578 . . . . 0.0 115.658 -177.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.313 1.5 t 90.51 125.82 0.03 OUTLIER 'General case' 0 C--N 1.36 1.039 1 C-N-CA 133.492 4.717 . . . . 0.0 110.489 -177.548 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.481 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 3.5 p90 -112.6 154.0 26.69 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 124.701 1.2 . . . . 0.0 109.308 -174.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.79 162.93 23.23 Favored 'General case' 0 CA--C 1.494 -1.19 0 CA-C-O 122.868 1.318 . . . . 0.0 111.133 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.66 138.17 52.8 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 120.983 -1.073 . . . . 0.0 109.373 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -132.04 141.85 49.36 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 165.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.555 ' CZ ' HD13 ' A' ' 50' ' ' LEU . 1.8 m-85 -101.11 153.8 19.27 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 123.395 1.569 . . . . 0.0 109.563 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 72.6 m -131.8 90.03 2.78 Favored 'General case' 0 CA--C 1.499 -0.993 1 N-CA-C 99.495 -4.261 . . . . 0.0 99.495 168.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -47.79 -9.59 0.02 OUTLIER 'General case' 0 C--O 1.191 -2.025 0 CA-C-O 112.764 -3.493 . . . . 0.0 119.781 -168.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.05 61.45 Favored 'General case' 0 N--CA 1.5 2.032 1 CA-C-N 129.487 5.585 . . . . 0.0 119.933 -176.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.508 HD11 ' H ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -64.12 -42.77 96.71 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 130.646 3.578 . . . . 0.0 111.622 172.402 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.555 HD13 ' CZ ' ' A' ' 45' ' ' TYR . 1.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 129.381 3.072 . . . . 0.0 109.099 171.287 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 47' ' ' GLN . 98.7 m-20 -58.89 -33.96 71.1 Favored 'General case' 0 C--N 1.365 1.268 0 C-N-CA 130.856 3.663 . . . . 0.0 110.699 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -74.71 -33.11 62.34 Favored 'General case' 0 C--N 1.364 1.225 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 164.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.41 -33.21 58.83 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 119.096 -2.252 . . . . 0.0 116.504 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.514 ' CG1' HD22 ' A' ' 50' ' ' LEU . 54.2 mt -63.34 -44.4 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.626 1 C-N-CA 133.746 4.818 . . . . 0.0 111.38 175.506 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.2 -24.91 11.32 Favored 'General case' 0 C--N 1.366 1.288 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 173.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -83.58 -17.09 42.88 Favored 'General case' 0 C--N 1.363 1.179 0 CA-C-N 123.528 2.876 . . . . 0.0 114.292 -173.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.404 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 15.0 pm0 -131.98 -50.62 0.96 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.223 1.409 . . . . 0.0 110.788 175.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.456 0.1 OUTLIER 73.8 156.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 C-N-CA 125.62 1.568 . . . . 0.0 111.033 177.55 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.4 t70 30.69 50.11 0.09 Allowed 'General case' 0 N--CA 1.52 3.049 0 C-N-CA 131.123 3.769 . . . . 0.0 115.458 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.404 ' HG3' ' HG3' ' A' ' 57' ' ' GLU 0.446 60.7 mm-40 -86.26 79.61 9.01 Favored 'General case' 0 CA--C 1.485 -1.529 0 CA-C-O 126.949 3.262 . . . . 0.0 109.742 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.309 33.2 p -78.44 -15.56 58.52 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 128.742 2.817 . . . . 0.0 112.769 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.421 ' HH ' ' C ' ' A' ' 109' ' ' GLY . 1.1 t80 -68.95 -34.25 75.03 Favored 'General case' 0 C--N 1.358 0.961 1 C-N-CA 131.82 4.048 . . . . 0.0 110.45 169.002 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.417 HG13 ' CZ ' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -64.86 -45.94 93.39 Favored 'Isoleucine or valine' 0 C--N 1.358 0.953 0 C-N-CA 130.901 3.68 . . . . 0.0 106.789 -178.698 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.46 ' CE1' ' HA ' ' A' ' 18' ' ' PHE 0.316 57.5 m-85 -62.57 -41.54 98.98 Favored 'General case' 0 C--O 1.21 -1.006 0 C-N-CA 130.322 3.449 . . . . 0.0 114.778 165.539 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -64.28 -43.04 96.02 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 123.898 3.044 . . . . 0.0 113.575 177.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.514 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.2 tm? -68.14 -41.62 81.33 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 125.064 1.346 . . . . 0.0 114.468 171.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.417 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.886 0.1 OUTLIER -77.76 -17.06 57.94 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 118.394 -2.691 . . . . 0.0 115.512 172.878 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -78.3 -18.98 54.52 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 127.845 2.458 . . . . 0.0 108.349 163.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -78.13 -33.17 50.57 Favored 'General case' 0 CA--C 1.567 1.611 0 O-C-N 119.978 -1.702 . . . . 0.0 112.085 159.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.514 HD13 ' HG1' ' A' ' 152' ' ' THR . 6.2 mm -58.0 -46.08 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.914 0 C-N-CA 128.155 2.582 . . . . 0.0 113.342 173.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 pttm -52.46 -16.92 1.0 Allowed 'General case' 0 CA--C 1.502 -0.898 0 C-N-CA 130.512 3.525 . . . . 0.0 118.272 -176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.277 60.7 m-20 -101.24 -14.14 17.8 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.974 2.109 . . . . 0.0 109.718 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.97 11.93 16.85 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 129.823 3.249 . . . . 0.0 113.059 -171.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.48 ' HA ' HG13 ' A' ' 77' ' ' VAL . 99.5 t -37.89 -31.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.384 2.067 0 C-N-CA 129.103 2.961 . . . . 0.0 115.996 166.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.5 -38.09 77.47 Favored 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 130.388 3.475 . . . . 0.0 114.404 175.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -76.43 -33.04 58.8 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.581 1.952 . . . . 0.0 112.101 172.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.48 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.744 0.1 OUTLIER -71.51 -26.77 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.787 0 CA-C-O 126.786 3.184 . . . . 0.0 112.517 169.83 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -70.44 -32.57 70.21 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 128.821 2.848 . . . . 0.0 111.997 163.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -63.72 -30.26 71.38 Favored 'General case' 0 C--N 1.377 1.784 0 C-N-CA 125.336 1.454 . . . . 0.0 112.372 161.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -41.29 98.03 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 124.944 1.298 . . . . 0.0 112.611 163.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.4 HD21 ' HB2' ' A' ' 125' ' ' LYS . 0.9 OUTLIER -75.4 -13.68 60.41 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 127.628 2.371 . . . . 0.0 115.575 173.458 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 49.1 m -78.81 2.51 19.65 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 128.765 2.826 . . . . 0.0 114.43 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 14.1 tpt -73.62 131.48 82.2 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 131.279 3.832 . . . . 0.0 111.023 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.68 151.84 77.85 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 125.241 3.961 . . . . 0.0 112.557 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -47.34 139.5 16.55 Favored 'Trans proline' 0 C--N 1.361 1.215 1 C-N-CA 126.918 5.079 . . . . 0.0 118.845 -162.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -83.96 95.32 0.31 Allowed Pre-proline 0 CA--C 1.568 1.668 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -113.3 165.76 0.04 OUTLIER 'Trans proline' 0 C--N 1.367 1.531 1 C-N-CA 127.659 5.573 . . . . 0.0 112.702 -164.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.89 -25.61 68.23 Favored 'General case' 0 C--N 1.368 1.392 0 C-N-CA 128.196 2.598 . . . . 0.0 114.323 170.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . 0.262 0.0 OUTLIER -89.67 157.43 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 1 C-N-CA 132.294 4.237 . . . . 0.0 111.498 171.839 . . . . . . . . 4 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -113.5 -41.7 3.6 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-N 110.156 -3.202 . . . . 0.0 110.127 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -82.61 -18.64 40.52 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 120.521 3.526 . . . . 0.0 120.521 -171.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -104.04 -3.38 24.66 Favored 'General case' 0 CA--C 1.494 -1.189 0 O-C-N 121.572 -0.705 . . . . 0.0 111.875 -173.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -145.7 -58.51 0.32 Allowed 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -175.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.46 ' HB ' ' HB ' ' A' ' 97' ' ' VAL 0.318 2.5 pt -87.4 87.58 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 CA-C-O 127.784 3.659 . . . . 0.0 115.868 -170.387 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -97.03 -22.84 16.57 Favored 'General case' 0 N--CA 1.436 -1.154 2 CA-C-N 104.745 -5.661 . . . . 0.0 109.032 175.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -90.64 -6.84 67.4 Favored Glycine 0 C--N 1.367 2.259 0 C-N-CA 124.424 1.012 . . . . 0.0 111.509 174.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.46 ' HB ' ' HB ' ' A' ' 94' ' ' ILE . 89.6 t -113.01 94.84 3.37 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 176.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -117.02 24.26 11.31 Favored 'General case' 0 N--CA 1.436 -1.147 0 C-N-CA 130.685 3.594 . . . . 0.0 108.816 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.6 t80 82.87 57.35 0.01 OUTLIER 'General case' 0 C--N 1.36 1.028 0 C-N-CA 130.03 3.332 . . . . 0.0 110.576 -175.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -111.08 109.54 57.01 Favored Pre-proline 0 C--N 1.357 0.921 0 C-N-CA 125.597 1.559 . . . . 0.0 109.297 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -63.63 152.8 78.69 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 125.3 4.0 . . . . 0.0 116.421 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.37 43.65 2.93 Favored Glycine 0 C--N 1.359 1.834 0 C-N-CA 126.163 1.84 . . . . 0.0 114.854 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -131.71 145.82 51.84 Favored 'General case' 0 CA--C 1.506 -0.719 0 O-C-N 119.35 -2.264 . . . . 0.0 110.141 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.8 tp -115.82 135.79 53.67 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.865 2.066 . . . . 0.0 109.886 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -129.4 110.69 12.11 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 103.367 -2.827 . . . . 0.0 103.367 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.6 pt -134.52 140.92 44.79 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 C-N-CA 124.776 1.231 . . . . 0.0 110.774 -173.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 23.3 m -127.48 130.58 49.46 Favored 'General case' 0 C--N 1.363 1.179 0 O-C-N 120.1 -1.625 . . . . 0.0 112.131 -176.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.407 ' HB3' ' HB ' ' A' ' 152' ' ' THR . 33.0 t0 -173.75 166.51 4.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.8 -3.037 . . . . 0.0 102.8 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.514 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.33 -38.51 3.2 Favored Glycine 0 C--N 1.351 1.411 0 CA-C-O 123.661 1.701 . . . . 0.0 111.072 172.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 29.1 m-80 121.23 -8.85 0.0 OUTLIER 'General case' 0 N--CA 1.422 -1.849 1 C-N-CA 139.497 7.119 . . . . 0.0 108.453 -168.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.491 ' HG ' HD23 ' A' ' 113' ' ' LEU 0.641 0.0 OUTLIER -79.26 136.01 36.92 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 130.24 3.416 . . . . 0.0 116.596 177.245 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -97.21 100.48 11.95 Favored 'General case' 0 C--N 1.37 1.463 0 N-CA-C 100.26 -3.978 . . . . 0.0 100.26 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.491 HD23 ' HG ' ' A' ' 111' ' ' LEU . 1.3 pt? -119.25 123.06 43.36 Favored 'General case' 0 C--N 1.361 1.086 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -117.36 142.95 17.7 Favored Glycine 0 C--N 1.355 1.621 0 N-CA-C 106.596 -2.602 . . . . 0.0 106.596 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -131.85 142.22 49.64 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 176.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 31.4 m -125.05 129.63 50.65 Favored 'General case' 0 CA--C 1.485 -1.544 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 -173.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.0 144.05 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 127.147 2.179 . . . . 0.0 108.884 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.425 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.309 86.4 m -56.87 107.5 0.41 Allowed 'General case' 0 C--N 1.379 1.867 0 CA-C-N 120.9 1.682 . . . . 0.0 111.593 179.697 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.252 22.7 ttmm -68.81 -40.02 15.94 Favored Pre-proline 0 N--CA 1.444 -0.73 0 CA-C-O 116.057 -1.925 . . . . 0.0 115.28 -170.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.48 59.46 5.51 Favored 'Trans proline' 0 CA--C 1.56 1.778 0 CA-C-N 126.042 3.194 . . . . 0.0 113.071 171.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.258 0.0 OUTLIER 163.71 124.24 0.01 OUTLIER 'General case' 0 C--N 1.367 1.359 0 C-N-CA 129.648 3.179 . . . . 0.0 111.47 178.15 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -146.46 67.15 1.18 Allowed 'General case' 0 N--CA 1.432 -1.341 0 O-C-N 117.331 -3.356 . . . . 0.0 111.241 168.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -105.42 11.99 32.03 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 126.339 1.855 . . . . 0.0 107.832 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -128.31 150.75 49.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.088 2.555 . . . . 0.0 113.354 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.4 ' HB2' HD21 ' A' ' 81' ' ' LEU 0.266 2.4 mppt? -101.82 -45.62 5.16 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.417 1.487 . . . . 0.0 111.183 178.348 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.3 85.25 6.77 Favored Pre-proline 0 C--N 1.367 1.346 0 C-N-CA 129.058 2.943 . . . . 0.0 108.018 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -81.49 -173.12 1.68 Allowed 'Trans proline' 0 CA--C 1.497 -1.342 1 C-N-CA 132.652 8.901 . . . . 0.0 114.106 -177.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.6 p -98.44 138.94 34.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 100.375 -3.935 . . . . 0.0 100.375 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.7 134.91 42.97 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 121.136 1.789 . . . . 0.0 106.629 -167.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 118' ' ' CYS 0.252 1.1 pt20 -95.85 66.59 2.65 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 125.486 1.514 . . . . 0.0 109.538 -169.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.309 2.1 p 98.68 148.65 0.02 OUTLIER 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.409 1.884 . . . . 0.0 109.669 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -115.09 124.16 50.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 101.164 -3.643 . . . . 0.0 101.164 165.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.42 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . 4.3 ttp -102.95 108.25 19.36 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -121.72 115.16 22.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.605 1.162 . . . . 0.0 108.439 -175.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.7 mm -139.1 136.38 42.16 Favored 'Isoleucine or valine' 0 C--N 1.363 1.186 0 N-CA-C 105.658 -1.979 . . . . 0.0 105.658 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.65 -179.39 3.31 Favored 'Isoleucine or valine' 0 C--N 1.351 0.651 0 C-N-CA 127.196 2.198 . . . . 0.0 112.822 -172.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.53 149.52 49.49 Favored 'General case' 0 CA--C 1.557 1.224 1 C-N-CA 135.418 5.487 . . . . 0.0 106.972 167.199 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.514 ' HB2' HD22 ' A' ' 141' ' ' LEU . 51.4 m -164.67 -103.54 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.536 ' HD2' ' HG2' ' A' ' 140' ' ' ARG 0.258 0.0 OUTLIER -118.15 -66.69 1.05 Allowed 'General case' 0 C--N 1.355 0.815 0 C-N-CA 129.671 3.188 . . . . 0.0 113.608 -160.264 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.536 ' HG2' ' HD2' ' A' ' 139' ' ' ARG . 12.2 ptp180 -105.66 2.14 27.85 Favored 'General case' 0 CA--C 1.497 -1.079 1 C-N-CA 133.684 4.794 . . . . 0.0 108.659 174.617 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.514 HD22 ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER -82.61 142.48 46.04 Favored Pre-proline 0 CA--C 1.574 1.895 0 CA-C-O 114.514 -2.66 . . . . 0.0 106.387 -152.463 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -45.15 -50.41 8.91 Favored 'Trans proline' 0 N--CA 1.48 0.702 2 C-N-CA 127.051 5.167 . . . . 0.0 125.441 -167.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -126.67 -165.51 11.98 Favored Glycine 0 CA--C 1.492 -1.376 0 C-N-CA 126.281 1.896 . . . . 0.0 111.883 -177.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -152.11 136.69 16.92 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 127.926 2.49 . . . . 0.0 111.842 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 163.07 120.86 0.0 OUTLIER 'General case' 0 C--N 1.36 1.047 0 C-N-CA 129.725 3.21 . . . . 0.0 111.902 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 75.6 m -141.86 119.66 11.88 Favored 'General case' 0 C--N 1.368 1.386 0 O-C-N 120.258 -1.526 . . . . 0.0 108.624 174.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -162.97 83.51 0.5 Allowed 'General case' 0 CA--C 1.498 -1.044 0 C-N-CA 125.338 1.455 . . . . 0.0 111.959 178.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 164.32 144.89 0.01 OUTLIER 'General case' 0 C--N 1.373 1.596 0 C-N-CA 128.042 2.537 . . . . 0.0 104.925 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -148.88 108.21 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.259 0 CA-C-N 121.756 2.071 . . . . 0.0 112.649 -178.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.422 HD11 ' H ' ' A' ' 153' ' ' GLN . 0.4 OUTLIER -129.3 146.59 33.98 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 131.173 3.789 . . . . 0.0 104.946 173.292 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.354 21.3 mttp -93.42 137.13 33.03 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 123.717 2.962 . . . . 0.0 104.382 153.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.514 ' HG1' HD13 ' A' ' 70' ' ' ILE 0.355 1.0 OUTLIER -79.17 116.1 19.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 120.033 3.346 . . . . 0.0 120.033 -140.332 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.422 ' H ' HD11 ' A' ' 150' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.433 2 C-N-CA 135.765 5.626 . . . . 0.0 122.93 -173.79 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm . . . . . 0 N--CA 1.452 -0.354 0 N-CA-C 104.78 -2.304 . . . . 0.0 104.78 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 77.7 p -89.46 148.19 23.58 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 128.019 2.528 . . . . 0.0 115.819 -173.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.6 mt -112.34 50.0 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.042 0 C-N-CA 127.7 2.4 . . . . 0.0 110.248 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.452 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 5.3 m120 -47.26 -4.29 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 1 C-N-CA 132.031 4.132 . . . . 0.0 120.26 -175.632 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -58.37 4.31 Favored 'General case' 0 C--O 1.24 0.589 1 C-N-CA 133.172 4.589 . . . . 0.0 111.048 173.004 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -73.55 -13.62 61.06 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.096 1.759 . . . . 0.0 113.07 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.452 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.7 OUTLIER -84.88 -31.61 7.19 Favored 'Isoleucine or valine' 0 C--N 1.358 0.946 0 C-N-CA 127.808 2.443 . . . . 0.0 110.214 176.605 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.3 -38.39 71.76 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 127.567 2.347 . . . . 0.0 108.413 174.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -61.07 -44.65 98.69 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.887 164.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 1.2 mmp_? -61.4 -47.46 85.7 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 120.951 1.705 . . . . 0.0 113.916 171.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -56.83 -27.29 59.94 Favored 'General case' 0 C--N 1.376 1.736 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 164.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -76.77 -50.68 12.96 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 119.486 -2.009 . . . . 0.0 111.877 171.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -56.83 -28.4 61.5 Favored 'General case' 0 C--N 1.376 1.721 0 C-N-CA 126.828 2.051 . . . . 0.0 112.754 171.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.62 -46.56 46.13 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 113.755 -1.566 . . . . 0.0 111.621 170.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.434 4.2 ptp180 -58.22 -36.28 72.92 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.16 -1.587 . . . . 0.0 114.586 173.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.9 mtt180 -64.19 -41.96 96.87 Favored 'General case' 0 C--N 1.384 2.069 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 162.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.251 3.0 t60 -62.22 -47.97 82.08 Favored 'General case' 0 C--N 1.383 2.024 0 C-N-CA 127.941 2.496 . . . . 0.0 114.392 174.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -59.06 -53.77 54.62 Favored 'General case' 0 C--N 1.369 1.449 1 C-N-CA 132.883 4.473 . . . . 0.0 108.8 177.885 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -70.65 -46.64 62.9 Favored 'General case' 0 C--N 1.37 1.48 0 N-CA-C 118.556 2.799 . . . . 0.0 118.556 173.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m -66.29 -38.58 88.11 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 119.597 -1.94 . . . . 0.0 114.053 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.449 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.327 4.6 mp0 -77.11 -29.15 54.68 Favored 'General case' 0 C--N 1.362 1.113 0 O-C-N 120.708 -1.245 . . . . 0.0 111.013 172.207 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.3 -36.81 83.27 Favored 'General case' 0 C--N 1.387 2.202 0 O-C-N 120.178 -1.576 . . . . 0.0 114.137 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -68.09 -34.91 77.29 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 124.745 1.218 . . . . 0.0 110.47 169.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.538 HE21 ' CE1' ' A' ' 68' ' ' HIS . 19.6 tt0 -63.49 -45.75 89.26 Favored 'General case' 0 C--N 1.364 1.223 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 169.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 68' ' ' HIS . 2.1 mt -71.3 -45.48 69.87 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 O-C-N 119.277 -2.14 . . . . 0.0 111.795 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.471 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.336 3.5 m120 -75.03 -23.75 58.22 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 120.87 -1.144 . . . . 0.0 112.391 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -75.84 -38.46 58.02 Favored 'General case' 0 C--N 1.382 2.012 0 CA-C-O 116.768 -1.587 . . . . 0.0 110.561 165.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.439 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 16.4 tp10 -65.97 -35.68 81.25 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-N 122.965 2.621 . . . . 0.0 115.793 172.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.471 HG13 ' HA ' ' A' ' 26' ' ' ASN 0.38 0.7 OUTLIER -73.06 -39.68 57.63 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 115.135 1.532 . . . . 0.0 115.135 174.625 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -74.4 -31.81 62.47 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 171.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 8.6 pt-20 -77.38 -38.06 50.76 Favored 'General case' 0 C--N 1.374 1.637 0 O-C-N 118.282 -2.762 . . . . 0.0 110.81 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.27 -36.5 54.31 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.428 1.091 . . . . 0.0 111.899 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.1 t -68.28 -35.45 77.88 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 121.213 -0.929 . . . . 0.0 110.346 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.05 -39.42 69.07 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.83 -28.38 61.58 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 126.48 1.912 . . . . 0.0 115.375 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.95 -15.58 58.11 Favored 'General case' 0 C--N 1.385 2.141 0 C-N-CA 124.75 1.22 . . . . 0.0 110.943 171.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 17.53 59.34 Favored Glycine 0 C--N 1.376 2.779 0 N-CA-C 114.994 0.757 . . . . 0.0 114.994 166.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.459 HG23 HD13 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -109.82 151.76 12.01 Favored 'Isoleucine or valine' 0 C--N 1.36 1.023 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 178.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.428 ' HB2' ' CD1' ' A' ' 81' ' ' LEU 0.52 7.7 m -20.74 -47.72 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.743 2 N-CA-C 125.715 5.45 . . . . 0.0 125.715 -167.267 . . . . . . . . 4 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.343 93.7 p 87.35 137.59 0.04 OUTLIER 'General case' 0 CA--C 1.501 -0.919 1 C-N-CA 131.758 4.023 . . . . 0.0 109.543 -178.502 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -112.51 140.53 47.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 -175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -101.96 104.61 15.31 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -175.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.294 0.3 OUTLIER -105.68 161.18 14.61 Favored 'General case' 0 CA--C 1.504 -0.791 0 O-C-N 116.863 -3.648 . . . . 0.0 115.451 -175.529 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -135.75 153.37 51.58 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.416 3.0 p90 -108.36 135.36 49.78 Favored 'General case' 0 C--N 1.36 1.03 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 167.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.9 m -106.35 133.41 51.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 50' ' ' LEU . 29.5 mm-40 -80.82 -10.76 59.69 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 121.717 3.969 . . . . 0.0 121.717 -170.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.47 -48.03 74.05 Favored 'General case' 0 N--CA 1.495 1.778 1 CA-C-N 126.582 4.265 . . . . 0.0 117.054 -175.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.582 ' H ' ' CD1' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -63.47 -34.81 78.58 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-O 128.031 3.777 . . . . 0.0 113.804 174.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.524 ' H ' HD22 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -72.84 -44.87 60.88 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 109.729 -3.396 . . . . 0.0 108.887 171.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.541 ' HA ' ' CG2' ' A' ' 54' ' ' ILE . 19.6 t70 -55.77 -30.03 60.6 Favored 'General case' 0 C--N 1.37 1.467 0 C-N-CA 127.818 2.447 . . . . 0.0 109.665 -179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.4 ttm-85 -68.16 -55.96 10.48 Favored 'General case' 0 C--N 1.375 1.714 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 157.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.35 71.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 120.603 3.557 . . . . 0.0 120.603 -177.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.541 ' CG2' ' HA ' ' A' ' 51' ' ' ASP . 5.4 tt -75.36 -39.65 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 1 C-N-CA 131.962 4.105 . . . . 0.0 110.619 178.635 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 -107.82 -22.43 12.46 Favored 'General case' 0 C--N 1.373 1.617 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -86.5 10.11 16.28 Favored 'General case' 0 C--N 1.377 1.768 0 CA-C-N 122.597 2.453 . . . . 0.0 113.82 -172.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -155.13 -52.85 0.09 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 125.794 1.638 . . . . 0.0 108.88 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.507 0.0 OUTLIER 75.85 160.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.373 1.629 0 C-N-CA 126.565 1.946 . . . . 0.0 110.125 -179.727 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.8 t70 34.87 45.63 0.16 Allowed 'General case' 0 N--CA 1.512 2.629 1 C-N-CA 131.821 4.048 . . . . 0.0 113.045 -175.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.622 0.0 OUTLIER -83.38 68.64 9.79 Favored 'General case' 0 C--O 1.206 -1.201 0 C-N-CA 128.018 2.527 . . . . 0.0 109.971 -178.233 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.292 23.4 p -79.51 -18.19 52.44 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 130.354 3.461 . . . . 0.0 112.896 177.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -65.26 -33.72 76.66 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 131.467 3.907 . . . . 0.0 111.009 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.439 HG21 HD23 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -60.07 -47.43 91.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.24 0 C-N-CA 130.712 3.605 . . . . 0.0 108.351 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.449 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.297 29.2 m-85 -64.61 -40.63 95.84 Favored 'General case' 0 CA--C 1.494 -1.174 1 C-N-CA 134.569 5.148 . . . . 0.0 113.628 171.585 . . . . . . . . 4 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -65.35 -45.26 84.9 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.565 2.346 . . . . 0.0 114.414 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -66.57 -51.04 60.83 Favored 'General case' 0 CA--C 1.567 1.617 0 C-N-CA 124.888 1.275 . . . . 0.0 112.166 171.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.749 0.0 OUTLIER -72.08 -14.71 61.92 Favored 'General case' 0 C--N 1.379 1.864 1 O-C-N 116.155 -4.091 . . . . 0.0 112.417 177.476 . . . . . . . . 4 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.552 ' CE1' HG12 ' A' ' 25' ' ' ILE . 21.2 m-70 -75.82 -27.6 57.97 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 129.124 2.969 . . . . 0.0 111.136 165.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.336 43.6 mmtm -69.1 -27.02 65.23 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.269 -1.52 . . . . 0.0 109.836 159.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.496 HG12 ' CD2' ' A' ' 73' ' ' HIS 0.495 5.5 mt -70.39 -9.08 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 N-CA-C 119.296 3.072 . . . . 0.0 119.296 166.544 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.3 pttm -75.21 -13.38 60.44 Favored 'General case' 0 CA--C 1.512 -0.517 1 O-C-N 116.027 -4.171 . . . . 0.0 114.054 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.381 70.4 m-20 -92.84 -27.31 17.22 Favored 'General case' 0 N--CA 1.432 -1.369 0 C-N-CA 129.422 3.089 . . . . 0.0 112.694 -178.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.496 ' CD2' HG12 ' A' ' 70' ' ' ILE . 3.6 t-80 -70.93 -1.09 10.76 Favored 'General case' 0 CA--C 1.493 -1.228 1 C-N-CA 135.012 5.325 . . . . 0.0 115.544 -170.773 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 55.0 t -27.33 -45.25 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.361 1.075 1 C-N-CA 132.104 4.162 . . . . 0.0 117.502 169.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.13 -31.39 62.73 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.458 2.303 . . . . 0.0 112.753 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -75.38 -43.26 51.16 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 126.415 1.886 . . . . 0.0 111.926 176.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.306 8.6 p -70.15 -31.2 46.59 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 C-N-CA 126.709 2.004 . . . . 0.0 110.804 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.424 ' HB3' HG22 ' A' ' 38' ' ' VAL . 49.0 m-20 -71.9 -30.65 65.6 Favored 'General case' 0 C--N 1.357 0.93 0 O-C-N 119.293 -2.13 . . . . 0.0 115.373 169.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -68.89 -34.62 75.72 Favored 'General case' 0 C--N 1.37 1.484 0 O-C-N 118.08 -2.887 . . . . 0.0 109.551 165.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.49 9.6 t80 -73.53 -4.39 33.61 Favored 'General case' 0 C--N 1.367 1.338 1 C-N-CA 131.779 4.032 . . . . 0.0 115.678 171.634 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.503 HD11 ' HB3' ' A' ' 125' ' ' LYS . 2.1 mt -40.65 -44.02 2.05 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 130.867 3.667 . . . . 0.0 113.152 -172.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . 0.322 1.1 t -112.38 -43.25 3.54 Favored 'General case' 0 C--N 1.381 1.952 0 CA-C-N 123.755 2.979 . . . . 0.0 115.854 151.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.444 ' HE1' HG21 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -129.73 166.73 23.92 Favored Pre-proline 0 C--N 1.359 0.985 0 N-CA-C 100.949 -3.723 . . . . 0.0 100.949 166.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -60.84 119.5 6.71 Favored 'Trans proline' 0 CA--C 1.565 2.05 0 CA-C-N 126.909 3.503 . . . . 0.0 109.618 162.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.418 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 87.0 Cg_exo 39.29 135.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.29 1 C-N-CA 129.896 7.064 . . . . 0.0 121.871 -154.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' HG2' ' HG3' ' A' ' 87' ' ' PRO 0.444 0.0 OUTLIER -6.03 6.07 0.0 OUTLIER Pre-proline 0 CA--C 1.595 2.683 3 N-CA-C 139.969 10.729 . . . . 0.0 139.969 167.497 . . . . . . . . 5 4 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.418 ' HD3' ' O ' ' A' ' 85' ' ' PRO . 19.1 Cg_endo -131.5 160.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.894 2 CA-C-N 137.453 7.269 . . . . 0.0 116.448 -134.589 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.33 -13.33 15.7 Favored 'General case' 0 C--N 1.365 1.269 0 CA-C-O 124.735 2.207 . . . . 0.0 110.114 177.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -122.64 113.68 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 C-N-CA 130.082 3.353 . . . . 0.0 107.785 -176.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -94.56 -1.94 52.44 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 127.679 2.392 . . . . 0.0 110.133 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -100.02 -18.41 17.04 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 126.119 1.768 . . . . 0.0 112.853 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -127.89 -21.05 3.75 Favored 'General case' 0 CA--C 1.495 -1.144 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 -171.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -131.39 2.44 4.2 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 119.309 3.077 . . . . 0.0 119.309 -168.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 36.7 pt -88.45 138.57 18.89 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -143.25 -25.65 0.59 Allowed 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 112.235 -2.257 . . . . 0.0 111.541 -176.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.22 -2.28 60.67 Favored Glycine 0 C--N 1.354 1.561 0 C-N-CA 124.235 0.921 . . . . 0.0 111.166 175.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.444 HG21 ' HE1' ' A' ' 83' ' ' MET . 97.2 t -95.53 114.61 32.56 Favored 'Isoleucine or valine' 0 C--N 1.368 1.388 0 CA-C-O 124.184 1.945 . . . . 0.0 112.726 -178.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -92.76 19.35 7.64 Favored 'General case' 0 CA--C 1.542 0.654 1 C-N-CA 132.504 4.322 . . . . 0.0 114.74 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 60.61 35.37 19.97 Favored 'General case' 0 N--CA 1.473 0.68 1 C-N-CA 131.767 4.027 . . . . 0.0 116.018 -177.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -113.05 168.02 8.34 Favored Pre-proline 0 C--N 1.355 0.833 0 C-N-CA 129.859 3.264 . . . . 0.0 110.328 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -60.13 174.58 1.34 Allowed 'Trans proline' 0 C--N 1.359 1.099 1 C-N-CA 126.469 4.78 . . . . 0.0 117.583 173.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.32 20.95 6.45 Favored Glycine 0 C--N 1.356 1.644 0 C-N-CA 127.114 2.292 . . . . 0.0 117.154 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.564 ' HE ' ' HG2' ' A' ' 120' ' ' PRO . 93.6 mtt180 -132.95 144.05 49.87 Favored 'General case' 0 C--N 1.351 0.668 0 N-CA-C 100.336 -3.95 . . . . 0.0 100.336 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.5 pp -120.79 147.94 44.67 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.201 -0.937 . . . . 0.0 112.333 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -130.24 120.64 24.77 Favored 'General case' 0 C--N 1.368 1.397 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.414 ' HB ' HD11 ' A' ' 150' ' ' ILE . 6.3 pt -134.64 138.23 49.85 Favored 'Isoleucine or valine' 0 C--N 1.35 0.604 0 C-N-CA 125.089 1.355 . . . . 0.0 109.723 -177.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.4 t -118.62 129.22 55.2 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 -178.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.457 ' HB2' HG13 ' A' ' 150' ' ' ILE . 6.4 t0 -154.5 -174.74 5.09 Favored 'General case' 0 C--N 1.367 1.346 0 N-CA-C 102.253 -3.24 . . . . 0.0 102.253 174.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.0 -66.65 3.9 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 119.23 -2.169 . . . . 0.0 113.547 173.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 159.64 -31.4 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.066 1 C-N-CA 139.902 7.281 . . . . 0.0 104.209 -163.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.439 HD23 HG21 ' A' ' 63' ' ' VAL . 4.5 mp -78.53 137.23 37.81 Favored 'General case' 0 C--N 1.368 1.393 1 C-N-CA 133.845 4.858 . . . . 0.0 121.064 -171.129 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -94.2 103.34 15.38 Favored 'General case' 0 C--N 1.375 1.676 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 164.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -100.12 133.51 44.41 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 177.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -110.21 141.52 16.28 Favored Glycine 0 C--N 1.343 0.937 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 173.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -129.16 133.91 47.8 Favored 'General case' 0 C--N 1.353 0.755 1 N-CA-C 99.403 -4.295 . . . . 0.0 99.403 179.041 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 42.1 p -134.37 137.65 44.28 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 -171.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . 0.27 1.6 p -92.02 151.72 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 C-N-CA 125.39 1.476 . . . . 0.0 112.602 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 15.5 p -58.73 97.94 0.03 OUTLIER 'General case' 0 C--N 1.39 2.348 0 C-N-CA 128.063 2.545 . . . . 0.0 113.583 -177.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.597 17.8 ptpt 46.52 86.66 0.13 Allowed Pre-proline 0 C--N 1.351 0.651 0 C-N-CA 129.1 2.96 . . . . 0.0 115.501 -165.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.564 ' HG2' ' HE ' ' A' ' 103' ' ' ARG . 4.9 Cg_exo -45.33 108.87 0.15 Allowed 'Trans proline' 0 C--N 1.364 1.368 1 C-N-CA 125.914 4.409 . . . . 0.0 118.863 -159.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -157.95 149.76 21.82 Favored 'General case' 0 C--N 1.364 1.216 0 C-N-CA 130.056 3.342 . . . . 0.0 109.268 -169.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -146.52 100.47 3.35 Favored 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 123.181 1.467 . . . . 0.0 110.11 166.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -108.1 -7.39 16.09 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.554 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.437 17.4 m-85 -157.0 176.01 13.33 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -164.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.503 ' HB3' HD11 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -138.28 104.99 5.34 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 103.641 -2.725 . . . . 0.0 103.641 177.841 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.9 t70 160.28 -25.89 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.542 0 C-N-CA 129.567 3.147 . . . . 0.0 115.94 -167.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.343 76.1 Cg_exo -53.12 -178.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.385 2.474 1 C-N-CA 127.638 5.559 . . . . 0.0 119.131 -179.195 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 30.2 t -103.29 152.37 21.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.335 2.254 . . . . 0.0 109.392 -172.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 20.2 mt -102.34 130.85 49.19 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 177.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -89.53 38.55 0.91 Allowed 'General case' 0 C--N 1.383 2.042 0 C-N-CA 128.427 2.691 . . . . 0.0 111.26 -163.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 19.5 t 98.66 143.93 0.02 OUTLIER 'General case' 0 C--N 1.371 1.521 0 C-N-CA 125.754 1.622 . . . . 0.0 106.929 -168.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.424 HH22 HG23 ' A' ' 25' ' ' ILE . 38.1 mtm180 -107.18 122.37 46.39 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 100.452 -3.907 . . . . 0.0 100.452 168.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.468 ' SD ' ' HB2' ' A' ' 49' ' ' LEU . 1.6 tmm? -93.02 118.67 31.45 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 104.313 -2.477 . . . . 0.0 104.313 -174.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -124.67 114.96 20.01 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . 0.267 80.4 mt -140.08 148.59 22.53 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.412 ' CG2' ' H ' ' A' ' 137' ' ' ASN . 0.3 OUTLIER -133.96 -178.76 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 124.877 2.275 . . . . 0.0 110.461 -169.129 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.454 ' HB2' ' HA ' ' A' ' 144' ' ' LYS . 0.3 OUTLIER -157.28 138.67 13.79 Favored 'General case' 0 N--CA 1.441 -0.89 1 C-N-CA 134.268 5.027 . . . . 0.0 102.02 176.416 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.476 ' HB3' HD22 ' A' ' 141' ' ' LEU . 0.9 OUTLIER -164.91 -115.07 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 120.137 3.384 . . . . 0.0 120.137 -168.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.592 ' HD3' ' HG2' ' A' ' 140' ' ' ARG 0.25 0.0 OUTLIER -103.44 -69.48 0.8 Allowed 'General case' 0 C--N 1.354 0.763 1 C-N-CA 133.515 4.726 . . . . 0.0 114.594 -159.482 . . . . . . . . 5 4 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.592 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 12.5 ptp180 -111.55 9.92 21.22 Favored 'General case' 0 N--CA 1.446 -0.647 1 C-N-CA 133.05 4.54 . . . . 0.0 107.25 173.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.476 HD22 ' HB3' ' A' ' 138' ' ' SER . 0.3 OUTLIER -84.53 163.69 46.01 Favored Pre-proline 0 CA--C 1.574 1.868 0 CA-C-O 115.658 -2.115 . . . . 0.0 106.878 -156.72 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.4 ' HD2' ' CD1' ' A' ' 141' ' ' LEU . 55.3 Cg_exo -54.43 -29.66 60.0 Favored 'Trans proline' 0 N--CA 1.48 0.698 3 N-CA-C 123.644 4.44 . . . . 0.0 123.644 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -161.98 -165.66 19.31 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 127.893 2.663 . . . . 0.0 110.939 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 137' ' ' ASN . 35.7 ttmt -135.45 139.55 44.17 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 131.098 3.759 . . . . 0.0 110.956 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -179.57 178.6 0.65 Allowed 'General case' 0 C--N 1.367 1.355 0 C-N-CA 126.44 1.896 . . . . 0.0 110.483 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . 0.352 2.1 p 158.45 107.9 0.0 OUTLIER 'General case' 0 C--N 1.367 1.331 0 C-N-CA 130.512 3.525 . . . . 0.0 111.168 173.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -168.77 89.12 0.22 Allowed 'General case' 0 C--N 1.361 1.091 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -177.55 170.63 2.02 Favored 'General case' 0 C--N 1.364 1.201 0 N-CA-C 100.468 -3.901 . . . . 0.0 100.468 -177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 30.0 m -117.63 150.62 19.69 Favored 'Isoleucine or valine' 0 C--N 1.375 1.7 0 CA-C-N 123.079 2.672 . . . . 0.0 116.425 -174.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.457 HG13 ' HB2' ' A' ' 108' ' ' ASP 0.424 0.1 OUTLIER -130.82 147.01 33.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 1 N-CA-C 125.988 5.551 . . . . 0.0 125.988 -160.316 . . . . . . . . 5 4 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . 0.492 ' HG3' ' CE1' ' A' ' 73' ' ' HIS 0.324 0.0 OUTLIER -78.92 149.04 32.48 Favored 'General case' 0 CA--C 1.496 -1.116 1 C-N-CA 140.861 7.664 . . . . 0.0 101.059 159.66 . . . . . . . . 5 4 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 11.7 t -79.35 97.21 6.23 Favored 'General case' 0 CA--C 1.566 1.561 1 CA-C-O 129.689 4.566 . . . . 0.0 111.108 168.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.446 ' HA ' ' CG1' ' A' ' 70' ' ' ILE . 3.7 tt0 . . . . . 1 N--CA 1.37 -4.46 2 C-N-CA 138.226 6.611 . . . . 0.0 106.838 173.063 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.1 tpp . . . . . 0 C--O 1.233 0.214 0 N-CA-C 107.427 -1.324 . . . . 0.0 107.427 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 53.9 p -120.77 116.59 25.53 Favored 'General case' 0 C--N 1.365 1.25 0 C-N-CA 126.299 1.839 . . . . 0.0 112.517 -177.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.8 mm -89.54 59.7 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.364 0 CA-C-O 125.179 2.419 . . . . 0.0 109.47 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.48 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.366 10.8 t-20 -54.44 -3.19 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.554 1 C-N-CA 133.831 4.852 . . . . 0.0 120.306 -170.833 . . . . . . . . 4 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.05 -59.2 2.56 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 130.894 3.678 . . . . 0.0 111.145 172.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.77 -12.31 61.48 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 128.142 2.577 . . . . 0.0 112.47 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.48 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.7 t -88.43 -30.11 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 C-N-CA 130.508 3.523 . . . . 0.0 108.39 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -73.57 -42.11 62.04 Favored 'General case' 0 C--N 1.369 1.426 0 C-N-CA 125.778 1.631 . . . . 0.0 109.038 174.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.69 -42.91 93.75 Favored 'Isoleucine or valine' 0 C--N 1.369 1.433 0 C-N-CA 126.958 2.103 . . . . 0.0 110.875 168.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.289 11.4 tpp180 -65.07 -47.29 77.81 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 79.4 mtm180 -57.89 -31.82 67.12 Favored 'General case' 0 C--N 1.379 1.849 0 C-N-CA 128.77 2.828 . . . . 0.0 117.507 167.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -77.15 -46.62 22.81 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 127.384 2.273 . . . . 0.0 110.683 170.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.502 ' HA ' ' HG3' ' A' ' 16' ' ' ARG 0.337 31.1 mtpt -59.3 -28.42 66.75 Favored 'General case' 0 C--N 1.367 1.341 0 C-N-CA 126.646 1.979 . . . . 0.0 111.36 172.271 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.81 -49.31 39.72 Favored 'General case' 0 C--O 1.21 -1.018 0 C-N-CA 125.504 1.522 . . . . 0.0 111.591 169.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.386 15.5 ptt180 -55.78 -33.34 64.27 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 170.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.502 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.292 0.1 OUTLIER -75.43 -38.16 59.96 Favored 'General case' 0 C--N 1.399 2.747 0 O-C-N 120.393 -1.442 . . . . 0.0 113.772 167.009 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.296 89.6 m-70 -56.93 -44.89 82.93 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 130.177 3.391 . . . . 0.0 109.402 172.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.454 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -65.51 -53.49 41.71 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 129.78 3.232 . . . . 0.0 110.802 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -69.07 -40.01 78.74 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.3 m -73.56 -35.47 65.47 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.861 2.064 . . . . 0.0 112.371 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.447 ' HB3' ' CD2' ' A' ' 64' ' ' PHE 0.281 50.7 mt-10 -77.3 -29.09 53.52 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 119.279 -2.138 . . . . 0.0 109.988 168.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -34.21 74.64 Favored 'General case' 0 C--N 1.376 1.72 0 O-C-N 119.196 -2.19 . . . . 0.0 112.637 169.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.321 7.4 ptm180 -69.65 -35.91 75.6 Favored 'General case' 0 C--N 1.375 1.7 0 CA-C-O 118.17 -0.919 . . . . 0.0 113.473 164.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -59.46 -50.41 74.03 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.3 mt -71.77 -44.56 68.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 C-N-CA 125.475 1.51 . . . . 0.0 110.35 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.556 ' HA ' ' CG1' ' A' ' 29' ' ' ILE 0.625 0.0 OUTLIER -70.15 -24.11 63.11 Favored 'General case' 0 C--N 1.375 1.679 0 O-C-N 119.396 -2.065 . . . . 0.0 114.247 174.443 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -75.02 -37.35 61.8 Favored 'General case' 0 C--N 1.375 1.693 0 O-C-N 119.683 -1.886 . . . . 0.0 112.879 170.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.439 ' HA ' ' HG2' ' A' ' 31' ' ' GLU 0.451 0.0 OUTLIER -69.3 -34.4 74.62 Favored 'General case' 0 C--N 1.402 2.89 0 CA-C-N 122.816 2.553 . . . . 0.0 113.735 172.866 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.556 ' CG1' ' HA ' ' A' ' 26' ' ' ASN 0.257 2.2 pp -67.19 -44.94 87.42 Favored 'Isoleucine or valine' 0 C--N 1.387 2.202 0 C-N-CA 124.624 1.169 . . . . 0.0 112.183 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -61.25 -38.57 87.18 Favored 'General case' 0 C--N 1.363 1.167 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 170.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.9 pt-20 -76.87 -41.57 43.34 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 119.432 -2.043 . . . . 0.0 113.031 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.46 -39.66 64.76 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.3 t -71.46 -35.5 70.89 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.896 1.278 . . . . 0.0 110.356 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -70.4 -38.0 74.59 Favored 'General case' 0 C--N 1.388 2.244 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 167.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.42 62.41 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.298 1.839 . . . . 0.0 114.251 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.25 -18.9 61.18 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 120.018 1.281 . . . . 0.0 112.162 170.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.14 18.23 47.39 Favored Glycine 0 C--N 1.376 2.753 0 CA-C-O 121.82 0.678 . . . . 0.0 113.355 168.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.425 HG22 ' CD2' ' A' ' 81' ' ' LEU . 0.5 OUTLIER -119.89 162.76 18.0 Favored 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 123.774 0.83 . . . . 0.0 109.343 -175.212 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 22.67 -51.09 0.0 OUTLIER 'General case' 0 C--N 1.371 1.504 1 C-N-CA 137.974 6.51 . . . . 0.0 120.718 176.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.2 m 72.75 92.48 0.08 Allowed 'General case' 0 C--N 1.364 1.209 0 C-N-CA 131.141 3.776 . . . . 0.0 109.737 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.476 ' CZ ' ' HB ' ' A' ' 29' ' ' ILE . 36.7 p90 -113.96 140.87 48.05 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 122.019 0.914 . . . . 0.0 111.568 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -102.71 167.64 9.77 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 129.163 2.985 . . . . 0.0 105.114 170.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.397 2.8 pp -122.64 156.6 33.99 Favored 'General case' 0 CA--C 1.495 -1.162 0 O-C-N 119.639 -1.913 . . . . 0.0 110.829 167.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -138.83 146.01 40.74 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 100.33 -3.952 . . . . 0.0 100.33 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -142.66 151.8 41.77 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 121.719 0.771 . . . . 0.0 110.151 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.3 t -105.23 140.62 38.11 Favored 'General case' 0 C--N 1.358 0.952 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.419 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.327 7.4 mm-40 -80.82 -9.27 59.83 Favored 'General case' 0 C--O 1.203 -1.369 0 C-N-CA 127.874 2.47 . . . . 0.0 116.309 -179.233 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.06 -48.3 82.38 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 125.731 3.878 . . . . 0.0 118.367 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.53 HD11 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.81 -34.23 77.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-O 125.024 2.345 . . . . 0.0 112.365 172.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.53 ' H ' HD11 ' A' ' 49' ' ' LEU 0.292 0.7 OUTLIER -68.09 -44.43 76.26 Favored 'General case' 0 C--O 1.196 -1.729 0 C-N-CA 129.671 3.188 . . . . 0.0 107.03 172.79 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -54.58 -37.83 65.99 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 129.461 3.104 . . . . 0.0 111.253 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -71.87 -39.34 69.7 Favored 'General case' 0 C--N 1.374 1.645 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 163.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.66 95.03 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 124.607 3.367 . . . . 0.0 115.345 170.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.495 ' CG1' HD23 ' A' ' 50' ' ' LEU . 56.7 mt -58.8 -45.79 91.22 Favored 'Isoleucine or valine' 0 C--N 1.368 1.389 1 C-N-CA 133.686 4.795 . . . . 0.0 112.562 176.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -106.99 -21.89 12.85 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 118.659 2.836 . . . . 0.0 118.659 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.4 ttp-105 -87.32 -30.91 20.48 Favored 'General case' 0 C--N 1.366 1.305 0 CA-C-N 123.893 3.042 . . . . 0.0 111.498 -178.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -102.75 -57.56 2.03 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.689 1.595 . . . . 0.0 111.309 -176.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.557 0.2 OUTLIER 55.44 135.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 C-N-CA 129.152 2.981 . . . . 0.0 114.379 178.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.402 ' CB ' ' HD2' ' A' ' 139' ' ' ARG 0.718 32.8 t70 61.07 25.26 15.3 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 127.784 2.433 . . . . 0.0 113.73 -174.54 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.873 0.4 OUTLIER -65.42 58.31 0.03 OUTLIER 'General case' 0 C--O 1.2 -1.539 0 C-N-CA 129.597 3.159 . . . . 0.0 117.314 -177.09 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.503 1.7 p -78.6 -10.01 59.58 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 130.977 3.711 . . . . 0.0 114.681 174.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -68.18 -34.23 75.91 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.238 3.015 . . . . 0.0 108.156 165.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD1' ' A' ' 64' ' ' PHE 0.279 0.4 OUTLIER -62.87 -46.04 97.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.362 0 C-N-CA 129.623 3.169 . . . . 0.0 107.929 177.957 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.447 ' CD2' ' HB3' ' A' ' 21' ' ' GLU . 85.1 m-85 -61.44 -32.61 72.59 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 131.678 3.991 . . . . 0.0 115.175 164.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -73.61 -43.44 59.64 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-N 123.63 2.923 . . . . 0.0 112.016 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.472 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 0.9 OUTLIER -70.64 -40.32 73.13 Favored 'General case' 0 CA--C 1.559 1.324 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.913 0.0 OUTLIER -77.76 -16.28 58.51 Favored 'General case' 0 C--N 1.377 1.787 0 O-C-N 119.972 -1.705 . . . . 0.0 114.754 176.315 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.432 ' CD2' ' O ' ' A' ' 64' ' ' PHE . 31.3 m-70 -76.29 -30.24 57.69 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.972 2.509 . . . . 0.0 108.622 163.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -72.26 -25.49 61.63 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.473 -2.017 . . . . 0.0 112.301 163.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -74.68 -31.63 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 C-N-CA 128.463 2.705 . . . . 0.0 111.581 172.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 pttp -52.68 -24.54 8.75 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 129.949 3.299 . . . . 0.0 118.676 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.267 35.8 t70 -97.37 -27.24 14.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.155 2.182 . . . . 0.0 109.513 -175.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.502 ' CE1' ' N ' ' A' ' 152' ' ' THR . 16.0 m-70 -77.28 6.79 6.09 Favored 'General case' 0 C--N 1.368 1.377 1 C-N-CA 132.454 4.302 . . . . 0.0 114.708 -174.501 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.0 t -36.72 -35.68 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 C-N-CA 129.16 2.984 . . . . 0.0 115.915 166.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.29 -34.25 72.53 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.783 -1.823 . . . . 0.0 113.6 177.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.456 ' HA ' ' HG2' ' A' ' 79' ' ' GLU 0.323 35.0 mt-10 -76.41 -34.04 58.81 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.294 1.438 . . . . 0.0 113.794 171.715 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.345 1.9 m -70.72 -36.96 67.24 Favored 'Isoleucine or valine' 0 C--N 1.377 1.785 0 CA-C-O 125.439 2.542 . . . . 0.0 110.68 172.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -65.34 -32.41 74.03 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 128.107 2.563 . . . . 0.0 112.559 169.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 76' ' ' GLU 0.404 5.6 pt-20 -71.5 -29.66 65.05 Favored 'General case' 0 C--N 1.369 1.439 0 O-C-N 117.7 -3.125 . . . . 0.0 112.33 164.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -74.41 -5.59 43.29 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 128.14 2.576 . . . . 0.0 114.197 168.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.425 ' CD2' HG22 ' A' ' 38' ' ' VAL . 2.9 pp -40.04 -46.73 2.17 Favored 'General case' 0 N--CA 1.508 2.43 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 -164.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 60.3 p -112.6 -49.15 2.96 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-N 125.404 3.729 . . . . 0.0 113.175 138.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.41 ' HE2' ' CG2' ' A' ' 97' ' ' VAL . 0.8 OUTLIER -130.13 169.52 13.24 Favored Pre-proline 0 N--CA 1.442 -0.839 2 C-N-CA 144.316 9.046 . . . . 0.0 99.519 156.353 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -52.32 149.45 22.71 Favored 'Trans proline' 0 CA--C 1.568 2.187 1 CA-C-N 129.663 4.487 . . . . 0.0 113.486 171.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . 0.281 21.6 Cg_exo -32.98 148.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.908 2 C-N-CA 127.95 5.766 . . . . 0.0 125.345 -151.173 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 24.7 mtm180 -105.87 53.24 0.15 Allowed Pre-proline 0 C--N 1.374 1.656 0 N-CA-C 118.584 2.809 . . . . 0.0 118.584 174.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -51.35 160.89 2.06 Favored 'Trans proline' 0 C--N 1.373 1.856 1 C-N-CA 129.051 6.501 . . . . 0.0 117.369 170.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -43.76 -43.21 5.94 Favored 'General case' 0 C--N 1.359 1.021 1 C-N-CA 133.005 4.522 . . . . 0.0 118.305 -173.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -77.47 154.25 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 127.79 2.436 . . . . 0.0 114.653 173.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -115.64 -11.44 11.69 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 112.972 -1.922 . . . . 0.0 110.209 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -104.69 -27.67 11.67 Favored 'General case' 0 C--N 1.354 0.795 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -175.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -109.92 1.83 19.39 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 126.855 2.062 . . . . 0.0 111.328 -176.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.332 0.2 OUTLIER -140.16 -86.85 0.2 Allowed 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 179.894 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . 0.306 0.4 OUTLIER -84.56 87.33 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.861 0 CA-C-O 127.849 3.69 . . . . 0.0 117.542 -169.661 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -106.18 -19.16 13.8 Favored 'General case' 0 C--N 1.313 -0.995 2 CA-C-N 105.142 -5.481 . . . . 0.0 110.118 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -91.91 -9.79 62.06 Favored Glycine 0 C--N 1.363 2.039 0 C-N-CA 127.097 2.284 . . . . 0.0 110.761 174.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.41 ' CG2' ' HE2' ' A' ' 83' ' ' MET . 68.7 t -91.85 91.62 3.56 Favored 'Isoleucine or valine' 0 C--N 1.372 1.553 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 173.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -115.22 19.13 15.83 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 127.934 2.494 . . . . 0.0 108.475 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 57.39 70.88 0.61 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 130.393 3.477 . . . . 0.0 115.778 -177.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.2 mmm180 -112.15 167.05 9.73 Favored Pre-proline 0 C--N 1.358 0.962 0 C-N-CA 125.364 1.466 . . . . 0.0 111.426 -175.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -62.18 135.62 55.55 Favored 'Trans proline' 0 C--N 1.362 1.247 1 C-N-CA 125.332 4.021 . . . . 0.0 116.614 176.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.05 56.5 4.61 Favored Glycine 0 C--N 1.361 1.928 0 C-N-CA 125.235 1.398 . . . . 0.0 113.701 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -137.01 158.01 45.44 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 120.467 -1.607 . . . . 0.0 111.411 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 12.7 tp -133.02 151.77 52.03 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.397 1.879 . . . . 0.0 113.132 -175.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -125.92 118.2 24.91 Favored 'General case' 0 C--N 1.369 1.433 0 N-CA-C 103.649 -2.722 . . . . 0.0 103.649 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.415 ' HB ' ' HB2' ' A' ' 113' ' ' LEU . 1.0 OUTLIER -122.95 119.19 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 126.882 2.073 . . . . 0.0 106.676 -174.173 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.638 HG21 ' H ' ' A' ' 149' ' ' VAL . 2.9 m -127.21 108.23 10.71 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.443 ' CG ' HD21 ' A' ' 66' ' ' LEU . 53.0 t0 -159.17 161.61 36.23 Favored 'General case' 0 CA--C 1.482 -1.657 0 N-CA-C 101.087 -3.671 . . . . 0.0 101.087 -172.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.472 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 83.8 -38.0 2.81 Favored Glycine 0 N--CA 1.474 1.222 0 O-C-N 119.708 -1.87 . . . . 0.0 114.251 174.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 108.95 0.3 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.613 1 C-N-CA 136.157 5.783 . . . . 0.0 108.19 -161.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.443 HD11 ' CG1' ' A' ' 136' ' ' ILE . 2.3 tp -79.78 129.36 34.41 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 128.867 2.867 . . . . 0.0 109.264 175.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.7 m95 -96.73 100.97 12.5 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 170.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.415 ' HB2' ' HB ' ' A' ' 106' ' ' ILE 0.319 2.0 mm? -97.26 131.24 44.17 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 173.25 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -105.92 125.3 8.15 Favored Glycine 0 C--N 1.351 1.394 0 N-CA-C 107.234 -2.346 . . . . 0.0 107.234 162.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . 0.294 1.0 OUTLIER -118.56 152.54 35.82 Favored 'General case' 0 C--N 1.374 1.667 0 CA-C-N 122.373 3.087 . . . . 0.0 106.712 179.163 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.7 m -122.27 137.8 54.72 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 100.438 -3.912 . . . . 0.0 100.438 166.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.22 128.64 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.369 0 N-CA-C 100.702 -3.814 . . . . 0.0 100.702 165.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.67 ' CB ' HD22 ' A' ' 121' ' ' ASN . 14.2 p 40.31 -137.4 0.12 Allowed 'General case' 0 C--N 1.363 1.163 0 N-CA-C 121.266 3.802 . . . . 0.0 121.266 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.359 88.3 tttt 159.31 -65.72 0.0 OUTLIER Pre-proline 0 N--CA 1.421 -1.885 2 C-N-CA 133.879 4.872 . . . . 0.0 109.182 161.812 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -75.46 53.62 3.59 Favored 'Trans proline' 0 CA--C 1.554 1.515 0 C-N-CA 123.267 2.644 . . . . 0.0 115.431 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.67 HD22 ' CB ' ' A' ' 118' ' ' CYS . 0.4 OUTLIER -170.16 172.32 6.41 Favored 'General case' 0 C--N 1.371 1.5 0 N-CA-C 117.148 2.277 . . . . 0.0 117.148 -177.542 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.557 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 29.0 tt0 -141.83 -91.29 0.14 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 128.495 2.718 . . . . 0.0 105.634 156.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.402 ' HD2' ' H ' ' A' ' 122' ' ' GLU . 6.9 mptt 50.77 14.85 0.2 Allowed 'General case' 0 C--N 1.364 1.223 1 C-N-CA 136.735 6.014 . . . . 0.0 117.505 -172.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.557 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -169.83 -119.83 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.171 0 C-N-CA 130.669 3.588 . . . . 0.0 106.964 -167.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -108.72 -65.53 1.13 Allowed 'General case' 0 N--CA 1.425 -1.712 0 N-CA-C 102.634 -3.098 . . . . 0.0 102.634 171.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -177.31 145.98 0.62 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 128.341 2.657 . . . . 0.0 107.893 169.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -147.2 38.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.065 0 N-CA-C 118.681 2.531 . . . . 0.0 118.681 -171.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.8 m -144.06 156.37 44.35 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 170.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.24 130.47 53.38 Favored 'General case' 0 C--N 1.358 0.978 1 N-CA-C 99.001 -4.444 . . . . 0.0 99.001 159.739 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . 0.327 35.9 mt-30 -119.99 72.39 0.93 Allowed 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 120.232 -1.542 . . . . 0.0 107.311 -172.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.256 4.8 t 104.12 117.1 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 125.597 1.559 . . . . 0.0 110.124 -177.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -114.87 113.86 24.76 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 173.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.0 ttp -94.01 108.16 20.01 Favored 'General case' 0 CA--C 1.497 -1.063 0 C-N-CA 126.077 1.751 . . . . 0.0 108.465 -177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.428 ' H ' ' CD2' ' A' ' 49' ' ' LEU . . . -123.61 114.81 20.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 121.276 0.56 . . . . 0.0 110.227 -172.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 6.3 mm -134.68 134.17 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.398 1.079 . . . . 0.0 110.544 178.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.443 ' CG1' HD11 ' A' ' 111' ' ' LEU . 0.1 OUTLIER -142.65 -179.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.15 0 C-N-CA 127.488 2.315 . . . . 0.0 113.278 -173.087 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.88 106.34 18.32 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 131.156 3.782 . . . . 0.0 107.719 155.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.439 ' H ' ' CG ' ' A' ' 141' ' ' LEU 0.277 0.4 OUTLIER -96.59 -91.91 0.23 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 120.069 3.359 . . . . 0.0 120.069 -175.838 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.654 ' H ' HD22 ' A' ' 141' ' ' LEU . 27.0 mtp180 -127.55 -51.99 1.37 Allowed 'General case' 0 C--N 1.371 1.5 0 CA-C-O 123.384 1.564 . . . . 0.0 109.2 -158.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.436 ' HG2' ' HB2' ' A' ' 139' ' ' ARG . 1.6 ptm180 -123.58 19.95 9.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 129.729 3.212 . . . . 0.0 111.335 -168.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.654 HD22 ' H ' ' A' ' 139' ' ' ARG . 0.4 OUTLIER -138.83 164.8 37.07 Favored Pre-proline 0 CA--C 1.492 -1.255 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.871 -170.325 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.59 -41.15 0.85 Allowed 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 124.566 3.511 . . . . 0.0 114.592 171.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 74.2 156.75 4.76 Favored Glycine 0 CA--C 1.496 -1.143 0 C-N-CA 129.567 3.46 . . . . 0.0 115.625 -162.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -85.96 98.71 10.96 Favored 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 128.596 2.758 . . . . 0.0 112.293 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 74.72 -167.59 0.09 Allowed 'General case' 0 C--N 1.36 1.06 0 C-N-CA 129.17 2.988 . . . . 0.0 115.65 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 7.6 p -171.84 136.15 0.89 Allowed 'General case' 0 C--N 1.361 1.106 0 C-N-CA 126.044 1.738 . . . . 0.0 108.575 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 19.1 tptt 168.01 155.61 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 101.986 -3.338 . . . . 0.0 101.986 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -150.03 85.93 1.42 Allowed 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 -176.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.638 ' H ' HG21 ' A' ' 107' ' ' THR . 50.6 t -77.07 -53.81 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 C-N-CA 130.578 3.551 . . . . 0.0 115.169 -169.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 1.2 pp -107.3 146.08 13.95 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 C-N-CA 131.444 3.898 . . . . 0.0 112.948 -174.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.443 68.6 mttt -114.43 148.19 38.12 Favored 'General case' 0 C--N 1.355 0.845 1 N-CA-C 98.48 -4.637 . . . . 0.0 98.48 148.268 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.502 ' N ' ' CE1' ' A' ' 73' ' ' HIS 0.994 0.5 OUTLIER -76.82 146.05 38.04 Favored 'General case' 0 N--CA 1.494 1.74 1 N-CA-C 129.65 6.907 . . . . 0.0 129.65 -134.56 . . . . . . . . 5 4 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 . . . . . 0 N--CA 1.416 -2.133 2 C-N-CA 135.27 5.428 . . . . 0.0 105.418 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.7 tmm? . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . 0.452 7.7 p 73.39 179.76 0.21 Allowed 'General case' 0 C--N 1.358 0.952 0 C-N-CA 127.806 2.442 . . . . 0.0 117.406 -177.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.5 mm -83.75 44.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.364 1.21 0 C-N-CA 128.198 2.599 . . . . 0.0 115.04 -171.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.522 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 18.1 m-80 -59.44 -8.66 1.91 Allowed 'General case' 0 N--CA 1.476 0.856 1 C-N-CA 133.07 4.548 . . . . 0.0 115.838 176.1 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.74 -57.91 10.39 Favored 'General case' 0 C--N 1.347 0.495 1 C-N-CA 133.268 4.627 . . . . 0.0 111.694 171.594 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.0 -15.24 61.1 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.562 2.345 . . . . 0.0 113.294 177.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.522 ' CG1' ' HA ' ' A' ' 4' ' ' ASN 0.252 0.6 OUTLIER -87.77 -37.03 10.28 Favored 'Isoleucine or valine' 0 C--N 1.355 0.827 0 C-N-CA 127.514 2.325 . . . . 0.0 110.565 179.304 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -70.26 -40.42 74.38 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 129.435 3.094 . . . . 0.0 108.795 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.17 -43.91 99.08 Favored 'Isoleucine or valine' 0 C--N 1.376 1.759 0 C-N-CA 125.02 1.328 . . . . 0.0 109.629 165.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.269 0.3 OUTLIER -58.11 -49.35 77.26 Favored 'General case' 0 C--N 1.37 1.472 0 N-CA-C 116.175 1.917 . . . . 0.0 116.175 171.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.4 -31.39 72.06 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 169.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -77.15 -51.24 11.33 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 126.93 2.092 . . . . 0.0 111.846 174.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -59.11 -28.76 66.83 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.173 3.389 . . . . 0.0 110.15 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -51.6 30.18 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 124.779 1.232 . . . . 0.0 111.27 167.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.3 ttt-85 -55.08 -39.56 69.43 Favored 'General case' 0 CA--C 1.566 1.587 0 C-N-CA 125.692 1.597 . . . . 0.0 112.622 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.5 mmt-85 -63.39 -43.86 96.37 Favored 'General case' 0 C--N 1.38 1.9 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 165.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.2 m-70 -56.89 -49.6 75.05 Favored 'General case' 0 C--N 1.39 2.368 0 C-N-CA 128.878 2.871 . . . . 0.0 110.327 171.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.441 ' CE2' HD12 ' A' ' 50' ' ' LEU . 1.4 t80 -54.92 -54.21 45.58 Favored 'General case' 0 C--N 1.379 1.864 0 C-N-CA 131.107 3.763 . . . . 0.0 110.079 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.72 -42.48 67.27 Favored 'General case' 0 C--N 1.372 1.58 0 N-CA-C 119.336 3.088 . . . . 0.0 119.336 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.6 m -69.95 -42.74 72.82 Favored 'General case' 0 C--N 1.363 1.183 0 C-N-CA 127.047 2.139 . . . . 0.0 113.337 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.505 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 4.5 mp0 -74.84 -29.19 60.97 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.208 1.403 . . . . 0.0 109.878 171.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.264 0.2 OUTLIER -62.26 -34.18 76.05 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.043 -1.66 . . . . 0.0 113.275 166.393 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -62.99 -37.55 87.62 Favored 'General case' 0 C--N 1.381 1.974 0 C-N-CA 124.313 1.045 . . . . 0.0 111.432 167.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 tp60 -60.16 -47.71 84.77 Favored 'General case' 0 C--N 1.371 1.537 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 166.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.6 mt -66.84 -45.11 88.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 O-C-N 120.942 -1.099 . . . . 0.0 112.162 178.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.423 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.56 0.7 OUTLIER -72.75 -23.02 60.77 Favored 'General case' 0 C--N 1.366 1.322 0 O-C-N 120.248 -1.533 . . . . 0.0 114.796 173.528 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -73.38 -36.09 66.01 Favored 'General case' 0 C--N 1.362 1.149 0 O-C-N 120.223 -1.548 . . . . 0.0 112.41 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.486 ' HG2' ' HG2' ' A' ' 71' ' ' LYS . 4.0 tp10 -74.03 -43.32 58.34 Favored 'General case' 0 C--N 1.394 2.521 0 O-C-N 119.281 -2.137 . . . . 0.0 109.645 171.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.423 HG13 ' HA ' ' A' ' 26' ' ' ASN 0.431 0.7 OUTLIER -63.66 -42.55 96.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 CA-C-N 120.714 1.597 . . . . 0.0 115.058 176.507 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -71.12 -32.34 68.89 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 120.204 1.366 . . . . 0.0 114.114 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 13.3 pt-20 -76.45 -39.62 52.83 Favored 'General case' 0 C--N 1.377 1.781 0 O-C-N 119.449 -2.032 . . . . 0.0 111.275 177.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.63 -44.58 56.61 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.348 1.459 . . . . 0.0 114.277 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.263 59.5 p -68.43 -30.37 69.25 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 120.092 -1.63 . . . . 0.0 112.481 175.039 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -70.05 -47.35 62.37 Favored 'General case' 0 C--N 1.379 1.848 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 162.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.41 -33.09 74.92 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 126.421 1.888 . . . . 0.0 115.988 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -14.96 61.48 Favored 'General case' 0 C--N 1.376 1.72 0 CA-C-N 119.865 1.211 . . . . 0.0 112.645 168.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 17.91 47.41 Favored Glycine 0 C--N 1.385 3.251 0 O-C-N 121.076 -1.015 . . . . 0.0 113.324 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . 0.277 0.6 OUTLIER -107.84 177.24 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.987 0 C-N-CA 126.534 1.934 . . . . 0.0 107.224 -174.868 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 6.94 -65.89 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.564 2 C-N-CA 135.758 5.623 . . . . 0.0 122.019 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.0 m 80.28 88.72 0.05 OUTLIER 'General case' 0 C--N 1.36 1.05 1 C-N-CA 132.075 4.15 . . . . 0.0 102.422 -165.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.469 ' CZ ' HG23 ' A' ' 77' ' ' VAL 0.321 52.0 p90 -111.15 140.87 45.34 Favored 'General case' 0 C--N 1.361 1.1 0 CA-C-O 122.743 1.259 . . . . 0.0 109.666 -167.173 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -100.96 162.4 12.92 Favored 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 126.148 1.779 . . . . 0.0 106.808 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.72 122.46 44.59 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.014 0.926 . . . . 0.0 108.916 -178.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -137.49 141.38 41.5 Favored 'General case' 0 N--CA 1.426 -1.663 1 N-CA-C 99.233 -4.358 . . . . 0.0 99.233 174.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.427 ' CE2' HD12 ' A' ' 50' ' ' LEU . 3.6 p90 -130.96 155.02 47.5 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 174.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.9 m -99.62 139.61 35.03 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 104.782 -2.303 . . . . 0.0 104.782 167.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -79.44 -8.74 59.33 Favored 'General case' 0 C--O 1.208 -1.129 0 C-N-CA 128.805 2.842 . . . . 0.0 116.374 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.38 96.6 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 124.447 3.294 . . . . 0.0 116.539 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.567 ' H ' HD21 ' A' ' 49' ' ' LEU 0.321 0.2 OUTLIER -68.62 -39.07 80.98 Favored 'General case' 0 CA--C 1.444 -3.127 0 C-N-CA 130.065 3.346 . . . . 0.0 113.151 174.884 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.484 HD21 ' CG1' ' A' ' 54' ' ' ILE 0.286 0.2 OUTLIER -65.01 -45.98 83.3 Favored 'General case' 0 C--O 1.202 -1.415 1 CA-C-N 108.304 -4.044 . . . . 0.0 108.991 170.71 . . . . . . . . 5 4 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -55.02 -34.32 63.39 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 117.28 -3.387 . . . . 0.0 110.915 170.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -76.63 -27.05 55.55 Favored 'General case' 0 C--N 1.365 1.281 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 166.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.0 -49.26 11.16 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 117.493 -3.254 . . . . 0.0 113.921 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.484 ' CG1' HD21 ' A' ' 50' ' ' LEU . 66.8 mt -51.56 -43.3 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 1 C-N-CA 134.686 5.194 . . . . 0.0 111.461 174.975 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.0 -26.0 11.36 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 119.549 3.166 . . . . 0.0 119.549 171.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -85.44 -16.6 39.16 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-N 124.394 3.27 . . . . 0.0 113.015 -175.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -121.59 -56.76 1.86 Allowed 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 128.443 2.697 . . . . 0.0 110.268 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.405 HD11 ' N ' ' A' ' 59' ' ' ASP 0.608 0.0 OUTLIER 73.6 -169.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 C-N-CA 129.894 3.278 . . . . 0.0 108.925 -178.089 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.405 ' N ' HD11 ' A' ' 58' ' ' ILE . 13.2 t70 -8.25 69.24 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.791 1 C-N-CA 133.756 4.822 . . . . 0.0 116.275 173.741 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.393 11.7 pt-20 -98.51 62.17 1.42 Allowed 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 129.469 3.108 . . . . 0.0 108.682 -173.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.389 24.3 p -79.21 -11.91 59.97 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 126.793 3.187 . . . . 0.0 113.244 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -69.56 -33.58 72.96 Favored 'General case' 0 CA--C 1.551 1.003 1 C-N-CA 133.131 4.572 . . . . 0.0 109.692 166.499 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.423 HG21 HD13 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -61.98 -44.96 99.64 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 C-N-CA 128.477 2.711 . . . . 0.0 108.767 -178.381 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.505 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.287 43.9 m-85 -62.42 -45.27 93.84 Favored 'General case' 0 C--O 1.205 -1.249 1 C-N-CA 134.38 5.072 . . . . 0.0 111.976 167.34 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -61.48 -46.21 90.98 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 124.902 3.501 . . . . 0.0 115.575 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.472 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 2.0 tm? -67.76 -45.94 73.5 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.744 1.217 . . . . 0.0 113.908 169.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.964 0.0 OUTLIER -77.05 -16.13 59.36 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.153 -2.217 . . . . 0.0 115.869 -179.616 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.487 ' HD1' ' HD3' ' A' ' 71' ' ' LYS . 41.0 m-70 -72.65 -36.64 68.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 130.066 3.346 . . . . 0.0 107.214 162.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.95 -15.85 61.11 Favored 'General case' 0 CA--C 1.59 2.518 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.636 HG22 ' CD2' ' A' ' 73' ' ' HIS . 4.4 mm -86.23 -40.15 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 128.079 2.552 . . . . 0.0 113.743 171.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.487 ' HD3' ' HD1' ' A' ' 68' ' ' HIS . 31.6 ttpt -52.75 -14.27 0.52 Allowed 'General case' 0 N--CA 1.503 2.203 1 C-N-CA 136.104 5.762 . . . . 0.0 115.951 175.496 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.343 35.3 t70 -80.89 -34.51 33.47 Favored 'General case' 0 N--CA 1.432 -1.369 1 C-N-CA 135.97 5.708 . . . . 0.0 111.014 176.914 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.636 ' CD2' HG22 ' A' ' 70' ' ' ILE 0.371 0.0 OUTLIER -88.12 24.31 1.88 Allowed 'General case' 0 CA--C 1.487 -1.459 0 C-N-CA 130.103 3.361 . . . . 0.0 116.573 -168.407 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.464 ' HA ' HG12 ' A' ' 77' ' ' VAL . 73.1 t -38.4 -33.51 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 129.206 3.002 . . . . 0.0 113.989 158.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -64.92 -39.5 93.6 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 131.217 3.807 . . . . 0.0 115.628 171.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -74.82 -36.74 62.42 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 127.039 2.135 . . . . 0.0 111.921 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.469 HG23 ' CZ ' ' A' ' 41' ' ' PHE 0.514 0.2 OUTLIER -71.34 -28.85 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-O 124.178 1.942 . . . . 0.0 113.149 172.801 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -47.66 80.71 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 128.765 2.826 . . . . 0.0 110.957 164.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -59.26 -30.49 68.33 Favored 'General case' 0 C--N 1.382 2.002 0 C-N-CA 126.459 1.903 . . . . 0.0 114.58 168.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -68.57 -37.9 80.27 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 127.652 2.381 . . . . 0.0 112.697 171.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.457 HD23 ' HB2' ' A' ' 125' ' ' LYS . 2.3 tm? -75.41 -12.9 60.35 Favored 'General case' 0 C--N 1.377 1.791 0 C-N-CA 129.227 3.011 . . . . 0.0 111.489 170.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.4 t -87.02 3.12 47.25 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 128.835 2.854 . . . . 0.0 117.587 -174.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.48 ' HE3' ' CG2' ' A' ' 97' ' ' VAL . 6.5 ttt -79.19 153.51 77.02 Favored Pre-proline 0 C--N 1.371 1.514 0 CA-C-O 115.388 -2.244 . . . . 0.0 105.495 171.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -62.08 -179.29 0.41 Allowed 'Trans proline' 0 CA--C 1.553 1.471 1 C-N-CA 125.864 4.376 . . . . 0.0 116.594 -168.183 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.73 149.78 74.93 Favored 'Trans proline' 0 C--N 1.37 1.704 0 CA-C-N 127.343 3.658 . . . . 0.0 113.522 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.57 HH11 HG22 ' A' ' 97' ' ' VAL 0.327 10.6 mmt85 -102.19 53.13 0.05 OUTLIER Pre-proline 0 CA--C 1.595 2.674 1 N-CA-C 121.906 4.039 . . . . 0.0 121.906 178.123 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 93' ' ' PHE 0.306 81.3 Cg_exo -67.48 160.28 48.59 Favored 'Trans proline' 0 C--N 1.388 2.624 1 C-N-CA 129.59 6.86 . . . . 0.0 117.004 170.887 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -23.24 -29.89 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 2 C-N-CA 135.401 5.481 . . . . 0.0 124.317 177.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . 0.273 0.0 OUTLIER -60.06 -156.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 1 C-N-CA 133.842 4.857 . . . . 0.0 119.65 179.869 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -146.36 -12.05 0.47 Allowed 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 129.669 3.188 . . . . 0.0 109.584 176.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -87.35 -13.64 42.96 Favored 'General case' 0 C--N 1.351 0.649 0 CA-C-O 123.097 1.427 . . . . 0.0 108.836 164.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.406 ' O ' ' HA ' ' A' ' 86' ' ' ARG . 1.0 OUTLIER -138.72 -3.15 1.68 Allowed 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 126.704 2.001 . . . . 0.0 114.782 -176.527 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.407 ' HB2' ' O ' ' A' ' 87' ' ' PRO 0.355 3.2 t80 -137.03 93.15 2.8 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-O 126.059 2.838 . . . . 0.0 109.042 175.529 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.417 ' HB ' ' HE2' ' A' ' 83' ' ' MET 0.375 6.7 mt -103.93 93.11 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.519 1 CA-C-N 108.343 -4.026 . . . . 0.0 121.781 -152.651 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.27 5.2 t70 31.11 -63.21 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.662 1 C-N-CA 132.666 4.386 . . . . 0.0 120.974 177.987 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -72.63 -9.12 73.7 Favored Glycine 0 C--N 1.37 2.437 0 C-N-CA 127.303 2.382 . . . . 0.0 113.242 165.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.57 HG22 HH11 ' A' ' 86' ' ' ARG . 55.8 t -82.13 98.0 4.28 Favored 'Isoleucine or valine' 0 C--N 1.365 1.247 0 C-N-CA 128.692 2.797 . . . . 0.0 107.3 171.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . 0.319 64.1 tt0 46.39 -23.81 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 2 N-CA-C 123.756 4.724 . . . . 0.0 123.756 178.298 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.99 -63.01 1.18 Allowed 'General case' 0 CA--C 1.532 0.285 1 C-N-CA 133.369 4.667 . . . . 0.0 111.539 178.641 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -112.25 164.78 14.42 Favored Pre-proline 0 C--N 1.354 0.781 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 171.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -59.18 144.43 99.39 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 125.133 3.889 . . . . 0.0 117.427 -174.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -104.6 60.1 0.44 Allowed Glycine 0 C--N 1.354 1.563 0 C-N-CA 126.3 1.905 . . . . 0.0 109.173 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 43.1 ptt85 -118.57 149.57 41.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.937 1.827 . . . . 0.0 113.996 -176.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.87 143.39 47.0 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 129.255 3.022 . . . . 0.0 108.305 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -129.88 117.83 20.78 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 103.035 -2.95 . . . . 0.0 103.035 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.416 ' HB ' ' CD1' ' A' ' 150' ' ' ILE 0.319 15.4 pt -135.57 140.98 43.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 C-N-CA 127.175 2.19 . . . . 0.0 107.664 -175.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.6 m -132.93 125.09 29.07 Favored 'General case' 0 CA--C 1.497 -1.087 0 O-C-N 118.252 -2.78 . . . . 0.0 106.29 -172.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -148.12 162.49 39.31 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 103.128 -2.915 . . . . 0.0 103.128 -169.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.472 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 84.29 -61.33 4.73 Favored Glycine 0 N--CA 1.479 1.552 0 O-C-N 119.885 -1.759 . . . . 0.0 115.793 170.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 162.12 -30.34 0.0 OUTLIER 'General case' 0 CA--C 1.563 1.456 1 C-N-CA 137.845 6.458 . . . . 0.0 106.611 -167.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.423 HD13 HG21 ' A' ' 63' ' ' VAL 0.559 0.5 OUTLIER -79.56 136.61 36.91 Favored 'General case' 0 C--N 1.379 1.878 2 C-N-CA 132.657 4.383 . . . . 0.0 122.358 -175.908 . . . . . . . . 5 4 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -90.32 101.84 14.57 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.276 0.2 OUTLIER -94.49 131.57 40.06 Favored 'General case' 0 C--N 1.383 2.032 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 177.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.92 127.19 7.69 Favored Glycine 0 C--N 1.353 1.514 0 N-CA-C 105.95 -2.86 . . . . 0.0 105.95 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -120.95 139.93 52.57 Favored 'General case' 0 C--N 1.368 1.405 0 N-CA-C 104.121 -2.548 . . . . 0.0 104.121 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -132.52 137.42 47.16 Favored 'General case' 0 CA--C 1.481 -1.688 0 N-CA-C 100.956 -3.72 . . . . 0.0 100.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -68.62 164.04 2.9 Favored 'Isoleucine or valine' 0 C--N 1.368 1.39 0 CA-C-N 120.282 1.401 . . . . 0.0 109.41 169.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.442 ' SG ' ' HD2' ' A' ' 127' ' ' PRO . 24.8 p -39.04 99.2 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 126.662 1.985 . . . . 0.0 115.813 169.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.264 54.5 tptt -68.02 -40.62 23.3 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 119.404 3.113 . . . . 0.0 119.404 -168.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -100.15 58.46 0.04 OUTLIER 'Trans proline' 0 CA--C 1.549 1.271 0 CA-C-N 125.327 2.938 . . . . 0.0 111.165 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.418 ' N ' HD21 ' A' ' 121' ' ' ASN . 0.2 OUTLIER 174.34 -173.83 0.07 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 125.721 1.609 . . . . 0.0 107.009 -175.118 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.424 ' H ' ' HD2' ' A' ' 123' ' ' LYS . 2.9 tp10 -156.09 -77.54 0.09 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 153.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.424 ' HD2' ' H ' ' A' ' 122' ' ' GLU 0.3 1.7 mptp? 60.84 -32.54 0.07 Allowed 'General case' 0 N--CA 1.436 -1.15 1 C-N-CA 135.58 5.552 . . . . 0.0 117.137 -172.872 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.408 ' H ' ' C ' ' A' ' 122' ' ' GLU . 0.1 OUTLIER -109.31 -149.07 0.43 Allowed 'General case' 0 N--CA 1.442 -0.827 1 C-N-CA 132.119 4.168 . . . . 0.0 109.602 -179.523 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.457 ' HB2' HD23 ' A' ' 81' ' ' LEU 0.306 0.0 OUTLIER -99.7 -54.01 3.03 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 129.066 2.947 . . . . 0.0 107.456 172.534 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -171.65 107.36 0.38 Allowed Pre-proline 0 C--N 1.356 0.886 0 C-N-CA 125.485 1.514 . . . . 0.0 114.199 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.442 ' HD2' ' SG ' ' A' ' 118' ' ' CYS . 8.2 Cg_endo -121.69 19.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.375 1.957 0 CA-C-N 124.015 2.47 . . . . 0.0 118.125 174.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.26 0.7 OUTLIER -146.29 153.5 40.63 Favored 'General case' 0 CA--C 1.479 -1.769 0 N-CA-C 103.361 -2.829 . . . . 0.0 103.361 159.256 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mt -103.82 135.03 46.13 Favored 'General case' 0 C--N 1.365 1.27 1 N-CA-C 99.758 -4.164 . . . . 0.0 99.758 161.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -129.95 74.85 1.61 Allowed 'General case' 0 CA--C 1.488 -1.41 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 -173.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 45' ' ' TYR 0.285 71.7 m 120.85 78.48 0.0 OUTLIER 'General case' 0 C--N 1.359 1.013 0 N-CA-C 103.845 -2.65 . . . . 0.0 103.845 -174.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -101.66 109.03 20.74 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 102.537 -3.134 . . . . 0.0 102.537 170.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.35 135.17 50.09 Favored 'General case' 0 C--N 1.348 0.528 0 C-N-CA 127.06 2.144 . . . . 0.0 111.134 -174.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.07 116.29 19.06 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 126.62 1.968 . . . . 0.0 110.647 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -135.2 133.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.365 1.255 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 174.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.508 ' CG2' ' H ' ' A' ' 137' ' ' ASN . 0.2 OUTLIER -121.35 -167.92 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.764 0 C-N-CA 127.432 2.293 . . . . 0.0 112.225 -172.243 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.508 ' H ' ' CG2' ' A' ' 136' ' ' ILE . 0.4 OUTLIER -177.19 -173.49 0.45 Allowed 'General case' 0 CA--C 1.476 -1.885 1 C-N-CA 137.991 6.517 . . . . 0.0 106.989 177.353 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.595 ' HB2' ' CD ' ' A' ' 139' ' ' ARG 0.375 12.5 m 153.81 -49.94 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 109.923 -3.308 . . . . 0.0 103.975 -168.064 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.595 ' CD ' ' HB2' ' A' ' 138' ' ' SER . 0.0 OUTLIER -133.17 -78.66 0.48 Allowed 'General case' 0 N--CA 1.424 -1.765 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.985 -157.421 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.568 ' HG3' ' CD ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -105.89 -19.44 13.74 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 130.222 3.409 . . . . 0.0 119.394 -165.413 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.455 ' HB2' ' CA ' ' A' ' 137' ' ' ASN . 2.7 mt -83.75 158.32 62.61 Favored Pre-proline 0 N--CA 1.439 -1.019 0 C-N-CA 129.647 3.179 . . . . 0.0 114.049 -162.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -80.02 -41.19 0.19 Allowed 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 124.489 3.459 . . . . 0.0 114.237 -170.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 87.14 -91.94 1.77 Allowed Glycine 0 CA--C 1.493 -1.342 1 C-N-CA 131.96 4.6 . . . . 0.0 119.105 166.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . 0.253 22.4 pttp -53.35 90.77 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 120.943 3.683 . . . . 0.0 120.943 -165.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -144.52 30.81 1.21 Allowed 'General case' 0 C--N 1.354 0.784 0 C-N-CA 125.664 1.586 . . . . 0.0 113.792 -176.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 24.9 m 174.5 161.82 0.2 Allowed 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 100.711 -3.811 . . . . 0.0 100.711 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -168.21 100.06 0.44 Allowed 'General case' 0 C--N 1.364 1.23 0 CA-C-N 121.902 2.137 . . . . 0.0 116.338 -177.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -176.49 82.69 0.02 OUTLIER 'General case' 0 C--N 1.379 1.85 0 C-N-CA 124.685 1.194 . . . . 0.0 111.622 -175.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . 0.267 21.7 m -53.5 110.73 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.247 0 N-CA-C 121.351 3.834 . . . . 0.0 121.351 -175.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.416 ' CD1' ' HB ' ' A' ' 106' ' ' ILE . 4.5 pt -129.94 144.09 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 131.387 3.875 . . . . 0.0 113.226 177.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.385 38.7 mttm -116.65 146.98 42.35 Favored 'General case' 0 CA--C 1.5 -0.956 1 N-CA-C 98.969 -4.456 . . . . 0.0 98.969 155.043 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 5.9 t -77.62 139.47 39.5 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 -132.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 . . . . . 0 C--O 1.262 1.761 0 CA-C-N 109.01 -3.723 . . . . 0.0 117.51 -162.011 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.0 mtt . . . . . 0 CA--C 1.518 -0.28 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.9 p -67.35 120.26 13.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 129.397 3.079 . . . . 0.0 114.05 176.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 mm -47.69 41.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 1 C-N-CA 133.916 4.886 . . . . 0.0 121.292 -172.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.509 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 35.4 m-80 -59.14 -1.88 0.22 Allowed 'General case' 0 N--CA 1.478 0.967 1 C-N-CA 133.165 4.586 . . . . 0.0 117.322 177.051 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.33 -57.7 9.53 Favored 'General case' 0 C--N 1.349 0.571 1 C-N-CA 131.956 4.102 . . . . 0.0 111.728 172.839 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -75.13 -14.57 60.58 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.013 2.125 . . . . 0.0 112.616 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.509 ' CG1' ' HA ' ' A' ' 4' ' ' ASN 0.316 0.8 OUTLIER -86.66 -33.67 7.26 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 126.791 2.036 . . . . 0.0 110.696 176.395 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -66.76 -44.69 80.76 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 128.599 2.759 . . . . 0.0 109.002 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mt -58.2 -43.21 85.23 Favored 'Isoleucine or valine' 0 C--N 1.363 1.169 0 CA-C-N 113.615 -1.629 . . . . 0.0 111.696 165.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 12.6 ttm105 -59.94 -49.44 77.66 Favored 'General case' 0 C--N 1.369 1.435 0 O-C-N 119.733 -1.855 . . . . 0.0 115.654 170.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 75.9 mtm180 -58.59 -30.53 67.27 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 119.113 3.005 . . . . 0.0 119.113 167.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -77.16 -49.02 16.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.696 3.198 . . . . 0.0 111.035 173.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 14.2 mmtp -57.49 -29.14 64.02 Favored 'General case' 0 C--N 1.376 1.752 0 C-N-CA 128.629 2.772 . . . . 0.0 109.679 170.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.435 ' CD1' ' HA ' ' A' ' 54' ' ' ILE . 0.0 OUTLIER -72.32 -43.45 64.12 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.038 1.335 . . . . 0.0 113.854 168.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -55.8 -40.92 73.38 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 119.764 -1.835 . . . . 0.0 112.496 168.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.3 mmt-85 -63.38 -48.09 79.36 Favored 'General case' 0 C--N 1.379 1.879 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 165.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.407 ' CG ' ' O ' ' A' ' 13' ' ' LYS 0.29 11.4 m-70 -57.03 -46.89 82.04 Favored 'General case' 0 C--N 1.39 2.354 1 C-N-CA 131.932 4.093 . . . . 0.0 110.27 175.81 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.453 ' CE1' HD22 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -58.55 -54.54 45.91 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 130.144 3.378 . . . . 0.0 110.889 175.238 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.17 -45.16 58.11 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 118.046 2.609 . . . . 0.0 118.046 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.9 m -65.78 -41.41 92.06 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.252 2.221 . . . . 0.0 112.748 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.418 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.392 3.7 mp0 -77.28 -29.25 53.7 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 120.611 -1.306 . . . . 0.0 111.249 172.071 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.67 -31.27 70.52 Favored 'General case' 0 C--N 1.388 2.258 0 O-C-N 119.18 -2.2 . . . . 0.0 112.76 167.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -69.17 -38.33 78.64 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 125.203 1.401 . . . . 0.0 110.632 165.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 31.4 tp60 -58.47 -46.87 85.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 168.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.5 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.7 mt -70.75 -45.46 73.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 O-C-N 121.24 -0.912 . . . . 0.0 112.285 175.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.628 0.5 OUTLIER -70.61 -23.69 62.6 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 119.825 1.193 . . . . 0.0 113.662 177.099 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -69.31 -45.95 68.3 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.19 -1.569 . . . . 0.0 109.814 167.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -64.19 -36.75 85.09 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.764 -1.835 . . . . 0.0 114.308 174.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.422 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 4.8 mt -62.31 -50.09 81.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 C-N-CA 125.055 1.342 . . . . 0.0 113.943 171.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttm105 -68.31 -28.6 67.32 Favored 'General case' 0 C--N 1.361 1.085 0 CA-C-N 121.534 1.97 . . . . 0.0 115.056 176.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -76.21 -45.38 33.34 Favored 'General case' 0 C--N 1.37 1.489 0 O-C-N 119.776 -1.827 . . . . 0.0 110.331 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.6 -40.42 66.53 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.348 4.0 p -68.93 -39.04 79.84 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.617 1.167 . . . . 0.0 111.19 177.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 mmtp -66.32 -46.25 77.53 Favored 'General case' 0 C--N 1.376 1.758 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 167.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.93 71.93 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 126.114 1.766 . . . . 0.0 114.783 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.33 -13.89 60.81 Favored 'General case' 0 C--N 1.376 1.736 0 CA-C-N 119.411 1.005 . . . . 0.0 113.495 169.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.98 18.02 30.68 Favored Glycine 0 C--N 1.38 2.988 0 CA-C-N 119.567 1.076 . . . . 0.0 114.094 171.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.438 HG23 ' CD1' ' A' ' 81' ' ' LEU . 1.9 m -118.83 175.8 3.56 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 -175.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.316 3.6 m -52.44 162.04 0.59 Allowed 'General case' 0 N--CA 1.428 -1.546 1 C-N-CA 132.574 4.35 . . . . 0.0 118.966 176.86 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.6 m -92.82 112.71 24.76 Favored 'General case' 0 CA--C 1.49 -1.335 0 C-N-CA 124.821 1.249 . . . . 0.0 107.632 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.481 ' CZ ' HG21 ' A' ' 77' ' ' VAL 0.277 42.9 p90 -114.0 144.53 42.95 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.056 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -118.35 163.12 17.19 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-O 123.601 1.667 . . . . 0.0 112.359 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -122.06 121.78 37.76 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 125.766 1.626 . . . . 0.0 114.403 -174.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -122.01 162.05 21.84 Favored 'General case' 0 C--N 1.373 1.621 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 171.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -116.34 172.55 7.12 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 170.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.9 m -97.59 117.84 32.76 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 102.893 -3.002 . . . . 0.0 102.893 159.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.554 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.529 0.0 OUTLIER -78.12 -10.16 59.5 Favored 'General case' 0 CA--C 1.556 1.18 0 O-C-N 120.004 -1.685 . . . . 0.0 115.281 -175.298 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.7 -38.82 46.57 Favored 'General case' 0 C--N 1.376 1.746 0 CA-C-O 126.127 2.87 . . . . 0.0 110.071 172.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 21.0 tp -64.45 -35.01 79.55 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 127.809 2.444 . . . . 0.0 111.213 168.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 47' ' ' GLN . 1.8 mp -74.71 -28.09 60.66 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.123 166.152 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.15 -30.6 64.6 Favored 'General case' 0 C--N 1.365 1.262 0 O-C-N 118.299 -2.75 . . . . 0.0 109.747 171.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -79.53 -55.43 5.04 Favored 'General case' 0 C--N 1.386 2.195 0 N-CA-C 117.821 2.526 . . . . 0.0 117.821 158.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.16 -30.69 70.55 Favored 'General case' 0 N--CA 1.502 2.15 1 CA-C-N 127.366 4.621 . . . . 0.0 118.852 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.438 ' CG1' HD23 ' A' ' 50' ' ' LEU . 42.1 mt -68.53 -46.49 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 128.08 2.552 . . . . 0.0 112.529 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -102.54 -18.98 15.04 Favored 'General case' 0 C--N 1.371 1.517 0 N-CA-C 119.031 2.975 . . . . 0.0 119.031 176.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -90.0 -7.41 54.05 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-N 123.168 2.713 . . . . 0.0 111.794 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -125.96 -65.25 1.0 Allowed 'General case' 0 C--N 1.354 0.786 0 C-N-CA 126.403 1.881 . . . . 0.0 108.93 -176.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.49 0.2 OUTLIER 71.47 147.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 128.574 2.75 . . . . 0.0 112.593 178.243 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.412 ' N ' ' HG ' ' A' ' 14' ' ' LEU . 22.0 t70 58.6 -61.52 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 129.409 3.084 . . . . 0.0 113.679 -175.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.431 ' HB2' ' HB ' ' A' ' 63' ' ' VAL 0.508 7.0 pt-20 27.69 61.56 0.1 Allowed 'General case' 0 C--O 1.205 -1.275 1 C-N-CA 133.799 4.84 . . . . 0.0 114.301 -178.101 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.438 34.9 p -78.03 -10.82 59.79 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 118.171 -2.831 . . . . 0.0 114.043 -172.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -68.95 -33.49 73.8 Favored 'General case' 0 CA--C 1.552 1.032 1 C-N-CA 133.653 4.781 . . . . 0.0 110.56 164.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.431 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -67.52 -44.33 86.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.412 0 C-N-CA 129.785 3.234 . . . . 0.0 108.804 -178.518 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.418 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.292 28.1 m-85 -63.81 -43.94 94.74 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 130.591 3.556 . . . . 0.0 112.682 166.445 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -59.25 -44.91 92.36 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.259 2.3 . . . . 0.0 114.681 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.515 ' HG ' ' CD2' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -59.47 -50.72 72.83 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 129.4 3.08 . . . . 0.0 113.125 169.797 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.413 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.812 0.1 OUTLIER -77.67 -17.48 57.64 Favored 'General case' 0 C--N 1.377 1.779 0 O-C-N 119.201 -2.187 . . . . 0.0 114.64 176.842 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.5 ' CE1' HG12 ' A' ' 25' ' ' ILE . 52.9 m-70 -80.03 -16.29 55.42 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 126.852 2.061 . . . . 0.0 111.405 166.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -84.36 -40.93 17.27 Favored 'General case' 0 CA--C 1.556 1.201 0 O-C-N 120.38 -1.45 . . . . 0.0 110.488 160.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.413 ' HB ' ' HA ' ' A' ' 67' ' ' PHE 0.327 0.9 OUTLIER -58.51 -26.16 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.808 0 C-N-CA 128.521 2.728 . . . . 0.0 113.896 176.009 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -61.72 -11.95 14.39 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 129.615 3.166 . . . . 0.0 117.431 174.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.316 80.5 m-20 -89.18 -36.81 15.46 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 123.8 1.762 . . . . 0.0 109.987 -173.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.465 ' NE2' ' HG3' ' A' ' 151' ' ' LYS . 1.9 t-80 -87.46 24.14 1.73 Allowed 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 131.48 3.912 . . . . 0.0 116.206 -166.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.48 ' HA ' HG13 ' A' ' 77' ' ' VAL 0.283 95.7 t -41.95 -31.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 128.171 2.589 . . . . 0.0 114.118 161.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.97 -39.07 92.92 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 127.108 2.163 . . . . 0.0 115.748 171.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.368 63.9 mm-40 -76.24 -34.74 59.2 Favored 'General case' 0 C--N 1.366 1.324 0 O-C-N 118.908 -2.37 . . . . 0.0 113.698 170.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.481 HG21 ' CZ ' ' A' ' 41' ' ' PHE 0.404 1.9 p -70.81 -29.29 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.699 0 CA-C-O 124.084 1.897 . . . . 0.0 113.654 173.318 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -64.43 -45.37 87.79 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 130.36 3.464 . . . . 0.0 110.326 169.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.28 -30.28 71.13 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 126.187 1.795 . . . . 0.0 112.762 172.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.465 ' CE1' HG23 ' A' ' 77' ' ' VAL 0.609 0.2 OUTLIER -74.86 -29.6 61.08 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 169.381 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.438 ' CD1' HG23 ' A' ' 38' ' ' VAL 0.307 0.4 OUTLIER -76.86 -46.52 24.37 Favored 'General case' 0 C--N 1.377 1.795 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 168.955 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.5 m -66.64 3.32 1.03 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 120.676 3.584 . . . . 0.0 120.676 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.444 ' HE3' ' CG2' ' A' ' 97' ' ' VAL . 8.0 ptm -77.04 166.67 42.92 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 128.644 2.778 . . . . 0.0 112.587 178.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -56.93 142.21 93.46 Favored 'Trans proline' 0 C--N 1.367 1.522 1 C-N-CA 125.321 4.014 . . . . 0.0 112.824 176.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -58.2 158.37 22.35 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 124.228 3.285 . . . . 0.0 118.634 -157.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.7 mmm-85 -66.22 2.0 0.03 OUTLIER Pre-proline 0 CA--C 1.583 2.221 1 N-CA-C 123.353 4.575 . . . . 0.0 123.353 172.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -52.52 160.9 3.24 Favored 'Trans proline' 0 C--N 1.38 2.216 3 C-N-CA 127.726 5.618 . . . . 0.0 123.048 -169.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -42.61 -26.98 0.14 Allowed 'General case' 0 C--N 1.361 1.107 1 C-N-CA 137.73 6.412 . . . . 0.0 119.036 -175.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.0 -41.03 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.351 0 C-N-CA 129.145 2.978 . . . . 0.0 115.743 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 55.81 -18.21 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.813 1 C-N-CA 136.182 5.793 . . . . 0.0 115.588 -177.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -98.3 -18.36 18.4 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 126.919 2.088 . . . . 0.0 113.536 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -113.95 3.73 15.5 Favored 'General case' 0 CA--C 1.505 -0.767 0 C-N-CA 123.66 0.784 . . . . 0.0 111.411 -174.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.257 1.3 m-85 -122.4 -66.42 1.03 Allowed 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 117.979 2.585 . . . . 0.0 117.979 -178.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.4 pt -78.26 138.02 21.02 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 127.857 2.463 . . . . 0.0 113.161 -177.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -137.97 -26.15 0.95 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 111.883 -2.417 . . . . 0.0 112.327 -170.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -95.9 -6.23 59.37 Favored Glycine 0 C--N 1.36 1.912 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.444 ' CG2' ' HE3' ' A' ' 83' ' ' MET . 11.6 t -113.24 113.57 44.42 Favored 'Isoleucine or valine' 0 C--N 1.365 1.264 0 N-CA-C 104.083 -2.562 . . . . 0.0 104.083 175.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -79.91 42.88 0.57 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.463 2.305 . . . . 0.0 116.672 -175.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 11.5 t80 77.42 -22.62 0.27 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 129.956 3.302 . . . . 0.0 115.362 178.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 45.1 ptt85 -87.59 168.57 16.8 Favored Pre-proline 0 C--N 1.352 0.71 0 C-N-CA 130.555 3.542 . . . . 0.0 110.72 178.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -52.42 155.71 9.36 Favored 'Trans proline' 0 C--N 1.356 0.929 1 C-N-CA 126.348 4.699 . . . . 0.0 119.821 178.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -92.22 54.28 2.84 Favored Glycine 0 C--N 1.353 1.487 0 C-N-CA 126.555 2.026 . . . . 0.0 113.347 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.1 ptt180 -119.42 146.56 45.27 Favored 'General case' 0 C--N 1.349 0.546 0 C-N-CA 125.59 1.556 . . . . 0.0 111.695 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pp -140.16 150.42 44.2 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 126.423 1.889 . . . . 0.0 111.715 -175.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -130.16 130.87 45.29 Favored 'General case' 0 C--N 1.367 1.336 0 C-N-CA 127.277 2.231 . . . . 0.0 105.444 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 4.9 pt -134.51 138.68 49.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -101.64 106.97 18.09 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 173.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.39 143.77 34.14 Favored 'General case' 0 CA--C 1.477 -1.845 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 -168.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 81.71 -21.76 6.23 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.866 2.174 . . . . 0.0 112.23 178.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 116.53 -9.49 0.0 OUTLIER 'General case' 0 C--N 1.376 1.73 1 C-N-CA 135.653 5.581 . . . . 0.0 110.623 -167.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.515 ' CD2' ' HG ' ' A' ' 66' ' ' LEU 0.64 0.0 OUTLIER -78.82 138.2 38.07 Favored 'General case' 0 CA--C 1.481 -1.68 1 C-N-CA 135.025 5.33 . . . . 0.0 118.654 -178.649 . . . . . . . . 5 4 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . 0.465 ' HE1' ' ND2' ' A' ' 137' ' ' ASN . 54.8 m95 -90.45 98.48 11.8 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 103.191 -2.892 . . . . 0.0 103.191 172.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' A' ' 133' ' ' MET 0.369 0.1 OUTLIER -108.46 119.43 39.49 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.758 176.085 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -106.76 131.73 10.79 Favored Glycine 0 C--N 1.361 1.943 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -115.53 145.97 42.14 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 103.249 -2.871 . . . . 0.0 103.249 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -138.86 124.42 19.5 Favored 'General case' 0 CA--C 1.488 -1.42 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -79.57 145.03 9.94 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 120.116 1.326 . . . . 0.0 110.876 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 25.0 m -4.44 84.1 0.0 OUTLIER 'General case' 0 C--N 1.37 1.458 0 C-N-CA 130.353 3.461 . . . . 0.0 119.856 -172.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.266 19.0 tptm -43.39 -48.63 17.57 Favored Pre-proline 0 C--N 1.365 1.266 0 C-N-CA 129.955 3.302 . . . . 0.0 116.238 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -87.06 90.02 0.6 Allowed 'Trans proline' 0 CA--C 1.561 1.87 0 C-N-CA 123.464 2.776 . . . . 0.0 107.589 156.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.264 11.0 m120 -47.78 116.97 1.65 Allowed 'General case' 0 C--N 1.369 1.413 0 C-N-CA 131.19 3.796 . . . . 0.0 119.226 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -83.48 -7.41 59.55 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 130.927 3.691 . . . . 0.0 120.652 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.295 19.4 mmtm 53.51 46.69 25.63 Favored 'General case' 0 N--CA 1.434 -1.229 1 C-N-CA 132.017 4.127 . . . . 0.0 119.958 176.71 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.271 38.1 m-85 -156.63 170.36 22.56 Favored 'General case' 0 CA--C 1.489 -1.384 0 CA-C-N 114.475 -1.238 . . . . 0.0 113.972 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.78 76.27 0.97 Allowed 'General case' 0 C--N 1.364 1.224 0 C-N-CA 127.575 2.35 . . . . 0.0 109.416 174.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -175.48 49.9 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.321 1 C-N-CA 137.937 6.495 . . . . 0.0 110.564 177.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.444 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 11.1 Cg_exo -98.7 -178.23 0.26 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.057 3.172 . . . . 0.0 114.182 -164.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.5 p -125.74 163.98 21.65 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.08 130.38 48.66 Favored 'General case' 0 C--N 1.361 1.104 0 N-CA-C 100.288 -3.967 . . . . 0.0 100.288 176.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -109.68 58.49 0.61 Allowed 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 -168.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 17.2 t 119.08 120.39 0.0 OUTLIER 'General case' 0 C--N 1.364 1.22 0 O-C-N 126.796 2.56 . . . . 0.0 106.259 -169.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -114.55 109.42 18.24 Favored 'General case' 0 C--N 1.357 0.907 1 N-CA-C 97.199 -5.112 . . . . 0.0 97.199 159.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' MET . . . . . 0.44 ' O ' ' HA ' ' A' ' 113' ' ' LEU . 0.0 OUTLIER -93.88 119.52 32.91 Favored 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 125.632 1.573 . . . . 0.0 107.87 -177.26 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -127.77 114.93 17.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 120.347 1.43 . . . . 0.0 108.422 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 5.3 mt -142.35 144.19 25.2 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.51 177.66 4.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.65 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -164.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.465 ' ND2' ' HE1' ' A' ' 112' ' ' TRP . 0.2 OUTLIER -133.14 117.5 17.56 Favored 'General case' 0 C--N 1.361 1.082 2 N-CA-C 98.023 -4.806 . . . . 0.0 98.023 162.202 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.99 -61.65 0.03 OUTLIER 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 103.838 -2.652 . . . . 0.0 103.838 -173.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.754 ' CD ' ' H ' ' A' ' 140' ' ' ARG 0.716 0.2 OUTLIER 94.88 132.09 0.02 OUTLIER 'General case' 0 C--N 1.369 1.417 0 CA-C-O 122.524 1.154 . . . . 0.0 112.704 -177.736 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.754 ' H ' ' CD ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER 124.5 -41.32 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.454 3 C-N-CA 135.705 5.602 . . . . 0.0 99.018 -144.388 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.599 ' H ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -106.15 154.4 39.66 Favored Pre-proline 0 C--N 1.38 1.893 2 N-CA-C 127.924 6.268 . . . . 0.0 127.924 171.046 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.449 ' CD ' ' H ' ' A' ' 143' ' ' GLY . 0.4 OUTLIER -97.35 -22.67 0.12 Allowed 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 125.257 3.971 . . . . 0.0 115.823 175.358 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.449 ' H ' ' CD ' ' A' ' 142' ' ' PRO . . . 3.44 -88.65 0.0 OUTLIER Glycine 0 N--CA 1.479 1.561 1 C-N-CA 136.136 6.589 . . . . 0.0 120.254 -164.498 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.07 132.29 14.47 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 128.223 2.609 . . . . 0.0 105.394 175.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -115.09 123.33 48.72 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 -176.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 38.3 m 175.6 165.34 0.34 Allowed 'General case' 0 C--N 1.363 1.166 1 N-CA-C 98.756 -4.535 . . . . 0.0 98.756 178.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.336 97.1 mttt -131.11 -79.78 0.53 Allowed 'General case' 0 C--N 1.369 1.437 0 CA-C-N 124.002 3.092 . . . . 0.0 115.688 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.264 . . 69.3 176.55 0.27 Allowed 'General case' 0 CA--C 1.569 1.691 0 N-CA-C 118.682 2.845 . . . . 0.0 118.682 172.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 10.4 t -132.38 118.19 34.74 Favored 'Isoleucine or valine' 0 C--N 1.38 1.925 0 O-C-N 118.379 -2.701 . . . . 0.0 116.366 -171.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.533 HD11 ' HG2' ' A' ' 151' ' ' LYS 0.432 0.0 OUTLIER -130.35 151.01 35.21 Favored 'Isoleucine or valine' 0 C--N 1.364 1.237 1 C-N-CA 134.455 5.102 . . . . 0.0 109.783 175.802 . . . . . . . . 5 4 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . 0.533 ' HG2' HD11 ' A' ' 150' ' ' ILE 0.381 7.2 ptmt -73.87 152.82 40.11 Favored 'General case' 0 CA--C 1.511 -0.523 1 C-N-CA 135.177 5.391 . . . . 0.0 105.095 175.73 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.439 ' O ' ' CB ' ' A' ' 73' ' ' HIS . 82.8 p -86.21 93.64 9.1 Favored 'General case' 0 C--O 1.203 -1.38 2 O-C-N 114.173 -5.33 . . . . 0.0 109.077 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . 0.426 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 1 N-CA-C 126.395 5.702 . . . . 0.0 126.395 -162.303 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.4 mtt . . . . . 0 N--CA 1.466 0.347 0 CA-C-O 123.017 1.389 . . . . 0.0 108.719 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -71.92 64.11 0.49 Allowed 'General case' 0 C--N 1.359 1.008 0 N-CA-C 117.957 2.577 . . . . 0.0 117.957 -171.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.0 mm 31.04 52.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.374 1.636 1 C-N-CA 134.685 5.194 . . . . 0.0 114.168 176.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.37 3.4 m120 -50.19 -10.23 0.05 Allowed 'General case' 0 N--CA 1.466 0.347 1 C-N-CA 132.685 4.394 . . . . 0.0 119.673 -170.921 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -50.75 72.8 Favored 'General case' 0 N--CA 1.445 -0.717 1 C-N-CA 133.341 4.656 . . . . 0.0 111.696 166.922 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -80.35 -16.83 53.64 Favored 'General case' 0 C--N 1.372 1.57 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.0 t -81.55 -39.42 17.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.213 0 C-N-CA 130.41 3.484 . . . . 0.0 108.828 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.56 -47.99 76.7 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.363 2.665 . . . . 0.0 110.339 173.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.81 -43.22 66.47 Favored 'Isoleucine or valine' 0 C--N 1.362 1.14 0 C-N-CA 125.708 1.603 . . . . 0.0 113.495 166.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.1 mtm180 -60.45 -50.78 72.19 Favored 'General case' 0 CA--C 1.56 1.345 0 C-N-CA 126.132 1.773 . . . . 0.0 114.086 171.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -60.47 -26.98 67.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 128.793 2.837 . . . . 0.0 117.634 167.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -77.72 -51.09 11.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 130.381 3.472 . . . . 0.0 110.991 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.8 mmtt -57.75 -29.75 65.04 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 128.907 2.883 . . . . 0.0 109.739 169.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.68 -49.75 65.11 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 114.233 -1.349 . . . . 0.0 113.887 164.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -57.64 -39.56 77.27 Favored 'General case' 0 C--N 1.371 1.533 0 CA-C-N 123.474 2.852 . . . . 0.0 114.452 171.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -61.18 -53.18 60.15 Favored 'General case' 0 C--N 1.379 1.85 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 167.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.293 50.1 m-70 -58.21 -48.73 79.45 Favored 'General case' 0 C--N 1.383 2.046 0 C-N-CA 129.157 2.983 . . . . 0.0 111.922 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . 0.287 0.9 OUTLIER -57.07 -55.64 32.04 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 128.372 2.669 . . . . 0.0 114.583 174.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.98 -35.46 62.05 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -176.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -67.96 -45.01 75.39 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 124.634 1.174 . . . . 0.0 112.806 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.518 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 38.1 mt-10 -77.56 -29.96 52.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.263 -1.523 . . . . 0.0 112.491 173.023 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.312 2.2 m-85 -67.38 -25.96 66.22 Favored 'General case' 0 C--N 1.383 2.05 0 O-C-N 118.706 -2.497 . . . . 0.0 112.362 169.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -66.31 -46.97 75.09 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-O 117.088 -1.434 . . . . 0.0 109.827 161.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -56.68 -47.61 79.47 Favored 'General case' 0 C--N 1.364 1.227 0 N-CA-C 118.842 2.904 . . . . 0.0 118.842 171.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.538 HG12 ' CE1' ' A' ' 68' ' ' HIS . 6.8 mt -70.21 -42.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 O-C-N 120.638 -1.289 . . . . 0.0 111.49 176.023 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.729 0.0 OUTLIER -74.75 -23.27 58.52 Favored 'General case' 0 C--N 1.373 1.59 0 O-C-N 119.224 -2.173 . . . . 0.0 115.345 177.186 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.61 -37.38 73.84 Favored 'General case' 0 C--N 1.383 2.026 0 C-N-CA 125.652 1.581 . . . . 0.0 110.724 167.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.93 -39.36 93.39 Favored 'General case' 0 C--N 1.388 2.245 0 O-C-N 118.961 -2.337 . . . . 0.0 112.013 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.483 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.6 mt -61.55 -42.0 92.34 Favored 'Isoleucine or valine' 0 C--N 1.373 1.59 0 CA-C-N 120.177 1.353 . . . . 0.0 114.321 172.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -59.71 -49.52 77.41 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 124.815 1.246 . . . . 0.0 114.356 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -77.06 -37.97 53.54 Favored 'General case' 0 C--N 1.372 1.58 0 C-N-CA 128.527 2.731 . . . . 0.0 113.912 -176.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.31 -29.16 38.09 Favored 'General case' 0 CA--C 1.494 -1.175 0 CA-C-O 122.49 1.138 . . . . 0.0 113.336 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.454 ' HB2' HD22 ' A' ' 78' ' ' ASN 0.344 23.2 p -79.11 -32.78 44.66 Favored 'General case' 0 C--N 1.357 0.904 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.727 173.277 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -60.43 -38.78 85.15 Favored 'General case' 0 C--N 1.374 1.647 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 163.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.09 -36.76 64.29 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.764 2.426 . . . . 0.0 112.843 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.61 61.25 Favored 'General case' 0 C--N 1.383 2.033 0 CA-C-N 119.342 0.974 . . . . 0.0 112.508 168.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.36 17.15 51.16 Favored Glycine 0 C--N 1.364 2.114 0 C-N-CA 127.161 2.315 . . . . 0.0 114.076 172.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.46 HG13 ' HB3' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -119.52 148.13 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.607 0 CA-C-O 124.482 2.086 . . . . 0.0 108.824 -174.776 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.322 0.1 OUTLIER -11.25 -58.77 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.655 2 C-N-CA 135.757 5.623 . . . . 0.0 121.846 -179.584 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.302 90.8 p 100.23 171.28 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.743 0 C-N-CA 129.3 3.04 . . . . 0.0 108.542 -171.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.483 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 54.2 p90 -151.12 154.79 37.62 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 126.189 1.796 . . . . 0.0 107.195 176.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -116.33 124.15 49.41 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 122.296 1.046 . . . . 0.0 109.835 174.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -94.55 160.91 14.43 Favored 'General case' 0 C--N 1.338 0.105 0 O-C-N 118.275 -2.765 . . . . 0.0 114.356 -175.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -138.73 141.41 38.91 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.25 1.82 . . . . 0.0 106.631 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -108.56 154.61 21.7 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 125.445 1.498 . . . . 0.0 108.238 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 110.71 22.76 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 125.063 1.345 . . . . 0.0 113.067 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.631 ' HA ' ' CB ' ' A' ' 50' ' ' LEU 0.965 0.0 OUTLIER -72.73 -8.28 54.62 Favored 'General case' 0 C--N 1.355 0.816 1 C-N-CA 134.004 4.922 . . . . 0.0 120.656 -175.304 . . . . . . . . 5 4 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 -47.08 15.82 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 125.292 2.472 . . . . 0.0 109.707 167.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.8 tp -60.67 -36.07 77.83 Favored 'General case' 0 C--N 1.369 1.429 0 C-N-CA 128.339 2.656 . . . . 0.0 110.06 164.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.631 ' CB ' ' HA ' ' A' ' 47' ' ' GLN 0.367 0.2 OUTLIER -74.52 -28.51 61.0 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 113.203 -1.817 . . . . 0.0 111.443 170.414 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -59.93 -29.47 68.41 Favored 'General case' 0 CA--C 1.559 1.31 0 O-C-N 116.524 -3.86 . . . . 0.0 109.287 171.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -73.21 -50.93 19.72 Favored 'General case' 0 C--N 1.381 1.948 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 158.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.448 ' HB1' ' CD1' ' A' ' 50' ' ' LEU . . . -61.8 -29.48 70.18 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 123.945 3.066 . . . . 0.0 116.919 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.437 HG23 HD12 ' A' ' 54' ' ' ILE . 1.3 tt -75.58 -39.01 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.139 1 C-N-CA 132.754 4.422 . . . . 0.0 112.693 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.19 -26.28 15.0 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 118.525 -1.27 . . . . 0.0 112.8 172.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -74.03 -52.31 13.12 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 120.617 -1.302 . . . . 0.0 112.179 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -109.51 8.42 25.16 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 116.826 2.158 . . . . 0.0 116.826 -175.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.474 0.0 OUTLIER 23.83 -26.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.633 2 C-N-CA 136.656 5.982 . . . . 0.0 125.723 175.096 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -112.92 -47.47 3.04 Favored 'General case' 0 CA--C 1.467 -2.214 1 C-N-CA 132.334 4.253 . . . . 0.0 108.706 176.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.46 ' HB2' ' HB ' ' A' ' 63' ' ' VAL 0.892 0.0 OUTLIER 15.47 55.61 0.01 OUTLIER 'General case' 0 C--N 1.359 0.995 0 N-CA-C 121.348 3.833 . . . . 0.0 121.348 -166.887 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.258 21.6 p -78.78 -19.07 53.08 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 129.605 3.162 . . . . 0.0 110.705 174.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . 0.266 40.5 t80 -65.48 -34.51 78.43 Favored 'General case' 0 CA--C 1.543 0.703 1 C-N-CA 132.458 4.303 . . . . 0.0 111.636 168.621 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.46 ' HB ' ' HB2' ' A' ' 60' ' ' GLU . 0.5 OUTLIER -60.66 -45.87 96.77 Favored 'Isoleucine or valine' 0 C--N 1.364 1.233 0 C-N-CA 130.231 3.413 . . . . 0.0 109.076 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.518 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 43.2 m-85 -62.61 -46.0 90.29 Favored 'General case' 0 CA--C 1.493 -1.241 1 C-N-CA 132.422 4.289 . . . . 0.0 112.79 170.078 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.89 -42.47 97.46 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 121.564 1.984 . . . . 0.0 114.902 177.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -65.02 -49.27 70.83 Favored 'General case' 0 CA--C 1.565 1.526 0 C-N-CA 127.797 2.439 . . . . 0.0 113.516 170.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.415 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.782 0.0 OUTLIER -78.5 -16.26 57.7 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 118.485 -2.634 . . . . 0.0 115.909 178.23 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.538 ' CE1' HG12 ' A' ' 25' ' ' ILE . 46.5 m-70 -76.81 -28.31 55.52 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 129.405 3.082 . . . . 0.0 106.797 164.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -70.08 -34.89 73.74 Favored 'General case' 0 CA--C 1.569 1.704 0 O-C-N 118.769 -2.457 . . . . 0.0 112.483 159.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.415 ' HB ' ' HA ' ' A' ' 67' ' ' PHE . 20.1 mm -72.1 -11.88 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.087 1 C-N-CA 132.258 4.223 . . . . 0.0 118.05 176.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.3 pttm -60.06 -26.94 66.55 Favored 'General case' 0 C--N 1.32 -0.699 2 N-CA-C 124.157 4.873 . . . . 0.0 124.157 -175.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.34 -20.26 15.93 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 127.239 2.215 . . . . 0.0 108.735 -172.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.565 ' CD2' ' HA ' ' A' ' 153' ' ' GLN . 2.1 m-70 -77.22 16.07 0.64 Allowed 'General case' 0 C--N 1.372 1.563 0 C-N-CA 129.174 2.99 . . . . 0.0 112.414 172.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.523 ' HA ' ' CG1' ' A' ' 77' ' ' VAL . 3.9 p -49.99 -27.93 4.08 Favored 'Isoleucine or valine' 0 C--N 1.378 1.82 0 C-N-CA 128.678 2.791 . . . . 0.0 111.569 157.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.24 -31.01 69.29 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 128.215 2.606 . . . . 0.0 113.22 174.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -76.28 -40.06 52.69 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 126.967 2.107 . . . . 0.0 112.324 172.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.523 ' CG1' ' HA ' ' A' ' 74' ' ' VAL 0.461 3.0 p -70.11 -27.82 33.81 Favored 'Isoleucine or valine' 0 C--N 1.367 1.353 0 CA-C-O 124.629 2.156 . . . . 0.0 111.636 171.405 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.46 ' HB3' HG13 ' A' ' 38' ' ' VAL . 9.1 m120 -70.12 -38.7 75.64 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.991 2.116 . . . . 0.0 114.39 167.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -30.43 70.0 Favored 'General case' 0 C--N 1.369 1.423 0 CA-C-N 121.075 1.761 . . . . 0.0 111.269 170.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -64.04 -36.17 83.11 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 129.139 2.976 . . . . 0.0 112.03 167.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.275 0.5 OUTLIER -73.36 -45.84 52.65 Favored 'General case' 0 C--N 1.39 2.365 0 O-C-N 119.81 -1.806 . . . . 0.0 113.769 170.321 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.5 m -70.81 -39.51 73.03 Favored 'General case' 0 CA--C 1.5 -0.954 1 C-N-CA 132.695 4.398 . . . . 0.0 117.546 -171.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.435 ' HE2' ' CG2' ' A' ' 97' ' ' VAL . 15.5 mmm -125.39 99.2 33.84 Favored Pre-proline 0 C--N 1.376 1.722 0 CA-C-O 125.712 2.672 . . . . 0.0 115.363 166.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.423 ' HD2' ' CE ' ' A' ' 125' ' ' LYS . 4.8 Cg_endo -138.21 -176.88 0.0 OUTLIER 'Trans proline' 0 CA--C 1.576 2.613 2 C-N-CA 133.116 9.211 . . . . 0.0 99.951 146.802 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -86.73 134.49 3.87 Favored 'Trans proline' 0 CA--C 1.566 2.117 2 O-C-N 112.765 -4.387 . . . . 0.0 118.426 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HG2' ' H ' ' A' ' 86' ' ' ARG . 6.3 ptm180 -85.64 -27.58 0.38 Allowed Pre-proline 0 CA--C 1.563 1.45 1 C-N-CA 136.17 5.788 . . . . 0.0 116.633 159.943 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -85.16 160.51 11.47 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 124.286 3.324 . . . . 0.0 117.773 -169.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.83 -17.77 13.98 Favored 'General case' 0 C--N 1.355 0.816 0 CA-C-N 113.046 -1.888 . . . . 0.0 109.984 170.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -96.35 174.27 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 C-N-CA 130.467 3.507 . . . . 0.0 117.104 -172.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -119.72 -9.75 9.69 Favored 'General case' 0 C--N 1.349 0.563 0 CA-C-N 110.748 -2.933 . . . . 0.0 113.031 -176.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -106.82 -36.73 6.58 Favored 'General case' 0 C--N 1.353 0.755 0 C-N-CA 126.321 1.848 . . . . 0.0 115.015 -176.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -120.42 34.07 5.35 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 128.746 2.819 . . . . 0.0 106.918 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.284 1.5 p90 -66.28 -136.94 0.0 OUTLIER 'General case' 0 C--N 1.353 0.733 0 C-N-CA 128.875 2.87 . . . . 0.0 117.741 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 6.1 pt -112.15 139.06 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 C-N-CA 127.635 2.374 . . . . 0.0 110.921 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -144.83 -23.59 0.51 Allowed 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 111.497 -2.592 . . . . 0.0 112.376 -171.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -94.23 -7.22 60.96 Favored Glycine 0 C--N 1.36 1.916 0 N-CA-C 110.294 -1.123 . . . . 0.0 110.294 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.435 ' CG2' ' HE2' ' A' ' 83' ' ' MET . 95.5 t -81.82 91.64 2.17 Favored 'Isoleucine or valine' 0 C--N 1.366 1.319 0 CA-C-O 125.224 2.44 . . . . 0.0 110.225 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -125.8 21.18 7.67 Favored 'General case' 0 N--CA 1.445 -0.704 1 C-N-CA 132.313 4.245 . . . . 0.0 105.582 175.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.344 0.1 OUTLIER -30.3 157.51 0.0 OUTLIER 'General case' 0 C--N 1.354 0.765 2 N-CA-C 125.06 5.207 . . . . 0.0 125.06 -170.888 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 67.9 mtm180 -112.25 159.32 34.31 Favored Pre-proline 0 C--N 1.361 1.078 0 C-N-CA 127.02 2.128 . . . . 0.0 108.232 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -74.5 156.89 45.2 Favored 'Trans proline' 0 C--N 1.364 1.355 0 C-N-CA 125.22 3.947 . . . . 0.0 112.893 176.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.6 24.68 2.61 Favored Glycine 0 C--N 1.362 2.014 0 C-N-CA 128.872 3.13 . . . . 0.0 119.017 -167.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -140.99 140.96 34.44 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 120.961 -1.317 . . . . 0.0 107.695 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 mt -115.95 129.3 56.33 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 127.004 2.122 . . . . 0.0 108.54 -176.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -129.89 110.87 12.04 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 18.0 pt -135.72 139.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 110.673 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -112.49 127.71 56.13 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 173.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -139.11 -174.54 3.88 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 100.625 -3.843 . . . . 0.0 100.625 -175.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.81 -59.44 3.01 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 121.468 3.347 . . . . 0.0 121.468 154.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . 0.272 1.1 m-80 129.74 -28.57 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 131.163 3.785 . . . . 0.0 104.403 -144.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.4 HD23 ' CG2' ' A' ' 63' ' ' VAL . 0.2 OUTLIER -79.47 132.47 36.36 Favored 'General case' 0 C--N 1.359 1.006 1 C-N-CA 132.412 4.285 . . . . 0.0 117.959 -171.853 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -92.02 101.48 14.02 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 167.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.294 1.4 mm? -95.09 121.53 36.82 Favored 'General case' 0 C--N 1.383 2.037 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 176.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -116.19 122.65 5.6 Favored Glycine 0 C--N 1.355 1.611 0 N-CA-C 106.484 -2.647 . . . . 0.0 106.484 171.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -117.6 147.0 43.25 Favored 'General case' 0 C--N 1.367 1.347 0 CA-C-N 121.402 2.601 . . . . 0.0 104.656 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.9 m -134.57 133.31 40.09 Favored 'General case' 0 C--N 1.367 1.334 0 N-CA-C 103.118 -2.919 . . . . 0.0 103.118 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -92.84 139.96 17.12 Favored 'Isoleucine or valine' 0 C--N 1.352 0.698 0 C-N-CA 125.497 1.519 . . . . 0.0 109.514 177.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.306 20.0 p -7.41 73.15 0.0 OUTLIER 'General case' 0 C--N 1.38 1.898 0 C-N-CA 131.571 3.948 . . . . 0.0 119.869 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.333 44.5 tttp -44.3 -53.68 13.56 Favored Pre-proline 0 C--N 1.363 1.161 1 C-N-CA 133.585 4.754 . . . . 0.0 116.959 -171.869 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.64 71.52 1.45 Allowed 'Trans proline' 0 CA--C 1.564 1.983 0 C-N-CA 123.368 2.712 . . . . 0.0 110.429 161.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -55.66 141.25 38.54 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 120.692 3.59 . . . . 0.0 120.692 -173.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.15 113.48 2.96 Favored 'General case' 0 N--CA 1.425 -1.706 2 N-CA-C 95.529 -5.73 . . . . 0.0 95.529 167.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 33.6 mmtm -71.43 55.98 0.24 Allowed 'General case' 0 C--N 1.345 0.382 0 C-N-CA 129.937 3.295 . . . . 0.0 117.241 -172.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -58.28 148.83 26.04 Favored 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.538 4.335 . . . . 0.0 117.586 177.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.423 ' CE ' ' HD2' ' A' ' 84' ' ' PRO 0.307 0.0 OUTLIER -110.82 48.78 0.9 Allowed 'General case' 0 C--N 1.368 1.391 0 CA-C-O 123.816 1.769 . . . . 0.0 107.546 176.024 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -173.36 62.77 0.28 Allowed Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 130.789 3.635 . . . . 0.0 108.448 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -71.78 -177.07 2.32 Favored 'Trans proline' 0 C--N 1.355 0.88 1 C-N-CA 126.589 4.859 . . . . 0.0 118.838 -175.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 77.7 p -137.63 153.07 49.92 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-N 110.413 -3.085 . . . . 0.0 103.343 167.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 43.1 mt -103.24 130.68 50.53 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 101.329 -3.582 . . . . 0.0 101.329 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -126.34 67.4 1.22 Allowed 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -160.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 72.5 m 110.8 84.04 0.0 OUTLIER 'General case' 0 C--N 1.372 1.587 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -101.58 109.81 21.68 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 101.418 -3.549 . . . . 0.0 101.418 173.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.52 121.98 45.39 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 127.325 2.25 . . . . 0.0 107.355 -174.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.15 114.76 17.42 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 176.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -133.8 149.73 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-O 123.053 1.406 . . . . 0.0 109.211 -176.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.02 -179.7 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 C-N-CA 125.275 1.43 . . . . 0.0 108.597 -175.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.6 124.52 27.0 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 128.735 2.814 . . . . 0.0 116.863 -170.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.36 14.5 m 150.22 -83.8 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.089 1 C-N-CA 132.135 4.174 . . . . 0.0 102.926 176.561 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.645 ' H ' HD13 ' A' ' 141' ' ' LEU . 0.0 OUTLIER 153.83 152.23 0.01 OUTLIER 'General case' 0 CA--C 1.483 -1.596 1 N-CA-C 96.747 -5.279 . . . . 0.0 96.747 -166.309 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.453 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 39.77 -51.78 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.975 2 CA-C-N 129.347 5.522 . . . . 0.0 124.173 -178.657 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.645 HD13 ' H ' ' A' ' 139' ' ' ARG 0.416 0.0 OUTLIER 73.12 132.78 0.04 OUTLIER Pre-proline 0 N--CA 1.427 -1.621 1 C-N-CA 150.524 11.53 . . . . 0.0 118.821 178.175 . . . . . . . . 5 4 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -74.86 -46.29 0.25 Allowed 'Trans proline' 0 C--N 1.368 1.562 0 C-N-CA 124.309 3.34 . . . . 0.0 111.226 162.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 116.12 123.03 3.5 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 130.093 3.711 . . . . 0.0 115.413 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -145.61 128.62 16.51 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 120.783 -1.422 . . . . 0.0 112.464 175.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -175.13 -171.22 0.5 Allowed 'General case' 0 C--N 1.349 0.586 0 C-N-CA 127.258 2.223 . . . . 0.0 108.267 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 24.5 t -133.65 -166.7 1.82 Allowed 'General case' 0 C--N 1.364 1.231 0 C-N-CA 125.971 1.709 . . . . 0.0 106.832 178.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -107.93 68.69 0.71 Allowed 'General case' 0 CA--C 1.512 -0.514 0 C-N-CA 127.257 2.223 . . . . 0.0 112.434 -177.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.353 . . -152.14 31.2 0.55 Allowed 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 113.084 -1.871 . . . . 0.0 108.43 -169.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 34.7 m -130.87 -166.15 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.96 0 C-N-CA 126.283 1.833 . . . . 0.0 110.636 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . 0.543 0.0 OUTLIER -87.88 150.07 3.88 Favored 'Isoleucine or valine' 0 C--N 1.356 0.866 1 C-N-CA 133.397 4.679 . . . . 0.0 110.089 176.107 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.12 158.31 33.29 Favored 'General case' 0 N--CA 1.416 -2.127 1 C-N-CA 145.279 9.432 . . . . 0.0 110.91 -171.888 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 14.6 t -74.18 113.88 11.89 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 128.003 3.763 . . . . 0.0 102.883 166.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.565 ' HA ' ' CD2' ' A' ' 73' ' ' HIS . 0.1 OUTLIER . . . . . 0 N--CA 1.402 -2.844 0 CA-C-N 109.582 -3.463 . . . . 0.0 108.841 -167.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 tpt . . . . . 0 CA--C 1.517 -0.319 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 29.4 p -90.73 -174.51 4.09 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 127.62 2.368 . . . . 0.0 112.761 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.3 mm -95.2 25.23 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.972 0 CA-C-O 125.049 2.356 . . . . 0.0 110.111 176.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -90.07 33.63 0.87 Allowed 'General case' 0 C--N 1.35 0.605 0 C-N-CA 127.94 2.496 . . . . 0.0 114.264 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -58.23 1.93 Allowed 'General case' 0 N--CA 1.448 -0.557 1 C-N-CA 135.515 5.526 . . . . 0.0 106.768 164.557 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 13.5 mt-10 -66.21 -9.82 35.79 Favored 'General case' 0 C--N 1.369 1.449 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.31 -38.14 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 C-N-CA 129.561 3.145 . . . . 0.0 112.035 177.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -71.56 -47.4 55.29 Favored 'General case' 0 C--N 1.357 0.933 1 C-N-CA 132.148 4.179 . . . . 0.0 107.665 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.9 mt -58.72 -43.88 88.76 Favored 'Isoleucine or valine' 0 C--N 1.37 1.497 0 C-N-CA 125.254 1.422 . . . . 0.0 112.132 168.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.296 91.2 mtm-85 -64.09 -50.14 69.48 Favored 'General case' 0 C--N 1.376 1.739 0 O-C-N 120.046 -1.659 . . . . 0.0 114.33 169.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 29.7 mtp180 -57.5 -28.64 63.63 Favored 'General case' 0 C--N 1.374 1.639 0 CA-C-N 124.405 3.275 . . . . 0.0 119.165 172.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -77.6 -51.64 10.32 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 130.374 3.47 . . . . 0.0 112.006 172.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -57.44 -28.62 63.48 Favored 'General case' 0 C--N 1.378 1.809 0 C-N-CA 128.131 2.572 . . . . 0.0 110.742 170.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.5 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.2 OUTLIER -70.71 -45.36 65.08 Favored 'General case' 0 C--O 1.206 -1.215 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.544 167.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.446 HH21 ' HG3' ' A' ' 47' ' ' GLN . 24.4 ttt180 -55.81 -40.39 72.67 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.747 -1.221 . . . . 0.0 114.106 169.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 mmt-85 -63.45 -49.08 75.08 Favored 'General case' 0 C--N 1.374 1.654 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 166.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -56.77 -43.51 80.87 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 129.397 3.079 . . . . 0.0 110.875 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.473 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.76 -54.95 39.01 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 130.546 3.538 . . . . 0.0 112.174 175.753 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -75.82 -39.62 56.42 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 -178.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -73.2 -36.11 66.46 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.749 2.42 . . . . 0.0 112.426 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.526 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.341 33.4 mt-10 -77.64 -29.37 51.66 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 120.463 -1.398 . . . . 0.0 110.89 167.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.515 ' CZ ' ' CE2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -59.18 -32.58 70.04 Favored 'General case' 0 C--N 1.383 2.049 0 O-C-N 119.175 -2.203 . . . . 0.0 113.511 168.59 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -45.98 74.27 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 127.774 2.43 . . . . 0.0 109.527 167.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -57.47 -39.75 77.06 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 170.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.569 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.1 mt -72.07 -45.56 62.59 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 O-C-N 120.908 -1.12 . . . . 0.0 111.657 177.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.488 8.3 p30 -70.84 -24.16 62.48 Favored 'General case' 0 C--N 1.373 1.61 0 O-C-N 120.179 -1.575 . . . . 0.0 114.283 173.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -73.77 -29.99 62.52 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.159 2.184 . . . . 0.0 110.182 169.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.68 -38.46 64.9 Favored 'General case' 0 C--N 1.39 2.346 0 O-C-N 118.315 -2.741 . . . . 0.0 109.739 172.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.474 HG12 ' CE2' ' A' ' 41' ' ' PHE . 1.3 mt -64.62 -46.13 93.37 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 CA-C-O 118.04 -0.981 . . . . 0.0 111.101 167.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.8 tpp180 -55.38 -45.0 76.62 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 122.632 2.469 . . . . 0.0 116.705 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.59 -41.16 47.27 Favored 'General case' 0 CA--C 1.488 -1.418 0 C-N-CA 128.018 2.527 . . . . 0.0 112.639 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.13 -31.4 30.6 Favored 'General case' 0 C--N 1.355 0.835 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.297 25.6 p -75.4 -34.82 61.1 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.388 1.475 . . . . 0.0 108.722 177.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -71.15 -35.88 71.85 Favored 'General case' 0 C--N 1.368 1.395 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 165.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 -36.2 64.31 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.79 -14.74 60.31 Favored 'General case' 0 C--N 1.375 1.697 0 CA-C-N 120.761 1.619 . . . . 0.0 114.016 171.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.37 15.42 44.15 Favored Glycine 0 C--N 1.376 2.8 0 O-C-N 121.187 -0.945 . . . . 0.0 114.51 172.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.464 ' CG2' ' H ' ' A' ' 39' ' ' SER . 7.5 p -99.98 179.37 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 126.379 1.872 . . . . 0.0 107.026 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.524 ' HB3' HD21 ' A' ' 81' ' ' LEU 0.27 32.5 t -83.56 155.71 23.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 124.676 2.179 . . . . 0.0 110.957 167.444 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.9 m -92.89 130.1 38.59 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.935 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.474 ' CE2' HG12 ' A' ' 29' ' ' ILE . 5.0 p90 -113.41 152.73 29.66 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 129.09 2.956 . . . . 0.0 105.704 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -101.5 161.35 13.7 Favored 'General case' 0 C--N 1.354 0.795 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -121.41 120.3 34.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.146 -1.596 . . . . 0.0 111.281 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.55 141.46 51.36 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.566 ' CZ ' HD11 ' A' ' 50' ' ' LEU . 4.3 m-85 -101.48 150.16 23.33 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.892 1.277 . . . . 0.0 108.871 172.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.4 m -123.06 85.78 2.48 Favored 'General case' 0 C--N 1.349 0.587 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 165.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.446 ' HG3' HH21 ' A' ' 15' ' ' ARG . 4.7 mm-40 -48.24 -10.9 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 121.217 3.784 . . . . 0.0 121.217 -168.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.68 -37.55 79.09 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 125.948 3.976 . . . . 0.0 116.166 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -68.28 -43.38 77.86 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-O 125.968 2.794 . . . . 0.0 111.132 171.458 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.566 HD11 ' CZ ' ' A' ' 45' ' ' TYR . 2.7 tt -64.11 -38.72 92.07 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 118.62 -2.55 . . . . 0.0 109.533 176.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -60.43 -32.46 71.38 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 129.621 3.168 . . . . 0.0 109.585 171.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 78.0 mtm180 -63.02 -47.12 84.42 Favored 'General case' 0 C--N 1.391 2.383 0 O-C-N 120.357 -1.464 . . . . 0.0 113.625 161.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -28.59 68.47 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . 0.336 0.1 OUTLIER -70.3 -39.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 131.698 3.999 . . . . 0.0 111.179 179.299 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -107.39 -26.48 10.96 Favored 'General case' 0 C--N 1.372 1.559 0 N-CA-C 117.24 2.311 . . . . 0.0 117.24 170.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -83.5 -18.6 37.92 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.801 2.091 . . . . 0.0 113.933 -175.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -115.21 -67.68 0.98 Allowed 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 127.528 2.331 . . . . 0.0 109.085 166.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.487 0.3 OUTLIER 74.91 135.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.429 -1.419 . . . . 0.0 111.121 -173.477 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.5 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 21.6 t70 44.88 45.19 8.4 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 130.922 3.689 . . . . 0.0 114.77 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.411 ' HB2' ' HB ' ' A' ' 63' ' ' VAL 0.399 10.4 pt-20 -74.33 62.26 0.95 Allowed 'General case' 0 CA--C 1.491 -1.308 0 C-N-CA 129.632 3.173 . . . . 0.0 114.436 179.43 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.39 14.0 p -79.0 -20.94 47.82 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.862 2.865 . . . . 0.0 113.18 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -64.21 -33.35 75.61 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.726 2.01 . . . . 0.0 111.151 166.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.438 HG12 ' CZ ' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -57.62 -46.48 86.42 Favored 'Isoleucine or valine' 0 C--N 1.37 1.466 0 C-N-CA 128.846 2.858 . . . . 0.0 109.392 -175.674 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.526 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 45.9 m-85 -61.68 -45.39 94.19 Favored 'General case' 0 CA--C 1.495 -1.171 1 C-N-CA 134.184 4.994 . . . . 0.0 112.65 169.527 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -66.12 -44.62 83.76 Favored 'General case' 0 C--N 1.35 0.597 0 CA-C-N 122.001 2.182 . . . . 0.0 114.503 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.432 ' CD1' HD13 ' A' ' 113' ' ' LEU . 1.4 tm? -63.09 -50.46 70.45 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.36 1.864 . . . . 0.0 114.177 166.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.438 ' CZ ' HG12 ' A' ' 63' ' ' VAL 0.742 0.0 OUTLIER -76.7 -29.15 56.16 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 118.979 -2.326 . . . . 0.0 111.59 -175.829 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.569 ' CE1' HG12 ' A' ' 25' ' ' ILE . 63.7 m-70 -64.17 -28.17 69.57 Favored 'General case' 0 C--N 1.367 1.353 0 C-N-CA 125.489 1.515 . . . . 0.0 112.147 162.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -77.27 -26.66 52.67 Favored 'General case' 0 C--N 1.377 1.786 0 O-C-N 121.214 -0.929 . . . . 0.0 112.017 171.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.322 0.0 OUTLIER -88.13 -44.29 15.68 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 C-N-CA 126.353 1.861 . . . . 0.0 115.054 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.553 9.1 mmpt? -49.02 0.21 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 1 C-N-CA 137.194 6.197 . . . . 0.0 120.365 -178.129 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.455 ' C ' ' H ' ' A' ' 74' ' ' VAL . 37.1 t70 -64.62 -24.04 67.46 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 131.033 3.733 . . . . 0.0 107.859 157.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -42.07 1.55 0.0 OUTLIER 'General case' 0 C--N 1.389 2.315 1 C-N-CA 139.394 7.078 . . . . 0.0 119.207 176.659 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.455 ' H ' ' C ' ' A' ' 72' ' ' ASP . 46.2 t -50.03 -49.22 22.21 Favored 'Isoleucine or valine' 0 CA--C 1.461 -2.463 1 C-N-CA 135.864 5.666 . . . . 0.0 107.382 170.486 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -58.88 -29.26 66.88 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 117.468 2.395 . . . . 0.0 117.468 176.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -75.19 -50.84 14.96 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 127.523 2.329 . . . . 0.0 112.634 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.372 14.6 p -66.93 -29.55 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.043 0 C-N-CA 127.631 2.373 . . . . 0.0 111.545 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -75.11 -32.75 61.49 Favored 'General case' 0 C--N 1.365 1.255 1 C-N-CA 132.322 4.249 . . . . 0.0 112.826 169.135 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . 0.356 6.7 pt-20 -67.74 -29.81 69.13 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 122.407 2.367 . . . . 0.0 110.034 169.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -66.47 -47.66 72.37 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 163.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' A' ' 39' ' ' SER 0.381 15.9 tp -71.96 -11.16 60.65 Favored 'General case' 0 C--N 1.373 1.595 0 C-N-CA 130.011 3.325 . . . . 0.0 119.762 176.773 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.9 m -65.83 3.48 0.78 Allowed 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 128.223 2.609 . . . . 0.0 117.975 -175.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 46.0 ttp -124.21 163.13 37.82 Favored Pre-proline 0 CA--C 1.567 1.624 0 C-N-CA 128.818 2.847 . . . . 0.0 106.411 174.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -65.24 -175.64 0.42 Allowed 'Trans proline' 0 C--N 1.38 2.187 1 C-N-CA 128.894 6.396 . . . . 0.0 111.449 167.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.27 134.9 38.49 Favored 'Trans proline' 0 C--N 1.392 2.822 2 CA-C-N 134.767 6.31 . . . . 0.0 112.422 175.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . 0.364 25.5 ttp180 -25.48 -55.22 0.18 Allowed Pre-proline 0 C--N 1.35 0.619 0 C-N-CA 129.554 3.142 . . . . 0.0 118.487 -174.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -65.02 141.46 70.42 Favored 'Trans proline' 0 CA--C 1.542 0.891 1 C-N-CA 126.526 4.817 . . . . 0.0 121.63 168.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.425 ' H ' HD12 ' A' ' 89' ' ' ILE . 2.9 m-20 -109.28 -22.51 12.04 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.96 2.904 . . . . 0.0 111.561 169.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.425 HD12 ' H ' ' A' ' 88' ' ' ASP . 0.4 OUTLIER -132.85 -168.2 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.519 1 C-N-CA 135.702 5.601 . . . . 0.0 108.067 -174.613 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -110.61 -18.7 13.11 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 169.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -103.75 -30.79 10.18 Favored 'General case' 0 C--N 1.365 1.281 1 N-CA-C 122.752 4.353 . . . . 0.0 122.752 -169.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -104.83 -5.99 20.65 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 120.543 -1.348 . . . . 0.0 110.794 -177.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.797 4.0 p90 25.39 -48.78 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.761 2 N-CA-C 125.412 5.338 . . . . 0.0 125.412 -172.195 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.536 ' CG2' HG13 ' A' ' 97' ' ' VAL . 19.3 mt -91.5 129.09 42.75 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.286 0 C-N-CA 129.314 3.045 . . . . 0.0 112.774 175.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -134.75 -56.07 0.83 Allowed 'General case' 0 CA--C 1.495 -1.144 0 CA-C-N 113.885 -1.507 . . . . 0.0 113.658 -175.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -109.21 29.54 9.54 Favored Glycine 0 CA--C 1.49 -1.473 0 N-CA-C 108.639 -1.784 . . . . 0.0 108.639 172.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.536 HG13 ' CG2' ' A' ' 94' ' ' ILE . 1.2 t -113.65 142.03 27.59 Favored 'Isoleucine or valine' 0 C--N 1.365 1.265 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 170.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -85.72 16.71 3.78 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 127.7 2.4 . . . . 0.0 116.564 -175.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.4 t80 68.06 41.59 1.99 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 128.004 2.522 . . . . 0.0 112.665 178.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -112.07 153.69 44.52 Favored Pre-proline 0 N--CA 1.447 -0.613 0 C-N-CA 127.649 2.38 . . . . 0.0 111.116 -173.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -78.12 170.57 18.5 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 125.163 3.909 . . . . 0.0 113.545 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.24 33.63 4.02 Favored Glycine 0 C--N 1.349 1.283 0 N-CA-C 118.164 2.026 . . . . 0.0 118.164 -175.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.2 ptt-85 -141.06 152.54 44.91 Favored 'General case' 0 N--CA 1.44 -0.974 0 O-C-N 121.067 -1.255 . . . . 0.0 109.024 177.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -109.24 125.84 52.68 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 126.37 1.868 . . . . 0.0 107.223 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -128.51 109.4 11.35 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 9.7 pt -135.97 140.59 43.76 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 C-N-CA 125.235 1.414 . . . . 0.0 112.61 -174.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.411 HG21 ' HB ' ' A' ' 149' ' ' VAL . 2.7 m -111.57 121.85 46.24 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 119.871 -1.768 . . . . 0.0 108.73 173.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.441 ' HB2' HG23 ' A' ' 150' ' ' ILE . 42.1 t0 -139.19 171.77 13.8 Favored 'General case' 0 CA--C 1.504 -0.826 1 N-CA-C 100.093 -4.04 . . . . 0.0 100.093 177.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.452 ' HA3' HD23 ' A' ' 111' ' ' LEU . . . 78.75 -68.37 3.03 Favored Glycine 0 N--CA 1.475 1.288 0 O-C-N 118.033 -2.917 . . . . 0.0 113.378 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.481 HD22 HD11 ' A' ' 141' ' ' LEU . 0.1 OUTLIER 156.01 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.366 1.294 2 C-N-CA 134.324 5.05 . . . . 0.0 109.474 -152.609 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.452 HD23 ' HA3' ' A' ' 109' ' ' GLY 0.476 1.1 pt? -78.22 137.4 38.11 Favored 'General case' 0 CA--C 1.507 -0.706 1 C-N-CA 134.978 5.311 . . . . 0.0 119.813 -177.543 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.34 100.66 13.42 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.432 HD13 ' CD1' ' A' ' 66' ' ' LEU 0.314 0.0 OUTLIER -94.84 127.78 41.1 Favored 'General case' 0 C--N 1.38 1.907 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 176.191 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -125.16 130.43 7.34 Favored Glycine 0 C--N 1.352 1.464 0 N-CA-C 106.138 -2.785 . . . . 0.0 106.138 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -131.95 137.17 47.83 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.469 2.634 . . . . 0.0 105.671 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.0 m -124.99 102.05 7.34 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.841 1.655 . . . . 0.0 106.808 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.08 116.35 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 121.328 1.876 . . . . 0.0 107.276 172.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.404 ' HB2' HD22 ' A' ' 121' ' ' ASN . 1.6 m 3.66 104.58 0.0 OUTLIER 'General case' 0 C--N 1.38 1.921 0 C-N-CA 130.937 3.695 . . . . 0.0 117.677 -160.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.55 ' H ' ' HB2' ' A' ' 130' ' ' GLN . 34.4 ttpt -34.31 -44.25 0.56 Allowed Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 118.474 2.768 . . . . 0.0 118.474 -178.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -98.13 18.7 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.288 0 C-N-CA 123.47 2.78 . . . . 0.0 114.305 172.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.404 HD22 ' HB2' ' A' ' 118' ' ' CYS 0.461 0.6 OUTLIER -161.53 108.05 1.38 Allowed 'General case' 0 CA--C 1.562 1.417 0 N-CA-C 118.899 2.926 . . . . 0.0 118.899 -178.988 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -99.3 -45.05 6.0 Favored 'General case' 0 C--N 1.351 0.671 0 O-C-N 118.67 -2.519 . . . . 0.0 115.193 170.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.411 0.0 OUTLIER -40.2 -14.74 0.01 OUTLIER 'General case' 0 C--N 1.353 0.726 1 C-N-CA 136.278 5.831 . . . . 0.0 120.754 -172.347 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -110.46 -6.07 15.01 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.773 2.029 . . . . 0.0 113.073 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' A' ' 81' ' ' LEU 0.416 0.0 OUTLIER 64.65 -51.71 0.31 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 128.379 2.672 . . . . 0.0 117.567 176.341 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.283 2.5 p30 -64.03 -15.97 0.33 Allowed Pre-proline 0 CA--C 1.551 1.004 1 C-N-CA 132.08 4.152 . . . . 0.0 119.562 173.386 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.358 39.7 Cg_exo -37.78 -176.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.486 1 C-N-CA 128.771 6.314 . . . . 0.0 121.008 166.464 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.0 m -99.61 164.3 12.13 Favored 'General case' 0 CA--C 1.486 -1.518 0 N-CA-C 104.113 -2.551 . . . . 0.0 104.113 -173.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.3 mp -100.12 129.04 46.11 Favored 'General case' 0 C--N 1.348 0.505 0 N-CA-C 100.208 -3.997 . . . . 0.0 100.208 176.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . 0.55 ' HB2' ' H ' ' A' ' 119' ' ' LYS . 0.6 OUTLIER -93.19 60.21 3.18 Favored 'General case' 0 C--N 1.364 1.198 0 C-N-CA 126.258 1.823 . . . . 0.0 107.635 -171.038 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.304 1.9 p 102.8 138.27 0.01 OUTLIER 'General case' 0 C--N 1.373 1.593 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 -171.113 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -114.87 133.69 55.76 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 100.796 -3.779 . . . . 0.0 100.796 163.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 7.7 ttp -109.29 120.36 42.27 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 127.263 2.225 . . . . 0.0 105.446 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -127.71 116.16 19.83 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.0 mm -139.8 138.44 38.66 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 CA-C-N 119.341 0.973 . . . . 0.0 109.495 178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -127.68 169.03 19.74 Favored 'Isoleucine or valine' 0 C--N 1.349 0.583 0 C-N-CA 128.164 2.586 . . . . 0.0 108.022 178.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -100.33 123.64 44.81 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.13 2.972 . . . . 0.0 114.398 -176.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.449 ' HB2' ' HD2' ' A' ' 139' ' ' ARG 0.261 2.5 p 171.86 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 123.934 1.825 . . . . 0.0 115.424 175.655 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.449 ' HD2' ' HB2' ' A' ' 138' ' ' SER . 0.7 OUTLIER 178.0 -50.32 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 109.628 -3.442 . . . . 0.0 107.871 -155.536 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 175.74 73.81 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.564 0 CA-C-O 126.005 2.812 . . . . 0.0 104.081 -170.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.512 HD11 ' H ' ' A' ' 144' ' ' LYS 0.285 0.0 OUTLIER -61.69 133.5 93.55 Favored Pre-proline 0 N--CA 1.447 -0.599 0 N-CA-C 117.764 2.505 . . . . 0.0 117.764 -162.62 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -83.65 -12.18 8.89 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.969 3.112 . . . . 0.0 112.837 -179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 104.85 92.36 2.26 Favored Glycine 0 CA--C 1.491 -1.434 0 C-N-CA 127.206 2.336 . . . . 0.0 112.382 -168.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 0.512 ' H ' HD11 ' A' ' 141' ' ' LEU . 25.8 ttpp -94.2 156.55 16.49 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-O 122.578 1.18 . . . . 0.0 111.911 177.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -142.01 110.31 5.99 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 127.717 2.407 . . . . 0.0 104.898 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 32.9 p -138.4 89.83 2.41 Favored 'General case' 0 CA--C 1.5 -0.967 0 C-N-CA 124.123 0.969 . . . . 0.0 113.431 -171.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.272 48.7 mmtm 78.82 -45.13 0.37 Allowed 'General case' 0 CA--C 1.505 -0.777 0 C-N-CA 129.601 3.16 . . . . 0.0 112.571 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 76.92 87.96 0.08 Allowed 'General case' 0 C--N 1.358 0.952 0 N-CA-C 116.548 2.055 . . . . 0.0 116.548 163.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . 0.411 ' HB ' HG21 ' A' ' 107' ' ' THR 0.382 15.8 t -58.49 -72.83 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.371 1.542 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 -174.199 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.441 HG23 ' HB2' ' A' ' 108' ' ' ASP 0.506 0.0 OUTLIER -87.81 147.22 5.41 Favored 'Isoleucine or valine' 0 C--N 1.349 0.576 0 C-N-CA 131.065 3.746 . . . . 0.0 116.488 -175.526 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.334 5.6 ptpt -78.02 149.6 33.99 Favored 'General case' 0 N--CA 1.423 -1.802 2 C-N-CA 138.292 6.637 . . . . 0.0 113.584 177.24 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 20.2 p -96.33 97.73 9.72 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 118.314 -2.741 . . . . 0.0 107.809 169.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.257 1.472 1 C-N-CA 135.319 5.448 . . . . 0.0 109.155 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 ttt . . . . . 0 CA--C 1.529 0.139 0 CA-C-O 124.366 2.031 . . . . 0.0 111.753 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.5 175.46 8.8 Favored 'General case' 0 C--N 1.348 0.528 0 C-N-CA 128.268 2.627 . . . . 0.0 113.933 -176.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 12.6 mm -80.79 47.42 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.893 0 C-N-CA 128.406 2.682 . . . . 0.0 112.507 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.427 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 14.1 m120 -75.42 18.24 0.23 Allowed 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 131.598 3.959 . . . . 0.0 113.414 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -81.86 -62.56 1.6 Allowed 'General case' 0 C--N 1.348 0.516 1 C-N-CA 133.714 4.806 . . . . 0.0 110.3 176.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -71.29 -9.23 57.79 Favored 'General case' 0 C--N 1.368 1.387 0 C-N-CA 125.585 1.554 . . . . 0.0 112.279 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.427 ' CG1' ' HA ' ' A' ' 4' ' ' ASN 0.286 0.7 OUTLIER -88.41 -28.45 5.38 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 C-N-CA 126.877 2.071 . . . . 0.0 108.969 174.368 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -72.86 -38.96 66.87 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 125.7 1.6 . . . . 0.0 108.688 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 28.8 mt -61.68 -44.52 98.85 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 C-N-CA 125.051 1.34 . . . . 0.0 110.636 165.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.314 0.6 OUTLIER -58.85 -48.91 79.7 Favored 'General case' 0 C--N 1.367 1.336 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 173.301 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -57.74 -34.11 69.17 Favored 'General case' 0 C--N 1.374 1.636 0 N-CA-C 118.835 2.902 . . . . 0.0 118.835 166.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -77.08 -49.28 15.66 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 128.141 2.576 . . . . 0.0 111.917 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -58.18 -29.28 65.51 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 130.04 3.336 . . . . 0.0 109.375 170.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -76.14 -37.56 57.84 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 169.832 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -58.45 -44.19 89.1 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.767 1.227 . . . . 0.0 111.419 166.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -62.85 -45.14 93.98 Favored 'General case' 0 C--N 1.382 2.019 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 166.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.409 ' CD2' HG22 ' A' ' 61' ' ' THR . 0.6 OUTLIER -56.92 -42.92 80.85 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 129.542 3.137 . . . . 0.0 112.207 174.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.01 -54.41 26.34 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 128.509 2.724 . . . . 0.0 113.114 177.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -74.67 -36.03 62.81 Favored 'General case' 0 C--N 1.367 1.361 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.5 m -72.78 -40.81 65.63 Favored 'General case' 0 C--N 1.365 1.256 0 C-N-CA 125.958 1.703 . . . . 0.0 111.946 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.503 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.545 52.0 mt-10 -77.77 -29.92 51.19 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 119.982 -1.699 . . . . 0.0 114.066 169.519 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -59.32 -36.95 76.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 118.284 -2.76 . . . . 0.0 112.665 168.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.251 7.4 ptm180 -71.22 -33.35 69.8 Favored 'General case' 0 C--N 1.376 1.756 0 C-N-CA 124.031 0.933 . . . . 0.0 112.368 168.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -61.91 -48.22 81.41 Favored 'General case' 0 C--N 1.362 1.134 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 170.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.488 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.1 mt -72.33 -46.42 57.02 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 O-C-N 121.333 -0.855 . . . . 0.0 110.975 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.567 0.0 OUTLIER -74.23 -23.5 59.17 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 119.761 -1.837 . . . . 0.0 114.29 177.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -72.83 -32.78 65.73 Favored 'General case' 0 C--N 1.388 2.24 0 O-C-N 120.213 -1.554 . . . . 0.0 110.515 168.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.52 -40.73 85.1 Favored 'General case' 0 C--N 1.389 2.307 0 O-C-N 118.509 -2.619 . . . . 0.0 112.407 168.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.452 ' HB ' ' CZ ' ' A' ' 41' ' ' PHE 0.395 0.1 OUTLIER -64.77 -44.63 96.43 Favored 'Isoleucine or valine' 0 C--N 1.369 1.422 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 176.461 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -67.97 -38.84 83.23 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -76.51 -35.91 58.06 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 125.325 1.45 . . . . 0.0 111.463 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.8 -33.74 60.15 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 176.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.3 t -73.77 -37.3 65.04 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 125.512 1.525 . . . . 0.0 109.852 175.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp -68.66 -44.65 73.65 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 168.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.25 -30.47 64.91 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.094 1.758 . . . . 0.0 113.543 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.03 -17.53 60.49 Favored 'General case' 0 C--N 1.383 2.022 0 CA-C-N 119.307 0.958 . . . . 0.0 113.197 169.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.37 18.31 28.9 Favored Glycine 0 C--N 1.374 2.693 0 O-C-N 121.179 -0.95 . . . . 0.0 114.775 174.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.411 HG23 ' CD2' ' A' ' 81' ' ' LEU . 0.4 OUTLIER -111.48 171.59 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 t -59.06 177.84 0.15 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 129.398 3.079 . . . . 0.0 115.979 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.6 m -96.86 126.39 41.97 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 125.689 1.596 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.452 ' CZ ' ' HB ' ' A' ' 29' ' ' ILE 0.286 41.8 p90 -113.6 141.02 47.69 Favored 'General case' 0 C--N 1.357 0.921 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 174.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -116.14 164.9 13.79 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 123.42 1.581 . . . . 0.0 113.326 -172.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -121.18 133.96 55.2 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.361 1.864 . . . . 0.0 113.872 -174.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -139.44 162.04 36.02 Favored 'General case' 0 C--N 1.37 1.496 0 N-CA-C 105.026 -2.212 . . . . 0.0 105.026 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.287 9.8 m-85 -125.31 161.34 27.19 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 126.688 1.995 . . . . 0.0 113.589 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.1 m -132.66 89.83 2.69 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 103.334 -2.839 . . . . 0.0 103.334 159.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' A' ' 51' ' ' ASP . 11.1 mp0 -47.45 -10.25 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 131.658 3.983 . . . . 0.0 118.354 -175.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.47 -37.12 56.39 Favored 'General case' 0 N--CA 1.503 2.212 1 CA-C-N 128.417 5.099 . . . . 0.0 119.201 -176.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.501 ' H ' ' HG ' ' A' ' 49' ' ' LEU . 0.4 OUTLIER -69.6 -41.37 75.82 Favored 'General case' 0 C--O 1.242 0.7 1 C-N-CA 134.415 5.086 . . . . 0.0 110.82 173.798 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.282 4.2 tt -74.8 -28.99 60.95 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 127.343 2.257 . . . . 0.0 110.707 171.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' A' ' 47' ' ' GLN . 10.1 t70 -68.05 -31.95 71.96 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 130.323 3.449 . . . . 0.0 108.165 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -70.99 -40.79 71.66 Favored 'General case' 0 C--N 1.373 1.594 0 O-C-N 119.874 -1.766 . . . . 0.0 114.984 160.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.22 62.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.407 ' CG2' ' HA ' ' A' ' 51' ' ' ASP . 2.7 tt -72.89 -35.9 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 1 C-N-CA 132.064 4.146 . . . . 0.0 110.828 178.292 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -108.63 -30.14 8.37 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 119.155 3.02 . . . . 0.0 119.155 171.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -88.91 -5.24 58.13 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 119.701 -1.875 . . . . 0.0 114.067 -172.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -137.73 -64.58 0.54 Allowed 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 -178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 54' ' ' ILE 0.697 0.0 OUTLIER 119.55 -28.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.374 1.659 0 N-CA-C 121.768 3.988 . . . . 0.0 121.768 167.37 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.539 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 31.1 t70 -147.37 80.34 1.51 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 130.735 3.614 . . . . 0.0 105.992 -170.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' HB2' ' HB ' ' A' ' 63' ' ' VAL 0.54 12.5 pt-20 -79.77 59.1 3.0 Favored 'General case' 0 C--N 1.38 1.922 0 O-C-N 118.883 -2.386 . . . . 0.0 112.301 177.216 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.409 HG22 ' CD2' ' A' ' 17' ' ' HIS 0.369 36.0 p -79.56 -21.66 44.81 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 129.816 3.247 . . . . 0.0 113.955 177.238 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.402 ' HH ' ' HB2' ' A' ' 110' ' ' ASN . 78.9 t80 -67.45 -30.24 69.92 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 130.643 3.577 . . . . 0.0 111.132 167.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.457 HG11 ' CZ ' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -64.9 -44.68 96.17 Favored 'Isoleucine or valine' 0 C--N 1.367 1.328 0 C-N-CA 126.078 1.751 . . . . 0.0 110.579 178.773 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 59.5 m-85 -58.88 -43.33 90.91 Favored 'General case' 0 C--O 1.204 -1.293 1 C-N-CA 133.727 4.811 . . . . 0.0 111.542 170.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -67.57 -45.6 75.11 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 121.786 2.084 . . . . 0.0 115.954 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.458 ' CD2' ' HA3' ' A' ' 109' ' ' GLY . 2.8 tm? -62.19 -49.21 76.72 Favored 'General case' 0 CA--C 1.57 1.738 0 O-C-N 119.198 -2.189 . . . . 0.0 112.315 169.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.475 ' HA ' ' CG1' ' A' ' 70' ' ' ILE 0.859 0.0 OUTLIER -77.49 -16.28 58.82 Favored 'General case' 0 C--N 1.379 1.869 0 O-C-N 118.923 -2.361 . . . . 0.0 115.078 -178.657 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.488 ' CE1' HG12 ' A' ' 25' ' ' ILE 0.295 58.2 m-70 -75.65 -23.13 56.28 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.437 2.295 . . . . 0.0 109.896 163.331 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.44 71.6 mmtt -75.47 -40.19 57.67 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 114.767 -2.773 . . . . 0.0 114.28 153.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.475 ' CG1' ' HA ' ' A' ' 67' ' ' PHE . 16.1 mm -53.63 -25.87 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 C-N-CA 129.643 3.177 . . . . 0.0 115.126 175.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -52.91 -26.1 13.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 C-N-CA 131.056 3.742 . . . . 0.0 118.209 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -101.3 2.89 40.22 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 125.282 1.433 . . . . 0.0 107.551 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.417 ' CE1' ' HB2' ' A' ' 151' ' ' LYS 0.279 94.3 m-70 -86.17 13.22 8.19 Favored 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.622 2.769 . . . . 0.0 112.177 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 78.6 t -39.16 -55.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.576 1 C-N-CA 133.334 4.654 . . . . 0.0 109.55 157.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -58.59 -28.52 65.66 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.546 2.338 . . . . 0.0 115.996 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -75.47 -44.78 42.27 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 125.319 1.448 . . . . 0.0 112.23 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.341 0.3 OUTLIER -67.83 -32.11 55.1 Favored 'Isoleucine or valine' 0 C--N 1.371 1.54 0 CA-C-O 124.338 2.018 . . . . 0.0 112.684 175.56 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -74.98 -39.49 61.25 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 129.883 3.273 . . . . 0.0 114.319 173.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.41 -29.2 70.53 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-N 120.694 1.588 . . . . 0.0 112.191 166.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -70.74 -32.08 69.13 Favored 'General case' 0 CA--C 1.58 2.098 0 C-N-CA 126.046 1.739 . . . . 0.0 114.485 167.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.411 ' CD2' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -69.27 -45.76 68.87 Favored 'General case' 0 N--CA 1.51 2.566 0 C-N-CA 128.814 2.846 . . . . 0.0 112.239 169.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.2 m -66.13 3.27 0.9 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 130.097 3.359 . . . . 0.0 119.327 -165.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 27.8 ptm -83.86 165.56 38.78 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 124.691 1.196 . . . . 0.0 112.456 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -65.39 171.99 8.44 Favored 'Trans proline' 0 C--N 1.372 1.766 0 C-N-CA 124.951 3.768 . . . . 0.0 110.942 168.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.471 ' HA ' ' HZ3' ' A' ' 125' ' ' LYS . 11.8 Cg_endo -54.65 155.48 17.23 Favored 'Trans proline' 0 C--N 1.361 1.186 0 C-N-CA 125.183 3.922 . . . . 0.0 115.475 -167.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . 0.28 0.0 OUTLIER -70.07 -60.08 3.82 Favored Pre-proline 0 N--CA 1.483 1.211 0 O-C-N 120.502 -1.374 . . . . 0.0 112.851 -178.263 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -58.73 162.6 12.61 Favored 'Trans proline' 0 N--CA 1.454 -0.811 2 C-N-CA 126.002 4.468 . . . . 0.0 122.696 172.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 121.88 -6.3 0.0 OUTLIER 'General case' 0 C--N 1.372 1.55 3 C-N-CA 145.41 9.484 . . . . 0.0 101.142 -169.609 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . 0.504 0.4 OUTLIER 105.3 161.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.382 1.999 1 C-N-CA 141.659 7.984 . . . . 0.0 114.124 163.096 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -60.14 -11.52 6.29 Favored 'General case' 0 CA--C 1.553 1.063 0 O-C-N 118.099 -2.875 . . . . 0.0 114.433 170.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -93.87 -34.4 13.14 Favored 'General case' 0 C--N 1.358 0.962 0 C-N-CA 129.996 3.318 . . . . 0.0 115.21 167.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.59 -2.27 8.42 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 116.905 2.187 . . . . 0.0 116.905 -176.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -115.37 -49.78 2.75 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 116.826 2.158 . . . . 0.0 116.826 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.423 HD11 HG12 ' A' ' 97' ' ' VAL . 0.2 OUTLIER -77.51 137.71 21.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 -169.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -163.83 -37.74 0.03 OUTLIER 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 111.91 -2.405 . . . . 0.0 109.18 -170.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -91.47 21.44 35.39 Favored Glycine 0 C--N 1.366 2.229 0 C-N-CA 124.885 1.231 . . . . 0.0 112.855 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.423 HG12 HD11 ' A' ' 94' ' ' ILE 0.256 4.0 p -101.89 98.05 6.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-O 124.298 1.999 . . . . 0.0 110.531 179.822 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -88.27 7.08 33.89 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.25 3.02 . . . . 0.0 114.51 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -117.42 166.8 11.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 112.041 -2.345 . . . . 0.0 109.764 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -90.38 162.58 33.94 Favored Pre-proline 0 C--N 1.357 0.923 0 C-N-CA 125.225 1.41 . . . . 0.0 112.149 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -65.24 147.56 88.07 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 124.636 3.557 . . . . 0.0 116.193 178.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 63.98 -50.84 0.08 OUTLIER Glycine 0 C--N 1.357 1.714 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 162.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -128.87 159.56 35.41 Favored 'General case' 0 CA--C 1.501 -0.91 0 CA-C-O 123.931 1.824 . . . . 0.0 113.265 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.5 128.8 53.77 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.311 2.645 . . . . 0.0 104.647 174.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -129.78 131.86 46.36 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 103.526 -2.768 . . . . 0.0 103.526 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.8 mt -131.54 133.37 61.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.886 0 C-N-CA 126.487 1.915 . . . . 0.0 108.266 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.6 m -134.1 115.51 14.35 Favored 'General case' 0 C--N 1.353 0.743 0 O-C-N 120.72 -1.237 . . . . 0.0 110.615 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.409 ' HB2' HG13 ' A' ' 150' ' ' ILE . 0.4 OUTLIER 176.14 -173.2 0.09 Allowed 'General case' 0 C--N 1.365 1.274 0 N-CA-C 100.217 -3.994 . . . . 0.0 100.217 173.098 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.458 ' HA3' ' CD2' ' A' ' 66' ' ' LEU . . . 72.6 9.23 73.77 Favored Glycine 1 CA--C 1.44 -4.597 0 O-C-N 118.285 -2.759 . . . . 0.0 117.29 175.375 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.402 ' HB2' ' HH ' ' A' ' 62' ' ' TYR . 1.5 m-80 70.61 9.24 6.84 Favored 'General case' 0 C--N 1.377 1.781 0 C-N-CA 128.624 2.77 . . . . 0.0 110.876 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -120.56 130.33 54.16 Favored 'General case' 0 N--CA 1.44 -0.946 1 C-N-CA 134.45 5.1 . . . . 0.0 114.601 -164.587 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . 0.425 ' CE3' ' HA ' ' A' ' 146' ' ' SER . 9.8 m95 -112.51 100.15 8.52 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 101.065 -3.68 . . . . 0.0 101.065 174.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.296 1.3 pt? -107.51 138.59 43.45 Favored 'General case' 0 C--N 1.368 1.381 0 O-C-N 120.554 -1.341 . . . . 0.0 109.894 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.76 142.35 13.44 Favored Glycine 0 C--N 1.355 1.616 0 N-CA-C 107.452 -2.259 . . . . 0.0 107.452 172.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.45 132.36 44.23 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 104.636 -2.357 . . . . 0.0 104.636 176.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.4 m -109.97 108.94 19.36 Favored 'General case' 0 C--N 1.367 1.342 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.03 105.31 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 C-N-CA 127.827 2.451 . . . . 0.0 111.663 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 16.7 m 42.83 72.58 0.17 Allowed 'General case' 0 C--N 1.368 1.408 0 C-N-CA 129.831 3.252 . . . . 0.0 115.282 -170.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.363 37.9 ttpt -30.81 -62.04 0.25 Allowed Pre-proline 0 C--N 1.361 1.095 1 C-N-CA 132.275 4.23 . . . . 0.0 118.768 -171.924 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -71.84 66.97 3.17 Favored 'Trans proline' 0 CA--C 1.556 1.621 0 C-N-CA 125.087 3.858 . . . . 0.0 111.039 169.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.345 7.9 m120 -36.53 149.73 0.02 OUTLIER 'General case' 0 C--N 1.363 1.153 2 N-CA-C 125.615 5.413 . . . . 0.0 125.615 -170.012 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -162.65 -46.23 0.04 OUTLIER 'General case' 0 C--N 1.358 0.955 0 C-N-CA 130.91 3.684 . . . . 0.0 113.96 -174.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.353 0.0 OUTLIER 75.54 100.27 0.07 Allowed 'General case' 0 N--CA 1.424 -1.763 1 C-N-CA 133.185 4.594 . . . . 0.0 113.246 -178.833 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -105.62 16.68 25.01 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 117.86 2.541 . . . . 0.0 117.86 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.471 ' HZ3' ' HA ' ' A' ' 85' ' ' PRO 0.72 0.0 OUTLIER 19.86 55.11 0.01 OUTLIER 'General case' 0 C--N 1.366 1.289 0 N-CA-C 121.292 3.812 . . . . 0.0 121.292 174.17 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 170.59 46.42 0.0 OUTLIER Pre-proline 0 CA--C 1.568 1.667 1 C-N-CA 140.319 7.448 . . . . 0.0 105.785 -172.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -92.56 -179.25 1.03 Allowed 'Trans proline' 0 C--N 1.361 1.205 0 CA-C-N 127.349 3.66 . . . . 0.0 118.951 -158.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 12.1 p -124.62 150.08 46.39 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.675 -2.342 . . . . 0.0 104.675 174.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 mp -101.82 130.34 48.24 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 102.174 -3.269 . . . . 0.0 102.174 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -114.62 45.72 1.51 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 119.949 -1.72 . . . . 0.0 109.364 -170.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 45.4 t 141.81 126.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.522 0 C-N-CA 128.201 2.6 . . . . 0.0 105.194 -170.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -115.36 111.47 20.9 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 102.583 -3.117 . . . . 0.0 102.583 165.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 4.5 ttt -99.43 121.22 40.83 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.03 3.332 . . . . 0.0 108.505 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . 0.425 ' HB3' HG23 ' A' ' 63' ' ' VAL . . . -128.69 116.44 19.55 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.56 1.544 . . . . 0.0 109.174 178.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . 0.47 HG22 ' H ' ' A' ' 144' ' ' LYS . 11.5 mm -136.03 128.29 45.59 Favored 'Isoleucine or valine' 0 C--N 1.365 1.252 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 176.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.442 ' H ' ' HG ' ' A' ' 141' ' ' LEU . 0.0 OUTLIER -103.88 171.39 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 C-N-CA 127.723 2.409 . . . . 0.0 108.61 -179.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.72 -178.78 5.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.148 1.779 . . . . 0.0 106.398 163.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.744 52.6 p -65.24 75.8 0.06 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 117.644 2.461 . . . . 0.0 117.644 175.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.525 ' HD2' ' H ' ' A' ' 141' ' ' LEU . 0.0 OUTLIER -71.83 -21.49 61.68 Favored 'General case' 0 C--N 1.377 1.772 0 CA-C-N 110.989 -2.823 . . . . 0.0 106.614 148.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . 0.402 70.6 mtt85 165.8 -45.86 0.0 OUTLIER 'General case' 0 CA--C 1.473 -2.009 1 C-N-CA 144.85 9.26 . . . . 0.0 114.218 -179.217 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' LEU . . . . . 0.525 ' H ' ' HD2' ' A' ' 139' ' ' ARG 0.262 0.1 OUTLIER -41.82 103.92 0.33 Allowed Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 129.298 3.039 . . . . 0.0 117.513 -175.756 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -80.09 97.35 1.05 Allowed 'Trans proline' 0 C--N 1.304 -1.775 0 C-N-CA 124.442 3.428 . . . . 0.0 110.841 171.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -175.92 -99.08 0.12 Allowed Glycine 0 N--CA 1.464 0.52 0 N-CA-C 118.858 2.303 . . . . 0.0 118.858 -174.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 0.47 ' H ' HG22 ' A' ' 135' ' ' ILE 0.407 6.9 tttt 65.01 159.44 0.11 Allowed 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 120.383 3.475 . . . . 0.0 120.383 -173.115 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -141.73 -147.39 0.21 Allowed 'General case' 0 C--N 1.373 1.613 0 C-N-CA 127.458 2.303 . . . . 0.0 110.863 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.425 ' HA ' ' CE3' ' A' ' 112' ' ' TRP . 6.2 t -158.3 177.88 10.78 Favored 'General case' 0 C--N 1.376 1.75 0 O-C-N 119.418 -2.051 . . . . 0.0 111.945 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.29 84.1 tttt 153.64 -45.03 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.942 1 C-N-CA 133.599 4.76 . . . . 0.0 110.879 176.79 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 87.05 6.68 0.27 Allowed 'General case' 0 C--N 1.354 0.79 0 N-CA-C 121.303 3.816 . . . . 0.0 121.303 168.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 3.4 t -140.15 144.06 28.6 Favored 'Isoleucine or valine' 0 C--N 1.375 1.714 0 CA-C-N 122.452 2.387 . . . . 0.0 115.801 -177.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 153' ' ' GLN 0.396 0.1 OUTLIER -130.31 144.9 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.646 2 N-CA-C 122.548 4.277 . . . . 0.0 122.548 -177.38 . . . . . . . . 5 4 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' LYS . . . . . 0.489 ' H ' ' CD ' ' A' ' 151' ' ' LYS . 0.0 OUTLIER -94.16 149.55 21.13 Favored 'General case' 0 CA--C 1.48 -1.744 2 C-N-CA 146.004 9.722 . . . . 0.0 97.652 167.87 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 152' ' ' THR 0.322 11.3 t -76.1 96.14 3.78 Favored 'General case' 0 CA--C 1.575 1.93 3 CA-C-O 130.563 4.982 . . . . 0.0 122.666 -162.49 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' GLN . . . . . 0.421 ' HA ' HD13 ' A' ' 150' ' ' ILE 0.481 0.0 OUTLIER . . . . . 0 N--CA 1.381 -3.913 2 C-N-CA 136.099 5.759 . . . . 0.0 117.524 166.591 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.455 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 2.3 t-20 . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 117.743 2.497 . . . . 0.0 117.743 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -58.76 6.66 Favored 'General case' 0 N--CA 1.445 -0.715 1 C-N-CA 132.95 4.5 . . . . 0.0 112.274 169.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.84 -25.87 62.14 Favored 'General case' 0 C--N 1.37 1.469 0 C-N-CA 126.907 2.083 . . . . 0.0 113.065 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.455 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.9 OUTLIER -77.01 -39.52 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.947 0 C-N-CA 129.721 3.208 . . . . 0.0 112.551 176.698 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.431 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 27.3 t80 -65.36 -45.05 85.69 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 129.039 2.935 . . . . 0.0 109.611 175.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.3 -43.73 86.72 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 126.625 1.97 . . . . 0.0 110.99 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.651 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.257 9.2 ttp-105 -66.34 -47.32 73.84 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.547 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.431 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.8 mtm180 -61.17 -27.63 68.55 Favored 'General case' 0 C--N 1.377 1.762 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 167.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -77.12 -48.75 16.89 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 128.691 2.796 . . . . 0.0 110.139 173.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.606 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 27.6 mmtt -57.8 -28.44 64.02 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 127.529 2.331 . . . . 0.0 110.573 169.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 58' ' ' ILE . 0.3 OUTLIER -66.68 -49.07 67.31 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.519 166.271 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.416 ' HB2' HD11 ' A' ' 54' ' ' ILE . 39.2 ttt85 -55.81 -34.68 65.55 Favored 'General case' 0 C--N 1.353 0.742 0 CA-C-N 121.15 1.795 . . . . 0.0 115.21 169.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.606 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.289 0.1 OUTLIER -73.7 -37.04 65.31 Favored 'General case' 0 C--N 1.386 2.17 0 O-C-N 120.065 -1.647 . . . . 0.0 113.812 170.088 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.13 -44.27 97.59 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 129.063 2.945 . . . . 0.0 111.041 172.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.508 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -61.17 -52.59 64.18 Favored 'General case' 0 C--N 1.371 1.508 1 C-N-CA 132.003 4.121 . . . . 0.0 110.315 175.598 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -74.56 -39.53 62.22 Favored 'General case' 0 C--N 1.373 1.608 0 N-CA-C 118.218 2.673 . . . . 0.0 118.218 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -73.16 -40.52 64.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.024 1.73 . . . . 0.0 112.18 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.307 4.1 mp0 -75.95 -28.92 58.12 Favored 'General case' 0 C--N 1.355 0.812 0 O-C-N 118.637 -2.539 . . . . 0.0 110.41 171.961 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.339 0.3 OUTLIER -65.18 -31.21 72.27 Favored 'General case' 0 C--N 1.384 2.077 0 O-C-N 119.824 -1.797 . . . . 0.0 113.688 166.956 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.394 0.0 OUTLIER -66.36 -35.49 80.49 Favored 'General case' 0 C--N 1.382 2.02 0 CA-C-N 119.033 0.833 . . . . 0.0 111.8 166.604 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.519 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 47.2 tt0 -62.55 -45.02 94.85 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 169.29 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.488 HG12 ' CE1' ' A' ' 68' ' ' HIS . 3.1 mt -69.77 -43.48 79.88 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 O-C-N 120.617 -1.302 . . . . 0.0 113.06 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER -70.34 -26.49 63.77 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 119.379 0.991 . . . . 0.0 113.004 176.205 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -69.41 -39.78 77.72 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 121.109 -0.994 . . . . 0.0 110.166 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.401 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.492 0.0 OUTLIER -67.07 -35.01 78.9 Favored 'General case' 0 C--N 1.403 2.911 0 CA-C-N 120.405 1.457 . . . . 0.0 113.21 168.575 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.402 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.7 mt -61.92 -44.73 99.29 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 120.797 1.635 . . . . 0.0 114.702 174.286 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -59.96 -47.31 86.31 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 172.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -77.34 -37.45 52.41 Favored 'General case' 0 C--N 1.372 1.553 0 C-N-CA 125.165 1.386 . . . . 0.0 114.265 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.609 ' CB ' HG11 ' A' ' 74' ' ' VAL . . . -80.35 -34.01 36.87 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-O 121.638 0.732 . . . . 0.0 112.409 -178.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.6 t -71.35 -36.15 71.41 Favored 'General case' 0 C--N 1.365 1.245 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 42.2 mmtt -64.14 -42.42 96.8 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 167.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.38 -32.11 66.14 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 126.881 2.073 . . . . 0.0 113.936 176.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.32 -19.36 58.3 Favored 'General case' 0 C--N 1.375 1.692 0 C-N-CA 125.382 1.473 . . . . 0.0 111.94 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.03 17.7 31.5 Favored Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.272 0.869 . . . . 0.0 115.272 171.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.561 HG23 HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -123.76 147.18 28.24 Favored 'Isoleucine or valine' 0 C--N 1.358 0.974 0 CA-C-O 123.544 1.64 . . . . 0.0 108.998 -178.249 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.498 ' HB2' HD11 ' A' ' 81' ' ' LEU 0.277 10.0 t 5.8 -79.88 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.302 1 C-N-CA 132.715 4.406 . . . . 0.0 119.736 -173.777 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.0 m 121.71 124.27 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.689 2 N-CA-C 98.863 -4.495 . . . . 0.0 98.863 -169.243 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.454 ' CZ ' HG22 ' A' ' 77' ' ' VAL . 10.7 p90 -113.24 142.54 45.69 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -100.7 126.63 47.24 Favored 'General case' 0 C--N 1.361 1.103 0 C-N-CA 125.758 1.623 . . . . 0.0 108.039 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 HD22 ' A' ' 129' ' ' LEU . 0.1 OUTLIER -95.78 128.29 42.53 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.838 -173.856 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -139.34 143.97 38.03 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 101.994 -3.335 . . . . 0.0 101.994 177.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.533 ' CE1' HD13 ' A' ' 50' ' ' LEU . 2.4 p90 -131.09 154.39 48.33 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.61 118.79 28.51 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 127.26 2.224 . . . . 0.0 107.585 173.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.446 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.502 0.0 OUTLIER -68.39 -10.32 54.33 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 129.224 3.01 . . . . 0.0 116.936 -174.404 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.64 -41.29 27.3 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 128.09 2.556 . . . . 0.0 111.489 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 133' ' ' MET . 0.1 OUTLIER -59.42 -47.7 84.45 Favored 'General case' 0 C--N 1.375 1.675 0 CA-C-O 127.738 3.637 . . . . 0.0 109.102 170.777 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.533 HD13 ' CE1' ' A' ' 45' ' ' TYR 0.279 7.0 tt -74.11 -31.58 62.84 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-N 110.567 -3.015 . . . . 0.0 111.116 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -62.34 -34.33 76.44 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 125.821 1.648 . . . . 0.0 109.537 170.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -62.63 -47.86 81.91 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.53 -1.356 . . . . 0.0 113.232 167.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.48 -27.26 65.99 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 117.885 2.55 . . . . 0.0 117.885 171.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.499 HD12 ' CD2' ' A' ' 50' ' ' LEU 0.302 0.1 OUTLIER -73.68 -42.93 54.87 Favored 'Isoleucine or valine' 0 C--N 1.347 0.496 0 C-N-CA 129.52 3.128 . . . . 0.0 110.884 178.975 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -103.2 -26.83 12.84 Favored 'General case' 0 C--N 1.38 1.912 0 N-CA-C 117.079 2.251 . . . . 0.0 117.079 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -87.44 -29.14 21.66 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 119.456 -2.028 . . . . 0.0 111.426 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -124.97 44.05 2.88 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 128.392 2.677 . . . . 0.0 107.491 -172.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.651 HD11 ' HE ' ' A' ' 10' ' ' ARG 0.393 0.5 OUTLIER -56.19 134.32 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 C-N-CA 125.986 1.714 . . . . 0.0 112.419 -177.331 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.494 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 24.9 t70 57.54 21.21 6.85 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 130.822 3.649 . . . . 0.0 113.202 -173.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.463 0.7 OUTLIER -73.97 80.52 1.68 Allowed 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.863 2.865 . . . . 0.0 109.626 170.0 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.3 p -82.06 -26.59 33.56 Favored 'General case' 0 N--CA 1.437 -1.089 2 C-N-CA 141.404 7.882 . . . . 0.0 110.92 162.01 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.94 -33.32 71.75 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 128.008 2.523 . . . . 0.0 109.582 172.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.557 ' HA ' HD22 ' A' ' 111' ' ' LEU . 3.2 t -43.18 -57.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.993 1 C-N-CA 132.455 4.302 . . . . 0.0 111.572 165.195 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 47.8 m-85 -62.5 -36.74 83.5 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 131.452 3.901 . . . . 0.0 113.468 172.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -72.98 -45.29 58.82 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 126.259 1.823 . . . . 0.0 111.607 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.576 HD13 HD13 ' A' ' 70' ' ' ILE . 3.2 tm? -63.19 -38.44 91.17 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.559 1.544 . . . . 0.0 113.268 169.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.682 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.974 0.0 OUTLIER -78.27 -17.48 56.6 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 117.742 2.497 . . . . 0.0 117.742 170.739 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.519 ' CE1' ' HB3' ' A' ' 24' ' ' GLN . 25.4 m-70 -84.51 -19.13 33.74 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 129.014 2.926 . . . . 0.0 109.682 171.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.61 ' O ' HG21 ' A' ' 152' ' ' THR . 48.6 mmtm -93.74 -27.34 16.55 Favored 'General case' 0 C--N 1.364 1.223 0 C-N-CA 126.434 1.894 . . . . 0.0 107.895 168.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.682 ' HB ' ' HA ' ' A' ' 67' ' ' PHE 0.356 0.9 OUTLIER -74.98 -12.13 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 C-N-CA 129.787 3.235 . . . . 0.0 112.684 178.327 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HB2' ' CD ' ' A' ' 28' ' ' GLU 0.313 19.2 ptmt -49.49 -35.32 19.45 Favored 'General case' 0 N--CA 1.428 -1.542 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 -169.26 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.276 26.6 m-20 -78.77 -15.05 58.9 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 127.448 2.299 . . . . 0.0 108.565 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.716 ' CD2' ' HA ' ' A' ' 152' ' ' THR 0.373 0.0 OUTLIER -66.8 -7.08 18.82 Favored 'General case' 0 C--N 1.379 1.859 0 C-N-CA 129.173 2.989 . . . . 0.0 109.379 167.62 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.609 HG11 ' CB ' ' A' ' 32' ' ' ALA . 13.0 p -43.57 -38.66 1.18 Allowed 'Isoleucine or valine' 1 C--N 1.428 4.016 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 151.328 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 2.7 tm? -61.74 -36.49 81.13 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 129.941 3.296 . . . . 0.0 115.419 172.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.547 ' HA ' ' HG3' ' A' ' 79' ' ' GLU . 71.1 mm-40 -75.26 -38.82 60.32 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 120.211 -1.555 . . . . 0.0 111.442 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.454 HG22 ' CZ ' ' A' ' 41' ' ' PHE 0.415 0.1 OUTLIER -71.47 -29.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 CA-C-O 124.472 2.082 . . . . 0.0 112.203 171.89 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.502 ' HA ' HD22 ' A' ' 78' ' ' ASN . 0.9 OUTLIER -70.01 -46.79 64.37 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 127.706 2.402 . . . . 0.0 116.782 168.407 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.333 0.8 OUTLIER -66.94 -29.51 69.4 Favored 'General case' 0 C--N 1.371 1.517 0 C-N-CA 127.332 2.253 . . . . 0.0 110.288 176.785 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -60.31 -45.66 92.61 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.02 2.528 . . . . 0.0 112.07 163.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.561 HD13 HG23 ' A' ' 38' ' ' VAL . 3.3 tt . . . . . 0 N--CA 1.502 2.152 0 CA-C-N 122.524 2.42 . . . . 0.0 115.546 168.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.502 0 N-CA-C 117.345 1.698 . . . . 0.0 117.345 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 ptt85 -140.99 160.04 40.93 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 123.194 1.473 . . . . 0.0 110.163 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.4 131.68 54.84 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 127.375 2.27 . . . . 0.0 104.992 177.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -128.53 116.43 19.65 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 -174.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.687 HD12 ' CE1' ' A' ' 73' ' ' HIS . 28.9 mm -122.33 130.15 74.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.009 1.324 . . . . 0.0 109.5 -172.267 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . 0.436 10.5 t -139.5 150.84 45.61 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 117.088 -3.508 . . . . 0.0 112.396 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.618 ' HB2' ' HB2' ' A' ' 151' ' ' LYS . 0.3 OUTLIER 173.76 164.75 0.18 Allowed 'General case' 0 C--N 1.362 1.129 0 N-CA-C 103.459 -2.793 . . . . 0.0 103.459 162.905 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' A' ' 110' ' ' ASN . . . 43.39 45.97 6.75 Favored Glycine 0 CA--C 1.454 -3.751 0 C-N-CA 129.547 3.451 . . . . 0.0 120.097 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 3.4 m-80 88.43 -9.66 0.49 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 130.057 3.343 . . . . 0.0 114.292 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.557 HD22 ' HA ' ' A' ' 63' ' ' VAL . 18.2 tp -102.19 133.52 46.91 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 126.87 2.068 . . . . 0.0 114.819 -177.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -111.78 100.07 8.64 Favored 'General case' 0 C--N 1.366 1.307 0 N-CA-C 101.256 -3.609 . . . . 0.0 101.256 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.486 HD21 HG21 ' A' ' 70' ' ' ILE 0.252 0.0 OUTLIER -115.36 119.85 37.64 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 119.83 -1.793 . . . . 0.0 106.578 -178.765 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -124.49 154.7 18.03 Favored Glycine 0 C--N 1.355 1.602 0 O-C-N 117.299 -3.376 . . . . 0.0 109.226 -174.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -132.44 134.11 44.68 Favored 'General case' 0 C--N 1.368 1.377 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 35.8 m -124.73 135.83 53.34 Favored 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 103.165 -2.902 . . . . 0.0 103.165 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 53.3 t -54.82 159.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 C-N-CA 129.167 2.987 . . . . 0.0 112.158 173.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 130' ' ' GLN 0.335 91.5 m -64.01 98.65 0.22 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 116.918 -1.913 . . . . 0.0 113.183 167.718 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -64.16 -36.67 20.9 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -175.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -85.14 72.71 4.47 Favored 'Trans proline' 0 CA--C 1.56 1.814 0 CA-C-N 126.005 3.18 . . . . 0.0 112.598 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.426 8.7 p30 -163.43 -136.6 0.03 OUTLIER 'General case' 0 C--N 1.377 1.796 0 N-CA-C 116.697 2.11 . . . . 0.0 116.697 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -95.84 -27.2 15.32 Favored 'General case' 0 C--N 1.376 1.732 0 C-N-CA 131.003 3.721 . . . . 0.0 113.919 174.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.452 0.0 OUTLIER 56.72 71.54 0.56 Allowed 'General case' 0 N--CA 1.423 -1.796 1 C-N-CA 134.745 5.218 . . . . 0.0 115.191 -176.243 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -63.52 52.5 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 130.116 3.367 . . . . 0.0 116.098 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.467 4.7 mptt 82.03 -68.38 0.08 Allowed 'General case' 0 N--CA 1.438 -1.045 1 C-N-CA 131.719 4.007 . . . . 0.0 110.498 176.977 . . . . . . . . 3 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -172.3 82.6 0.45 Allowed Pre-proline 0 C--N 1.353 0.739 0 CA-C-O 115.779 -2.057 . . . . 0.0 111.314 168.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.403 ' HA ' ' HB3' ' A' ' 41' ' ' PHE . 1.6 Cg_endo -123.85 16.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.369 1.612 0 CA-C-N 127.056 3.556 . . . . 0.0 118.848 177.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.319 4.2 p -147.71 159.2 44.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 111.959 -2.382 . . . . 0.0 109.063 162.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.428 HD22 HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -116.3 140.72 49.03 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 103.405 -2.813 . . . . 0.0 103.405 168.094 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.443 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 49.9 tp60 -130.41 72.02 1.48 Allowed 'General case' 0 C--N 1.361 1.082 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' CYS . . . . . 0.537 ' SG ' HD22 ' A' ' 49' ' ' LEU . 49.4 t 128.99 115.73 0.0 OUTLIER 'General case' 0 C--N 1.362 1.13 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 -174.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.553 ' O ' HD21 ' A' ' 49' ' ' LEU . 8.1 mmm180 -115.81 108.98 17.01 Favored 'General case' 0 N--CA 1.446 -0.672 1 N-CA-C 99.707 -4.183 . . . . 0.0 99.707 164.038 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.709 ' HA ' HD11 ' A' ' 49' ' ' LEU . 3.4 ttp -92.69 108.91 20.35 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 128.284 2.634 . . . . 0.0 109.15 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.482 ' O ' HD13 ' A' ' 135' ' ' ILE . . . -116.9 113.98 23.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ILE . . . . . 0.482 HD13 ' O ' ' A' ' 134' ' ' ALA . 47.3 mm -145.16 132.61 15.93 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.482 HD12 HD13 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -117.08 -175.83 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-O 125.326 2.488 . . . . 0.0 108.882 -174.379 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.317 0.4 OUTLIER -134.42 132.41 39.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 108.955 -3.748 . . . . 0.0 106.713 160.772 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.672 ' HB2' ' HB2' ' A' ' 141' ' ' LEU 0.286 25.2 m -145.01 -119.85 0.08 Allowed 'General case' 0 N--CA 1.485 1.288 0 O-C-N 118.615 -2.553 . . . . 0.0 116.942 -174.998 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.741 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.1 OUTLIER -108.57 -75.66 0.63 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 130.879 3.672 . . . . 0.0 110.71 -167.852 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.741 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 14.5 ptp180 -79.66 -9.33 59.62 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 130.704 3.601 . . . . 0.0 111.685 170.158 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.672 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.415 -2.179 0 CA-C-N 112.744 -2.026 . . . . 0.0 116.445 -159.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.817 HD13 ' O ' ' A' ' 151' ' ' LYS 0.409 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.919 0 N-CA-C 120.82 3.637 . . . . 0.0 120.82 . . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.817 ' O ' HD13 ' A' ' 150' ' ' ILE 0.515 4.5 tptp -71.13 160.79 32.23 Favored 'General case' 0 CA--C 1.461 -2.463 1 C-N-CA 153.109 12.563 . . . . 0.0 103.913 -175.689 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.716 ' HA ' ' CD2' ' A' ' 73' ' ' HIS 0.398 9.8 t -71.44 97.23 1.6 Allowed 'General case' 0 CA--C 1.571 1.766 1 CA-C-O 130.546 4.974 . . . . 0.0 121.11 -173.12 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.686 2 CA-C-N 100.419 -7.628 . . . . 0.0 112.741 162.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.451 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 5.5 t-20 . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.61 -62.74 1.27 Allowed 'General case' 0 C--N 1.352 0.698 1 C-N-CA 133.866 4.867 . . . . 0.0 112.395 172.968 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -72.92 -20.04 61.15 Favored 'General case' 0 C--N 1.374 1.668 0 O-C-N 120.146 -1.596 . . . . 0.0 112.847 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.451 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.3 m -76.27 -34.81 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 129.789 3.235 . . . . 0.0 111.215 173.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -66.99 -41.56 86.55 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 127.769 2.428 . . . . 0.0 108.513 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.7 mt -59.29 -43.91 91.0 Favored 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 124.538 1.135 . . . . 0.0 112.862 167.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.268 77.0 mtp85 -63.45 -49.11 74.94 Favored 'General case' 0 C--N 1.373 1.606 0 O-C-N 120.236 -1.54 . . . . 0.0 115.033 170.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -60.29 -27.31 67.19 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 171.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -76.99 -50.67 12.64 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 127.856 2.462 . . . . 0.0 110.678 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -57.3 -29.08 63.6 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 127.623 2.369 . . . . 0.0 110.856 171.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.485 HD22 ' C ' ' A' ' 58' ' ' ILE . 12.0 tp -68.5 -49.09 62.28 Favored 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 125.637 1.575 . . . . 0.0 112.295 168.069 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -55.34 -39.21 69.73 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.353 -1.467 . . . . 0.0 112.213 172.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 64.8 mmt-85 -62.4 -48.71 78.52 Favored 'General case' 0 C--N 1.372 1.575 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 163.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.498 ' HB3' HG22 ' A' ' 61' ' ' THR . 48.1 m80 -56.35 -46.49 79.95 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 129.644 3.178 . . . . 0.0 111.577 174.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.524 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.43 -53.05 62.57 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 131.472 3.909 . . . . 0.0 111.011 173.565 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -74.33 -43.98 54.37 Favored 'General case' 0 C--N 1.377 1.79 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 t -66.98 -38.03 85.31 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.515 2.326 . . . . 0.0 112.231 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.583 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.34 41.7 mt-10 -76.91 -29.17 55.58 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 125.369 1.468 . . . . 0.0 112.145 170.525 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -33.97 72.88 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 121.415 1.916 . . . . 0.0 113.037 167.054 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -66.38 -44.69 82.42 Favored 'General case' 0 C--N 1.377 1.797 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.894 164.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -57.69 -40.25 79.04 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.805 2.15 . . . . 0.0 116.805 170.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.462 HD11 ' CD1' ' A' ' 64' ' ' PHE . 1.0 OUTLIER -69.24 -45.64 78.96 Favored 'Isoleucine or valine' 0 C--N 1.366 1.317 0 C-N-CA 125.683 1.593 . . . . 0.0 111.106 178.043 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.758 0.0 OUTLIER -73.54 -23.26 59.96 Favored 'General case' 0 C--N 1.369 1.452 0 O-C-N 121.296 -0.878 . . . . 0.0 112.929 177.129 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.53 -41.15 66.17 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.945 1.698 . . . . 0.0 111.592 168.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.587 0.8 OUTLIER -63.65 -29.32 70.57 Favored 'General case' 0 C--N 1.403 2.908 0 O-C-N 119.507 -1.996 . . . . 0.0 113.426 169.875 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.497 ' HA ' HG21 ' A' ' 74' ' ' VAL . 7.2 mt -68.78 -50.5 54.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.416 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 166.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.1 mtm180 -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 121.152 1.796 . . . . 0.0 114.743 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.21 -45.23 27.23 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 125.228 1.411 . . . . 0.0 111.417 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.446 ' HB3' HG11 ' A' ' 74' ' ' VAL . . . -75.53 -31.91 60.27 Favored 'General case' 0 C--N 1.359 1.019 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -178.056 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.4 t -78.71 -34.18 46.21 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 127.138 2.175 . . . . 0.0 108.847 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -72.42 -43.25 64.13 Favored 'General case' 0 C--N 1.384 2.076 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 165.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.42 73.14 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 126.399 1.879 . . . . 0.0 114.601 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.28 -16.86 60.92 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 119.082 0.855 . . . . 0.0 112.495 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.83 17.75 40.08 Favored Glycine 0 C--N 1.376 2.764 0 C-N-CA 124.413 1.006 . . . . 0.0 114.12 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.649 HG21 ' HB3' ' A' ' 78' ' ' ASN . 2.3 t -102.16 179.76 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.239 0 C-N-CA 128.113 2.565 . . . . 0.0 111.106 -172.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.592 ' H ' HG12 ' A' ' 38' ' ' VAL 0.397 3.1 t -75.09 -144.93 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.436 2.294 . . . . 0.0 113.834 178.927 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.2 m -150.6 157.66 43.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 119.122 -2.236 . . . . 0.0 107.588 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.491 ' CE1' HD13 ' A' ' 29' ' ' ILE . 19.9 p90 -128.63 154.64 46.04 Favored 'General case' 0 C--N 1.349 0.554 0 C-N-CA 124.559 1.144 . . . . 0.0 109.727 -177.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -100.92 114.62 28.66 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 101.847 -3.39 . . . . 0.0 101.847 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.345 0.0 OUTLIER -115.4 128.75 56.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.256 -1.528 . . . . 0.0 107.572 -170.713 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -130.83 146.04 52.16 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 121.076 -1.015 . . . . 0.0 109.295 -178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.498 ' CE1' HD13 ' A' ' 50' ' ' LEU . 21.0 p90 -99.97 159.3 15.19 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 124.983 1.313 . . . . 0.0 110.588 177.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.1 p -108.72 118.83 37.81 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 124.46 1.104 . . . . 0.0 108.562 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.468 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.439 0.0 OUTLIER -74.8 -10.8 59.85 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 119.458 3.133 . . . . 0.0 119.458 -170.435 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.74 -48.6 24.84 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 122.161 2.255 . . . . 0.0 113.049 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.585 HD13 ' HA ' ' A' ' 133' ' ' MET . 3.7 pp -67.14 -31.46 71.91 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 128.726 2.811 . . . . 0.0 112.93 173.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.53 ' CD2' HD12 ' A' ' 54' ' ' ILE 0.306 6.2 tt -75.56 -42.72 51.52 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 128.593 2.757 . . . . 0.0 109.848 173.408 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.54 -30.32 67.01 Favored 'General case' 0 C--N 1.378 1.831 0 C-N-CA 128.471 2.708 . . . . 0.0 111.246 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -77.96 -41.32 36.53 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 119.87 -1.769 . . . . 0.0 114.508 164.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.44 -34.36 78.11 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.53 HD12 ' CD2' ' A' ' 50' ' ' LEU . 4.0 tt -66.73 -39.02 82.73 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 C-N-CA 130.421 3.489 . . . . 0.0 112.793 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -104.56 -23.79 13.08 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 174.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.77 -22.71 39.9 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 119.023 -2.298 . . . . 0.0 112.894 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.544 ' HB3' ' HB3' ' A' ' 60' ' ' GLU . 3.1 mm-40 -127.91 14.37 6.86 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -177.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.485 ' C ' HD22 ' A' ' 14' ' ' LEU 0.478 0.3 OUTLIER 20.64 -28.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.985 2 C-N-CA 136.678 5.991 . . . . 0.0 126.621 177.628 . . . . . . . . 5 4 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -155.3 64.68 0.62 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.564 ' O ' HG12 ' A' ' 63' ' ' VAL 0.452 6.7 pt-20 -87.44 61.93 6.87 Favored 'General case' 0 CA--C 1.469 -2.143 0 CA-C-O 125.53 2.586 . . . . 0.0 110.71 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.498 HG22 ' HB3' ' A' ' 17' ' ' HIS 0.319 59.6 p -78.96 -11.79 60.02 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 129.154 2.982 . . . . 0.0 112.492 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -65.68 -34.29 77.86 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 130.464 3.506 . . . . 0.0 111.185 164.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.564 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -66.89 -38.04 80.63 Favored 'Isoleucine or valine' 0 C--N 1.359 1.005 0 C-N-CA 126.363 1.865 . . . . 0.0 110.582 -174.505 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 37.6 m-85 -66.52 -46.66 75.45 Favored 'General case' 0 CA--C 1.47 -2.125 1 C-N-CA 133.224 4.61 . . . . 0.0 111.396 169.677 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -60.46 -38.28 83.7 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.815 1.643 . . . . 0.0 114.875 176.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 1.015 HD12 HD12 ' A' ' 111' ' ' LEU . 2.1 tm? -75.24 -47.98 25.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.97 3.308 . . . . 0.0 114.414 173.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.429 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.623 0.0 OUTLIER -77.31 -17.68 58.11 Favored 'General case' 0 C--N 1.377 1.763 0 O-C-N 118.304 -2.748 . . . . 0.0 112.001 174.278 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.459 ' NE2' HG12 ' A' ' 25' ' ' ILE . 27.6 m170 -67.91 -38.11 82.52 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 127.288 2.235 . . . . 0.0 109.516 162.216 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.493 8.9 mttt -77.22 -16.7 58.94 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 122.135 2.243 . . . . 0.0 112.968 168.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.771 HD12 ' HE2' ' A' ' 151' ' ' LYS 0.331 0.8 OUTLIER -71.75 -40.03 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 C-N-CA 126.044 1.738 . . . . 0.0 113.47 172.914 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.517 ' O ' HG23 ' A' ' 74' ' ' VAL 0.866 11.5 mptt -67.44 -2.4 6.29 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 131.013 3.725 . . . . 0.0 118.683 176.06 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -87.43 -16.52 34.63 Favored 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 167.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.768 ' CD2' ' HG3' ' A' ' 151' ' ' LYS 0.288 3.0 m-70 -90.65 10.25 26.49 Favored 'General case' 0 C--N 1.379 1.873 0 C-N-CA 129.768 3.227 . . . . 0.0 111.103 174.268 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 71' ' ' LYS 0.29 24.4 t -41.14 -40.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.414 3.396 0 C-N-CA 130.334 3.454 . . . . 0.0 111.096 160.969 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.64 -37.95 74.19 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.633 3.173 . . . . 0.0 115.565 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -75.58 -38.24 59.27 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 128.47 2.708 . . . . 0.0 109.904 172.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.385 1.9 m -69.99 -30.42 44.03 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 CA-C-O 124.188 1.946 . . . . 0.0 113.856 173.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.649 ' HB3' HG21 ' A' ' 38' ' ' VAL . 3.7 m120 -73.81 -34.11 64.47 Favored 'General case' 0 C--N 1.345 0.382 1 C-N-CA 132.45 4.3 . . . . 0.0 111.865 172.397 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -67.41 -30.46 70.23 Favored 'General case' 0 C--N 1.367 1.327 0 C-N-CA 125.957 1.703 . . . . 0.0 111.067 165.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.566 13.4 p90 -75.11 -29.92 60.71 Favored 'General case' 0 C--N 1.379 1.864 0 N-CA-C 116.264 1.95 . . . . 0.0 116.264 162.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.442 ' O ' HD12 ' A' ' 81' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.368 1.4 0 C-N-CA 128.05 2.54 . . . . 0.0 114.531 174.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.4 ' HA3' HG22 ' A' ' 117' ' ' VAL . . . . . . . . 0 N--CA 1.465 0.612 1 N-CA-C 124.371 4.508 . . . . 0.0 124.371 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -129.97 138.53 50.89 Favored 'General case' 0 N--CA 1.431 -1.423 1 N-CA-C 98.2 -4.741 . . . . 0.0 98.2 167.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.41 144.61 49.96 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -129.46 130.29 45.7 Favored 'General case' 0 C--N 1.361 1.108 0 N-CA-C 105.596 -2.001 . . . . 0.0 105.596 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.807 HG23 HD12 ' A' ' 150' ' ' ILE . 1.0 OUTLIER -126.01 137.11 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 175.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.469 ' O ' HG22 ' A' ' 150' ' ' ILE . 1.0 OUTLIER -136.49 107.35 6.64 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 172.984 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.615 ' N ' HE21 ' A' ' 153' ' ' GLN . 0.4 OUTLIER -162.98 -117.76 0.01 OUTLIER 'General case' 0 CA--C 1.448 -2.97 0 N-CA-C 103.131 -2.914 . . . . 0.0 103.131 -178.429 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.569 ' H ' ' HG3' ' A' ' 153' ' ' GLN . . . -52.04 75.4 0.01 OUTLIER Glycine 0 C--N 1.384 3.231 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -160.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.623 ' O ' HG22 ' A' ' 136' ' ' ILE . 1.1 m-80 63.13 7.35 2.72 Favored 'General case' 0 C--N 1.369 1.437 1 C-N-CA 132.358 4.263 . . . . 0.0 113.192 179.063 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 1.015 HD12 HD12 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -117.32 133.12 56.35 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 129.987 3.315 . . . . 0.0 112.683 -160.132 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -111.4 98.54 7.55 Favored 'General case' 0 C--N 1.363 1.163 1 N-CA-C 98.979 -4.452 . . . . 0.0 98.979 174.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.638 HD23 HD13 ' A' ' 111' ' ' LEU 0.287 0.8 OUTLIER -115.91 121.11 41.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.453 1.501 . . . . 0.0 107.205 -167.623 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.25 132.1 7.22 Favored Glycine 0 C--N 1.364 2.117 0 O-C-N 119.938 -1.726 . . . . 0.0 109.605 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 152.85 50.56 Favored 'General case' 0 C--N 1.372 1.548 0 CA-C-N 120.848 2.324 . . . . 0.0 107.744 174.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 m -130.1 142.17 50.63 Favored 'General case' 0 C--N 1.371 1.506 0 C-N-CA 125.797 1.639 . . . . 0.0 106.709 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.4 HG22 ' HA3' ' A' ' 102' ' ' GLY . 12.5 m -77.47 179.18 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.999 0 C-N-CA 125.566 1.546 . . . . 0.0 110.289 169.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.526 ' HA ' ' HG3' ' A' ' 130' ' ' GLN 0.267 0.5 OUTLIER -56.66 92.56 0.01 OUTLIER 'General case' 0 C--N 1.359 1.014 0 CA-C-O 124.194 1.949 . . . . 0.0 115.698 168.029 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.354 9.1 pttp -71.6 -40.21 8.32 Favored Pre-proline 0 C--N 1.345 0.383 1 C-N-CA 133.09 4.556 . . . . 0.0 114.028 -178.711 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -75.74 60.3 5.92 Favored 'Trans proline' 0 CA--C 1.568 2.176 0 C-N-CA 124.29 3.327 . . . . 0.0 108.205 160.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.561 0.6 OUTLIER 2.3 -3.24 0.0 OUTLIER 'General case' 0 C--N 1.354 0.764 2 N-CA-C 129.217 6.747 . . . . 0.0 129.217 -168.178 . . . . . . . . 4 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 56.38 -16.21 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.984 1 N-CA-C 123.224 4.528 . . . . 0.0 123.224 167.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.371 10.0 mptt 72.19 18.66 4.7 Favored 'General case' 0 N--CA 1.421 -1.877 1 C-N-CA 134.821 5.248 . . . . 0.0 114.03 177.58 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -145.71 177.78 8.64 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 128.373 2.669 . . . . 0.0 107.36 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.422 ' H ' ' HE3' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -63.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.354 0.771 1 C-N-CA 132.14 4.176 . . . . 0.0 118.838 -170.466 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -109.8 -4.4 0.11 Allowed Pre-proline 0 N--CA 1.446 -0.636 1 CA-C-O 111.538 -4.077 . . . . 0.0 115.874 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.258 31.1 Cg_exo -69.0 23.61 0.15 Allowed 'Trans proline' 0 C--N 1.371 1.719 2 CA-C-N 133.963 6.022 . . . . 0.0 124.665 -166.898 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.292 19.3 m -145.41 149.55 34.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 C-N-CA 124.514 1.125 . . . . 0.0 108.916 158.123 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.25 130.42 55.94 Favored 'General case' 0 C--N 1.36 1.026 1 N-CA-C 98.903 -4.48 . . . . 0.0 98.903 159.675 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.526 ' HG3' ' HA ' ' A' ' 118' ' ' CYS . 9.8 mm100 -125.08 71.99 1.22 Allowed 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -164.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.262 64.0 m 98.15 106.57 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 125.059 1.475 . . . . 0.0 110.405 178.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -115.32 140.78 48.82 Favored 'General case' 0 C--N 1.359 1.002 0 CA-C-N 113.983 -1.462 . . . . 0.0 110.423 171.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.585 ' HA ' HD13 ' A' ' 49' ' ' LEU . 10.1 ttt -107.38 123.51 48.47 Favored 'General case' 0 N--CA 1.436 -1.144 1 C-N-CA 133.815 4.846 . . . . 0.0 110.002 178.566 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.66 114.76 17.06 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 169.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.7 mm -136.7 135.16 48.82 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.623 HG22 ' O ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -112.35 176.46 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.662 0 CA-C-O 124.423 2.058 . . . . 0.0 107.759 -177.389 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -72.19 103.87 3.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 130.242 3.417 . . . . 0.0 106.024 161.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.42 87.3 p -74.73 77.46 2.06 Favored 'General case' 0 C--N 1.357 0.892 0 N-CA-C 116.155 1.909 . . . . 0.0 116.155 -171.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -79.97 -57.67 3.53 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.31 167.796 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 139' ' ' ARG 0.293 32.7 mtt180 109.56 66.16 0.0 OUTLIER 'General case' 0 C--N 1.365 1.272 1 C-N-CA 143.299 8.64 . . . . 0.0 102.788 -173.741 . . . . . . . . 4 3 . 1 . 002 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.469 HD21 HG21 ' A' ' 136' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.355 0.836 1 N-CA-C 126.158 5.614 . . . . 0.0 126.158 -145.13 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 1.05 HD13 ' HB3' ' A' ' 151' ' ' LYS 0.442 0.3 OUTLIER . . . . . 0 N--CA 1.417 -2.077 0 CA-C-O 122.913 1.34 . . . . 0.0 111.156 . . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 1.05 ' HB3' HD13 ' A' ' 150' ' ' ILE 0.564 0.0 OUTLIER -71.48 147.18 48.06 Favored 'General case' 0 CA--C 1.502 -0.899 1 C-N-CA 140.219 7.408 . . . . 0.0 105.498 -177.464 . . . . . . . . 5 4 . 1 . 002 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.627 ' O ' HG23 ' A' ' 152' ' ' THR 0.473 12.4 t -78.31 93.03 4.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 128.318 3.913 . . . . 0.0 117.882 -163.198 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.615 HE21 ' N ' ' A' ' 108' ' ' ASP 0.251 5.4 pt20 . . . . . 0 N--CA 1.418 -2.026 0 N-CA-C 102.122 -3.288 . . . . 0.0 102.122 177.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.45 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.442 -0.851 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -61.17 2.23 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 130.151 3.381 . . . . 0.0 114.764 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -75.6 -19.58 59.15 Favored 'General case' 0 C--N 1.376 1.734 0 CA-C-O 122.192 0.996 . . . . 0.0 112.227 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.45 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -74.32 -37.25 44.92 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 C-N-CA 129.912 3.285 . . . . 0.0 111.578 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.61 -44.26 82.57 Favored 'General case' 0 C--N 1.373 1.615 0 C-N-CA 128.731 2.812 . . . . 0.0 108.576 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.43 -43.52 77.91 Favored 'Isoleucine or valine' 0 C--N 1.368 1.381 0 C-N-CA 125.1 1.36 . . . . 0.0 112.847 167.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HB3' HD13 ' A' ' 58' ' ' ILE 0.27 0.9 OUTLIER -62.73 -50.86 69.41 Favored 'General case' 0 CA--C 1.564 1.507 0 C-N-CA 126.39 1.876 . . . . 0.0 115.123 173.184 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.41 ' HE ' HE22 ' A' ' 55' ' ' GLN . 32.6 mtp180 -59.29 -27.63 66.02 Favored 'General case' 0 C--N 1.372 1.546 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 163.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -77.08 -47.76 19.64 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 128.676 2.79 . . . . 0.0 110.563 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.54 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 9.5 mmpt? -58.77 -29.63 66.94 Favored 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.161 2.184 . . . . 0.0 109.571 169.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.683 HD13 HG13 ' A' ' 54' ' ' ILE . 0.4 OUTLIER -67.07 -44.49 79.96 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 163.145 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 -60.87 -32.6 72.03 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 122.726 2.512 . . . . 0.0 113.837 171.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.54 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.29 0.5 OUTLIER -72.07 -38.46 69.44 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.498 -1.376 . . . . 0.0 112.289 171.728 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -65.23 -46.14 81.8 Favored 'General case' 0 C--N 1.386 2.154 0 C-N-CA 128.316 2.646 . . . . 0.0 111.06 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.607 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -63.2 -51.1 67.67 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 129.964 3.306 . . . . 0.0 112.201 -177.891 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -74.31 -42.96 58.64 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 126.983 2.113 . . . . 0.0 115.905 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.7 m -64.93 -42.88 94.28 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 124.428 2.061 . . . . 0.0 112.068 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.563 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.279 41.2 mt-10 -76.41 -29.79 57.2 Favored 'General case' 0 N--CA 1.439 -1.023 0 O-C-N 120.135 -1.603 . . . . 0.0 112.495 172.879 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -59.55 -31.39 69.38 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 122.348 2.34 . . . . 0.0 112.471 166.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -63.0 -46.26 88.5 Favored 'General case' 0 C--N 1.385 2.116 0 C-N-CA 124.585 1.154 . . . . 0.0 111.126 163.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 43.8 tt0 -56.08 -43.24 77.8 Favored 'General case' 0 C--N 1.371 1.53 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 169.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.7 mt -68.57 -45.79 81.12 Favored 'Isoleucine or valine' 0 C--N 1.357 0.93 0 C-N-CA 125.519 1.528 . . . . 0.0 113.888 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.726 0.1 OUTLIER -73.45 -22.93 60.06 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 174.46 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -67.73 -47.19 70.03 Favored 'General case' 0 C--N 1.377 1.78 0 CA-C-O 116.989 -1.482 . . . . 0.0 112.457 168.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG2' ' CD ' ' A' ' 71' ' ' LYS 0.774 0.2 OUTLIER -69.77 -30.54 68.14 Favored 'General case' 0 C--N 1.406 3.028 0 CA-C-N 124.259 3.209 . . . . 0.0 113.92 171.739 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.47 -37.15 79.35 Favored 'Isoleucine or valine' 0 C--N 1.372 1.578 0 CA-C-N 121.85 2.114 . . . . 0.0 115.274 170.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 ttt-85 -70.59 -38.08 73.98 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 118.745 -2.472 . . . . 0.0 114.241 175.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -76.3 -41.2 49.43 Favored 'General case' 0 CA--C 1.485 -1.53 0 C-N-CA 126.493 1.917 . . . . 0.0 111.732 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.0 -32.09 45.01 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.369 11.3 p -78.51 -27.98 46.2 Favored 'General case' 0 C--N 1.359 0.987 0 O-C-N 120.823 -1.173 . . . . 0.0 110.125 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -71.36 -52.1 20.55 Favored 'General case' 0 C--N 1.371 1.522 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 158.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.03 -30.16 71.25 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.88 -11.97 60.01 Favored 'General case' 0 C--N 1.375 1.685 0 O-C-N 120.901 -1.124 . . . . 0.0 111.591 170.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.85 17.18 62.0 Favored Glycine 0 C--N 1.383 3.189 0 O-C-N 121.016 -1.052 . . . . 0.0 115.056 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.67 HG22 ' H ' ' A' ' 39' ' ' SER . 7.9 p -96.58 178.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.36 0 CA-C-O 125.035 2.35 . . . . 0.0 112.754 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.67 ' H ' HG22 ' A' ' 38' ' ' VAL . 41.9 t -23.88 -69.11 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 1 C-N-CA 136.859 6.064 . . . . 0.0 117.522 178.188 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.256 90.9 p 102.57 142.39 0.01 OUTLIER 'General case' 0 C--N 1.357 0.903 0 C-N-CA 131.007 3.723 . . . . 0.0 104.238 -166.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . 0.266 50.4 p90 -141.53 161.9 36.8 Favored 'General case' 0 C--N 1.345 0.399 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -111.12 149.58 30.65 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.847 1.659 . . . . 0.0 112.863 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.353 1.7 pp -126.84 158.38 36.82 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 119.44 -2.038 . . . . 0.0 112.861 167.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -140.41 150.25 43.63 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.347 3.059 . . . . 0.0 103.196 172.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.467 ' CD1' HD13 ' A' ' 50' ' ' LEU . 4.0 p90 -125.2 134.08 52.5 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 105.72 -1.956 . . . . 0.0 105.72 170.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.3 m -105.18 128.16 53.27 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 120.99 -1.069 . . . . 0.0 108.516 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.597 0.7 OUTLIER -73.68 -10.54 59.8 Favored 'General case' 0 C--N 1.363 1.187 1 N-CA-C 122.541 4.274 . . . . 0.0 122.541 -169.921 . . . . . . . . 5 4 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.27 -45.3 60.7 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 122.966 2.621 . . . . 0.0 111.762 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.0 tp -53.78 -48.61 69.62 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 131.138 3.775 . . . . 0.0 111.977 166.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.607 HD11 ' CE1' ' A' ' 18' ' ' PHE . 8.3 tt -74.83 -28.65 60.78 Favored 'General case' 0 CA--C 1.487 -1.444 0 C-N-CA 125.837 1.655 . . . . 0.0 112.708 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.515 ' HA ' HG22 ' A' ' 54' ' ' ILE . 16.3 t70 -66.72 -30.64 70.92 Favored 'General case' 0 C--N 1.365 1.239 0 CA-C-N 120.177 1.353 . . . . 0.0 108.729 169.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -73.82 -28.69 61.75 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 167.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.82 -50.18 25.74 Favored 'General case' 0 C--O 1.207 -1.179 0 O-C-N 119.979 -1.7 . . . . 0.0 113.373 165.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.683 HG13 HD13 ' A' ' 14' ' ' LEU 0.282 0.3 OUTLIER -50.95 -43.35 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 1 C-N-CA 132.939 4.496 . . . . 0.0 113.884 -177.297 . . . . . . . . 5 4 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.41 HE22 ' HE ' ' A' ' 11' ' ' ARG 0.26 16.5 mm-40 -84.18 -31.67 25.01 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 171.828 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -99.53 39.1 1.34 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 124.201 1.953 . . . . 0.0 109.456 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . 0.295 2.7 pt-20 -160.71 -52.07 0.05 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 127.946 2.498 . . . . 0.0 110.395 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.605 ' HA ' HD12 ' A' ' 14' ' ' LEU 0.64 0.1 OUTLIER 19.83 108.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.524 3.241 0 C-N-CA 131.518 3.927 . . . . 0.0 113.249 -169.171 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.422 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 69.1 m-20 53.23 44.3 30.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 131.59 3.956 . . . . 0.0 112.089 -173.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.663 ' O ' HG12 ' A' ' 63' ' ' VAL 0.652 3.8 tp10 -78.29 79.64 4.72 Favored 'General case' 0 C--N 1.372 1.577 0 CA-C-O 127.22 3.391 . . . . 0.0 110.666 175.024 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.313 62.2 p -78.23 -15.87 58.38 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 127.616 2.366 . . . . 0.0 112.569 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -67.59 -33.29 74.7 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 129.859 3.264 . . . . 0.0 109.33 165.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -58.57 -44.33 89.15 Favored 'Isoleucine or valine' 0 C--N 1.372 1.551 0 C-N-CA 128.978 2.911 . . . . 0.0 110.332 179.892 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.563 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 41.1 m-85 -64.98 -45.46 85.54 Favored 'General case' 0 CA--C 1.488 -1.434 1 C-N-CA 133.332 4.653 . . . . 0.0 111.229 170.612 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.39 -34.17 77.15 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-N 122.408 2.367 . . . . 0.0 114.187 178.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.961 HD12 HD23 ' A' ' 111' ' ' LEU . 2.9 tm? -76.35 -45.39 32.3 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 127.43 2.292 . . . . 0.0 116.522 168.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.47 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.87 0.1 OUTLIER -75.49 -16.36 60.31 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 122.334 2.333 . . . . 0.0 113.514 176.526 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.415 ' CE1' ' HB3' ' A' ' 24' ' ' GLN 0.253 24.9 m-70 -76.81 -36.34 56.99 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 128.669 2.788 . . . . 0.0 110.296 161.637 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -73.88 -18.17 60.95 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 122.335 2.334 . . . . 0.0 114.569 169.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.482 HG21 HH22 ' A' ' 132' ' ' ARG . 26.4 mm -57.8 -70.26 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.379 1.876 0 C-N-CA 129.067 2.947 . . . . 0.0 113.013 173.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.435 ' CD ' ' HG2' ' A' ' 28' ' ' GLU 0.846 0.0 OUTLIER -52.13 -2.1 0.02 OUTLIER 'General case' 0 CA--C 1.48 -1.726 1 C-N-CA 133.015 4.526 . . . . 0.0 120.996 179.163 . . . . . . . . 5 4 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -84.26 -18.77 35.34 Favored 'General case' 0 CA--C 1.564 1.483 0 O-C-N 119.944 -1.722 . . . . 0.0 107.409 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -99.16 21.23 12.13 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 130.118 3.367 . . . . 0.0 113.993 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.3 t -38.62 -43.73 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.397 2.652 0 C-N-CA 129.588 3.155 . . . . 0.0 112.99 163.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.93 -39.69 74.97 Favored 'General case' 0 C--O 1.214 -0.8 1 C-N-CA 132.546 4.339 . . . . 0.0 114.096 177.099 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.488 ' HA ' ' HG3' ' A' ' 79' ' ' GLU 0.254 30.8 mt-10 -75.93 -32.11 59.42 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 126.315 1.846 . . . . 0.0 112.594 169.02 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.417 ' HB ' ' CE2' ' A' ' 80' ' ' PHE 0.422 1.8 m -66.98 -31.12 52.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.505 0 CA-C-O 127.805 3.669 . . . . 0.0 112.379 168.15 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.521 ' HB2' HG21 ' A' ' 38' ' ' VAL 0.451 0.0 OUTLIER -71.93 -29.56 64.42 Favored 'General case' 0 C--N 1.351 0.67 1 C-N-CA 132.593 4.357 . . . . 0.0 112.067 168.718 . . . . . . . . 5 4 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.298 17.7 mt-10 -69.94 -30.11 67.41 Favored 'General case' 0 C--N 1.373 1.602 0 C-N-CA 129.248 3.019 . . . . 0.0 109.574 166.684 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.417 ' CE2' ' HB ' ' A' ' 77' ' ' VAL . 2.8 m-85 -61.58 -47.26 86.31 Favored 'General case' 0 C--N 1.386 2.157 0 CA-C-N 119.295 0.952 . . . . 0.0 110.553 165.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 125' ' ' LYS 0.53 1.1 tm? . . . . . 0 N--CA 1.501 2.113 0 N-CA-C 119.612 3.19 . . . . 0.0 119.612 173.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.138 0 N-CA-C 118.112 2.005 . . . . 0.0 118.112 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -124.83 139.41 53.87 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 103.822 -2.659 . . . . 0.0 103.822 176.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.51 139.1 45.2 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -174.263 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -128.26 130.82 48.49 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 102.564 -3.124 . . . . 0.0 102.564 178.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.407 ' CG2' ' HB3' ' A' ' 151' ' ' LYS . 0.0 OUTLIER -134.33 138.71 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 124.477 1.111 . . . . 0.0 108.115 -171.761 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -137.6 114.4 10.55 Favored 'General case' 0 C--N 1.38 1.928 0 N-CA-C 116.412 2.005 . . . . 0.0 116.412 -167.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.803 ' HB3' ' H ' ' A' ' 151' ' ' LYS 0.329 0.9 OUTLIER -132.32 -157.99 0.86 Allowed 'General case' 0 C--N 1.386 2.16 0 CA-C-N 122.576 2.444 . . . . 0.0 108.064 177.853 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -47.2 67.06 0.0 OUTLIER Glycine 0 CA--C 1.453 -3.84 1 C-N-CA 134.494 5.807 . . . . 0.0 118.771 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 93.41 5.01 0.05 OUTLIER 'General case' 0 CA--C 1.492 -1.277 1 C-N-CA 134.568 5.147 . . . . 0.0 111.825 169.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.961 HD23 HD12 ' A' ' 66' ' ' LEU . 16.0 tp -106.96 133.99 50.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.727 1.211 . . . . 0.0 111.383 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -110.59 99.63 8.57 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 102.13 -3.285 . . . . 0.0 102.13 171.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.402 ' HB2' ' HZ1' ' A' ' 151' ' ' LYS . 0.7 OUTLIER -106.76 131.68 53.6 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 124.625 1.17 . . . . 0.0 108.12 -177.607 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -135.27 138.43 9.98 Favored Glycine 0 C--N 1.348 1.25 0 O-C-N 118.938 -2.351 . . . . 0.0 108.133 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.89 152.81 50.8 Favored 'General case' 0 C--N 1.364 1.203 0 CA-C-N 120.876 2.338 . . . . 0.0 107.182 174.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 p -127.32 140.79 51.96 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 106.33 -1.729 . . . . 0.0 106.33 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.5 t -85.84 134.86 26.24 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 102.411 -3.181 . . . . 0.0 102.411 169.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.418 14.2 p -14.64 64.41 0.0 OUTLIER 'General case' 0 C--N 1.375 1.705 0 C-N-CA 131.674 3.99 . . . . 0.0 120.29 -171.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.436 2.0 ptmt -15.77 -56.75 0.04 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 137.796 6.439 . . . . 0.0 117.215 -172.201 . . . . . . . . 3 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -68.94 48.18 0.48 Allowed 'Trans proline' 0 CA--C 1.574 2.508 0 C-N-CA 123.143 2.562 . . . . 0.0 115.174 166.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.402 0.0 OUTLIER 156.45 -171.89 0.0 OUTLIER 'General case' 0 C--N 1.376 1.75 0 C-N-CA 131.356 3.863 . . . . 0.0 110.576 176.159 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -152.35 -77.41 0.12 Allowed 'General case' 0 N--CA 1.423 -1.779 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 157.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.502 0.0 OUTLIER 19.35 59.53 0.02 OUTLIER 'General case' 0 C--N 1.356 0.855 1 C-N-CA 135.417 5.487 . . . . 0.0 119.176 -170.496 . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 171.14 -168.7 0.02 OUTLIER 'General case' 0 CA--C 1.507 -0.698 1 C-N-CA 132.322 4.249 . . . . 0.0 104.299 -172.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 81' ' ' LEU 0.489 0.0 OUTLIER -125.22 -71.41 0.71 Allowed 'General case' 0 C--N 1.358 0.944 0 CA-C-N 119.457 1.026 . . . . 0.0 113.631 -179.763 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.517 ' H ' HD23 ' A' ' 81' ' ' LEU . 9.3 p-10 -43.71 -59.57 3.37 Favored Pre-proline 0 C--N 1.355 0.831 0 N-CA-C 121.78 3.993 . . . . 0.0 121.78 172.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.619 0.0 OUTLIER 55.49 -178.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.392 2.82 1 N-CA-C 123.061 4.216 . . . . 0.0 123.061 163.648 . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 24.6 t -105.26 140.61 38.15 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 102.053 -3.314 . . . . 0.0 102.053 171.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mp -100.29 130.15 46.37 Favored 'General case' 0 C--N 1.347 0.486 1 N-CA-C 99.157 -4.386 . . . . 0.0 99.157 -177.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -123.3 74.29 1.23 Allowed 'General case' 0 CA--C 1.479 -1.756 0 N-CA-C 105.655 -1.979 . . . . 0.0 105.655 -161.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.365 0.5 OUTLIER 95.35 115.65 0.02 OUTLIER 'General case' 0 C--N 1.368 1.389 0 CA-C-O 123.482 1.611 . . . . 0.0 110.598 -176.487 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.482 HH22 HG21 ' A' ' 70' ' ' ILE . 14.3 ptm180 -114.75 129.93 56.76 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 171.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.9 ttt -93.73 122.02 35.76 Favored 'General case' 0 N--CA 1.439 -0.986 1 C-N-CA 132.998 4.519 . . . . 0.0 107.729 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.274 . . -127.91 114.44 17.17 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -144.4 122.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 O-C-N 119.849 -1.782 . . . . 0.0 108.634 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.546 HD12 HG23 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -118.14 -179.67 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 C-N-CA 127.67 2.388 . . . . 0.0 112.72 -166.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.326 0.2 OUTLIER -140.23 153.13 46.46 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 111.314 -2.676 . . . . 0.0 109.169 162.671 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.56 ' HB2' ' HD2' ' A' ' 139' ' ' ARG . 68.0 m -162.5 -122.35 0.02 OUTLIER 'General case' 0 C--N 1.354 0.789 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -169.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.581 ' CG ' ' H ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -84.76 -81.52 0.19 Allowed 'General case' 0 C--N 1.362 1.138 1 C-N-CA 136.118 5.767 . . . . 0.0 114.661 -171.677 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.581 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 0.5 OUTLIER -87.71 -1.16 57.78 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 129.521 3.128 . . . . 0.0 110.428 171.413 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.7 OUTLIER . . . . . 0 N--CA 1.42 -1.94 0 C-N-CA 125.951 1.7 . . . . 0.0 111.004 -170.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.733 ' CD1' ' H ' ' A' ' 152' ' ' THR . 5.0 tp . . . . . 0 CA--C 1.513 -0.472 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.827 ' HE3' HD11 ' A' ' 66' ' ' LEU 0.292 0.0 OUTLIER -127.92 111.24 13.36 Favored 'General case' 0 CA--C 1.459 -2.536 1 O-C-N 115.916 -4.24 . . . . 0.0 115.568 118.886 . . . . . . . . 5 4 . 1 . 003 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.733 ' H ' ' CD1' ' A' ' 150' ' ' ILE 0.28 74.5 p -118.71 99.11 6.57 Favored 'General case' 0 N--CA 1.435 -1.196 1 N-CA-C 97.58 -4.97 . . . . 0.0 97.58 130.755 . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.681 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -175.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.631 ' HA ' HG13 ' A' ' 7' ' ' VAL . 15.3 m-80 . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 115.964 1.838 . . . . 0.0 115.964 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.5 m -61.22 -55.47 31.72 Favored 'General case' 0 C--N 1.349 0.581 0 C-N-CA 130.458 3.503 . . . . 0.0 112.104 174.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -72.74 -21.16 61.07 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 128.222 2.609 . . . . 0.0 112.656 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.631 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.267 0.7 OUTLIER -82.41 -38.13 15.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.074 0 C-N-CA 126.798 2.039 . . . . 0.0 111.049 178.156 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.82 -44.47 85.53 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 129.857 3.263 . . . . 0.0 108.885 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.88 -43.84 89.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 C-N-CA 126.048 1.739 . . . . 0.0 110.765 168.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.266 2.7 tpt85 -62.33 -50.29 72.22 Favored 'General case' 0 C--N 1.371 1.511 0 N-CA-C 116.153 1.909 . . . . 0.0 116.153 170.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -59.11 -29.18 67.18 Favored 'General case' 0 C--N 1.373 1.596 0 N-CA-C 118.486 2.773 . . . . 0.0 118.486 170.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -77.21 -51.45 10.93 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.13 3.372 . . . . 0.0 110.719 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -57.44 -29.21 64.0 Favored 'General case' 0 C--N 1.382 1.993 0 C-N-CA 128.271 2.628 . . . . 0.0 111.042 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.747 HD23 ' HA ' ' A' ' 54' ' ' ILE . 7.9 tp -71.22 -46.68 60.63 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 114.878 -1.056 . . . . 0.0 112.569 167.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.582 ' HA ' HD11 ' A' ' 54' ' ' ILE . 3.3 tmm_? -55.32 -43.43 74.89 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 120.18 1.354 . . . . 0.0 112.722 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -57.91 -47.75 81.91 Favored 'General case' 0 C--N 1.371 1.543 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 165.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -50.15 74.53 Favored 'General case' 0 C--N 1.38 1.912 0 C-N-CA 128.28 2.632 . . . . 0.0 115.113 175.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.544 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -65.33 -51.44 60.55 Favored 'General case' 0 C--N 1.357 0.91 1 C-N-CA 131.942 4.097 . . . . 0.0 110.226 177.46 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -72.95 -44.84 60.68 Favored 'General case' 0 C--N 1.381 1.952 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 176.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.4 m -63.71 -42.93 97.87 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.352 1.861 . . . . 0.0 112.792 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.491 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.453 4.9 mp0 -76.75 -28.41 55.74 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 120.073 -1.642 . . . . 0.0 111.029 174.163 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.45 -32.53 71.47 Favored 'General case' 0 C--N 1.386 2.156 0 CA-C-N 122.467 2.394 . . . . 0.0 113.023 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -65.12 -45.33 85.54 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 124.347 1.059 . . . . 0.0 111.761 163.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -56.63 -47.04 80.56 Favored 'General case' 0 C--N 1.378 1.806 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 171.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.448 ' CD1' ' CD1' ' A' ' 67' ' ' PHE . 1.2 mt -68.57 -43.85 83.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 124.929 1.291 . . . . 0.0 112.767 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.58 1.4 p30 -73.41 -23.95 60.21 Favored 'General case' 0 C--N 1.376 1.75 0 CA-C-N 121.631 2.014 . . . . 0.0 114.001 173.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -70.61 -41.32 72.41 Favored 'General case' 0 C--N 1.382 1.979 0 C-N-CA 125.059 1.343 . . . . 0.0 111.086 169.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -66.01 -37.68 86.54 Favored 'General case' 0 C--N 1.373 1.614 0 O-C-N 119.439 -2.038 . . . . 0.0 112.429 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -40.15 87.79 Favored 'Isoleucine or valine' 0 C--N 1.363 1.17 0 C-N-CA 124.619 1.168 . . . . 0.0 113.807 174.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -67.21 -39.96 86.39 Favored 'General case' 0 C--N 1.37 1.469 0 O-C-N 120.604 -1.31 . . . . 0.0 113.265 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -75.7 -38.57 58.51 Favored 'General case' 0 CA--C 1.484 -1.575 0 C-N-CA 126.37 1.868 . . . . 0.0 111.642 -176.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.35 -44.96 67.07 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 124.055 0.942 . . . . 0.0 113.175 174.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.527 ' HA ' HD22 ' A' ' 78' ' ' ASN 0.362 96.5 p -71.41 -31.38 67.18 Favored 'General case' 0 C--N 1.355 0.824 0 O-C-N 121.214 -0.929 . . . . 0.0 113.159 177.1 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -69.69 -48.49 59.47 Favored 'General case' 0 C--N 1.367 1.355 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 164.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.1 67.69 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 126.48 1.912 . . . . 0.0 114.612 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.9 -13.67 62.36 Favored 'General case' 0 C--N 1.378 1.805 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 164.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.22 18.05 30.03 Favored Glycine 0 C--N 1.375 2.731 0 O-C-N 120.823 -1.173 . . . . 0.0 113.576 171.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.674 HG23 HD23 ' A' ' 81' ' ' LEU 0.256 0.8 OUTLIER -113.25 169.08 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -174.603 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.5 t -30.37 -78.3 0.02 OUTLIER 'General case' 0 C--N 1.357 0.919 1 C-N-CA 132.825 4.45 . . . . 0.0 117.242 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.5 m 122.73 146.86 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 131.483 3.913 . . . . 0.0 102.521 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.415 ' CE1' HG23 ' A' ' 74' ' ' VAL . 30.5 p90 -122.98 154.6 38.21 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 124.713 1.205 . . . . 0.0 109.012 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -101.3 144.66 29.87 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.289 2.5 pp -125.86 159.6 32.07 Favored 'General case' 0 CA--C 1.49 -1.349 0 O-C-N 119.207 -2.183 . . . . 0.0 111.066 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -133.79 165.98 23.72 Favored 'General case' 0 CA--C 1.485 -1.537 0 N-CA-C 102.059 -3.311 . . . . 0.0 102.059 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 131' ' ' CYS . 0.1 OUTLIER -152.98 147.2 25.66 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -179.453 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -95.24 124.94 39.54 Favored 'General case' 0 C--N 1.359 0.994 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 176.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.464 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.325 0.4 OUTLIER -79.51 -11.03 59.9 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 117.975 -1.012 . . . . 0.0 113.342 -179.439 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.73 -37.98 48.11 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 127.639 2.375 . . . . 0.0 112.34 176.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.3 tp -62.79 -41.02 99.09 Favored 'General case' 0 C--N 1.359 1.007 0 CA-C-O 126.536 3.065 . . . . 0.0 111.544 168.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.544 HD11 ' CD1' ' A' ' 18' ' ' PHE 0.401 6.8 tt -76.62 -41.43 45.98 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 110.299 -3.137 . . . . 0.0 109.231 -172.92 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.412 ' HA ' HG22 ' A' ' 54' ' ' ILE . 29.9 t70 -54.65 -38.24 66.66 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 129.147 2.979 . . . . 0.0 111.746 165.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -66.23 -42.29 88.85 Favored 'General case' 0 C--N 1.376 1.724 0 O-C-N 119.735 -1.853 . . . . 0.0 112.136 169.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.69 67.05 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 118.693 -2.504 . . . . 0.0 116.959 170.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.747 ' HA ' HD23 ' A' ' 14' ' ' LEU 0.401 0.2 OUTLIER -69.29 -41.81 81.15 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 C-N-CA 131.582 3.953 . . . . 0.0 111.972 179.61 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.05 -28.86 10.79 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 171.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -83.54 -27.31 29.41 Favored 'General case' 0 C--N 1.371 1.517 0 CA-C-N 122.277 2.308 . . . . 0.0 111.422 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -103.55 -70.11 0.77 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.931 1.693 . . . . 0.0 111.384 173.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.566 0.0 OUTLIER 83.78 155.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 127.082 2.153 . . . . 0.0 111.568 -179.419 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.514 ' N ' HD22 ' A' ' 14' ' ' LEU 0.257 47.0 p30 31.83 47.43 0.07 Allowed 'General case' 0 N--CA 1.519 3.011 1 C-N-CA 132.483 4.313 . . . . 0.0 116.675 -177.296 . . . . . . . . 4 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.404 11.3 pt-20 -82.03 69.88 8.83 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-O 125.005 2.336 . . . . 0.0 113.358 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 64' ' ' PHE 0.414 1.2 p -81.67 -19.09 42.35 Favored 'General case' 0 N--CA 1.426 -1.637 0 C-N-CA 131.687 3.995 . . . . 0.0 113.819 164.828 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.601 ' CD2' HD13 ' A' ' 141' ' ' LEU . 0.0 OUTLIER -65.42 -35.53 81.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 130.322 3.449 . . . . 0.0 109.157 171.915 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.654 ' HA ' HD11 ' A' ' 111' ' ' LEU . 3.0 t -58.71 -46.1 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.845 0 C-N-CA 129.668 3.187 . . . . 0.0 110.442 176.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.254 60.3 m-85 -60.55 -45.18 94.86 Favored 'General case' 0 C--O 1.212 -0.875 1 C-N-CA 131.812 4.045 . . . . 0.0 114.065 166.91 . . . . . . . . 4 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -68.32 -37.98 81.1 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 121.507 1.958 . . . . 0.0 114.049 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.597 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.3 tm? -65.1 -52.4 55.69 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 125.116 1.366 . . . . 0.0 112.087 168.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.457 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.677 0.0 OUTLIER -78.44 -17.76 55.89 Favored 'General case' 0 C--N 1.38 1.896 0 CA-C-N 121.967 2.167 . . . . 0.0 116.158 -177.299 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -78.08 -22.97 48.22 Favored 'General case' 0 C--N 1.355 0.826 0 C-N-CA 128.0 2.52 . . . . 0.0 109.576 165.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -76.91 -36.93 56.28 Favored 'General case' 0 C--N 1.381 1.96 0 O-C-N 120.379 -1.451 . . . . 0.0 110.46 170.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 66' ' ' LEU 0.356 0.0 OUTLIER -92.92 -7.55 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.295 0 N-CA-C 120.74 3.608 . . . . 0.0 120.74 -178.777 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -47.69 -1.45 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 1 C-N-CA 133.725 4.81 . . . . 0.0 116.998 -175.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -83.67 -43.23 15.79 Favored 'General case' 0 C--N 1.362 1.116 1 C-N-CA 139.079 6.952 . . . . 0.0 110.353 172.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.632 ' CG ' ' HA ' ' A' ' 153' ' ' GLN . 0.2 OUTLIER -62.57 -9.76 9.87 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 131.343 3.857 . . . . 0.0 115.895 -174.001 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.415 HG23 ' CE1' ' A' ' 41' ' ' PHE . 10.6 p -60.49 -20.73 21.47 Favored 'Isoleucine or valine' 0 C--N 1.375 1.702 0 C-N-CA 127.937 2.495 . . . . 0.0 110.959 166.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.418 ' HA ' HD21 ' A' ' 78' ' ' ASN . 4.5 mp -72.99 -35.15 66.8 Favored 'General case' 0 C--N 1.378 1.812 0 C-N-CA 130.339 3.456 . . . . 0.0 111.362 171.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.334 36.2 mt-10 -76.85 -32.61 57.66 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.229 -1.544 . . . . 0.0 113.118 170.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.452 HG13 ' O ' ' A' ' 73' ' ' HIS 0.383 0.8 OUTLIER -68.95 -29.94 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 CA-C-O 126.66 3.124 . . . . 0.0 110.12 167.867 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.55 ' HB3' HG11 ' A' ' 38' ' ' VAL . 82.6 m-20 -68.04 -32.5 72.91 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 117.921 -2.987 . . . . 0.0 113.583 165.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.56 -30.03 71.2 Favored 'General case' 0 C--N 1.378 1.82 0 C-N-CA 125.882 1.673 . . . . 0.0 111.534 165.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.458 ' CE2' HG21 ' A' ' 117' ' ' VAL 0.389 6.6 t80 -65.35 -32.05 73.5 Favored 'General case' 0 CA--C 1.583 2.226 0 C-N-CA 126.864 2.066 . . . . 0.0 112.733 164.082 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.674 HD23 HG23 ' A' ' 38' ' ' VAL . 10.9 tp . . . . . 0 N--CA 1.523 3.214 0 CA-C-O 125.09 2.376 . . . . 0.0 114.071 162.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.124 0 CA-C-O 123.35 1.528 . . . . 0.0 115.155 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -141.06 151.7 44.23 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.286 -1.714 . . . . 0.0 107.902 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.0 mt -109.61 114.11 27.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -128.81 109.42 11.26 Favored 'General case' 0 CA--C 1.496 -1.107 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 -173.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.762 HD12 HD23 ' A' ' 113' ' ' LEU . 1.3 pp -136.63 141.01 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.075 0 C-N-CA 125.752 1.621 . . . . 0.0 111.837 -171.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.5 m -117.9 118.47 32.09 Favored 'General case' 0 C--N 1.351 0.641 0 O-C-N 119.652 -1.905 . . . . 0.0 111.873 177.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.263 0.4 OUTLIER -176.6 170.36 2.45 Favored 'General case' 0 CA--C 1.479 -1.762 0 N-CA-C 102.724 -3.065 . . . . 0.0 102.724 172.727 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.597 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 94.0 -34.15 4.83 Favored Glycine 1 CA--C 1.417 -6.074 0 CA-C-O 115.044 -3.087 . . . . 0.0 110.753 -160.863 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 29.9 m-80 100.76 0.71 0.02 OUTLIER 'General case' 0 C--N 1.375 1.684 2 C-N-CA 132.232 4.213 . . . . 0.0 106.381 -157.448 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.654 HD11 ' HA ' ' A' ' 63' ' ' VAL 0.308 1.0 OUTLIER -86.72 137.03 32.79 Favored 'General case' 0 C--N 1.354 0.787 1 C-N-CA 138.103 6.561 . . . . 0.0 114.216 -178.681 . . . . . . . . 5 4 . 1 . 004 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.71 100.64 13.32 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 164.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.762 HD23 HD12 ' A' ' 106' ' ' ILE . 0.3 OUTLIER -96.22 126.82 41.7 Favored 'General case' 0 C--N 1.382 1.981 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 175.453 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.66 123.71 5.32 Favored Glycine 0 C--N 1.351 1.391 0 N-CA-C 105.899 -2.881 . . . . 0.0 105.899 174.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -122.97 127.3 48.66 Favored 'General case' 0 C--N 1.369 1.446 1 N-CA-C 99.648 -4.204 . . . . 0.0 99.648 174.713 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.1 m -121.18 127.88 51.93 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 -171.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.459 HG13 ' HB3' ' A' ' 127' ' ' PRO . 13.4 t -80.24 138.73 19.31 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.425 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.558 10.9 p -54.41 67.7 0.0 OUTLIER 'General case' 0 C--N 1.378 1.84 0 N-CA-C 120.845 3.646 . . . . 0.0 120.845 -162.06 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.465 11.8 ttmm -22.48 -45.81 0.05 OUTLIER Pre-proline 0 C--N 1.359 0.997 1 C-N-CA 133.999 4.92 . . . . 0.0 121.795 -170.251 . . . . . . . . 3 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -70.63 60.18 2.12 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 CA-C-N 125.647 3.053 . . . . 0.0 113.595 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 17.0 p30 170.07 161.99 0.07 Allowed 'General case' 0 C--N 1.367 1.335 0 C-N-CA 128.038 2.535 . . . . 0.0 113.521 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.542 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 2.5 tt0 -85.28 -69.63 0.64 Allowed 'General case' 0 C--N 1.376 1.744 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 152.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 44.37 -10.76 0.0 OUTLIER 'General case' 0 C--N 1.363 1.173 1 C-N-CA 139.648 7.179 . . . . 0.0 118.018 -170.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.542 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 56.4 m-85 -138.9 -163.01 1.4 Allowed 'General case' 0 N--CA 1.414 -2.245 0 N-CA-C 121.212 3.782 . . . . 0.0 121.212 -161.138 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HB2' HD12 ' A' ' 81' ' ' LEU 0.364 0.0 OUTLIER -167.84 -56.4 0.02 OUTLIER 'General case' 0 C--N 1.359 1.019 2 C-N-CA 139.725 7.21 . . . . 0.0 105.484 179.051 . . . . . . . . 5 4 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.581 ' HB3' HD22 ' A' ' 81' ' ' LEU . 1.4 p30 -89.31 85.26 0.13 Allowed Pre-proline 0 C--N 1.357 0.894 1 C-N-CA 131.999 4.119 . . . . 0.0 111.912 171.969 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.459 ' HB3' HG13 ' A' ' 117' ' ' VAL . 2.8 Cg_exo -90.72 -176.08 0.94 Allowed 'Trans proline' 0 CA--C 1.488 -1.782 0 C-N-CA 124.136 3.224 . . . . 0.0 117.297 -161.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 16.6 m -112.41 136.07 52.34 Favored 'General case' 0 N--CA 1.439 -1.006 1 N-CA-C 100.192 -4.003 . . . . 0.0 100.192 162.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.5 mp -100.73 140.83 34.46 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 102.415 -3.18 . . . . 0.0 102.415 -175.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -100.28 -0.58 38.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.889 -1.132 . . . . 0.0 110.412 -166.592 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 131' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 45' ' ' TYR . 8.4 t 174.21 128.92 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -170.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -115.59 109.79 18.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 101.309 -3.589 . . . . 0.0 101.309 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 10.3 ttt -104.28 122.66 45.87 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.191 2.196 . . . . 0.0 107.423 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.301 . . -129.07 113.74 15.51 Favored 'General case' 0 N--CA 1.435 -1.213 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 173.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -144.24 159.98 15.37 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 C-N-CA 125.378 1.471 . . . . 0.0 111.836 -176.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.945 HD13 HD11 ' A' ' 141' ' ' LEU . 0.2 OUTLIER -140.11 -179.08 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 128.236 2.614 . . . . 0.0 108.989 -175.917 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.409 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -138.12 122.98 18.88 Favored 'General case' 0 CA--C 1.56 1.331 0 N-CA-C 117.938 2.57 . . . . 0.0 117.938 179.168 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.326 46.5 m 172.72 -76.01 0.0 OUTLIER 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.989 2.915 . . . . 0.0 105.486 177.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.459 ' HG2' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER 168.45 -123.78 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.156 1 N-CA-C 95.722 -5.659 . . . . 0.0 95.722 -172.363 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.459 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 -58.94 -24.72 62.82 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 130.979 3.711 . . . . 0.0 119.682 173.473 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.945 HD11 HD13 ' A' ' 136' ' ' ILE 0.359 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.125 2 C-N-CA 135.802 5.641 . . . . 0.0 124.276 178.991 . . . . . . . . 4 3 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.411 HG21 HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.466 -2.251 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -77.82 115.24 17.41 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 105.433 -2.062 . . . . 0.0 105.433 176.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 11.0 t -75.38 143.84 42.57 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -124.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.632 ' HA ' ' CG ' ' A' ' 73' ' ' HIS . 3.1 tp60 . . . . . 0 C--O 1.263 1.764 0 C-N-CA 129.235 3.014 . . . . 0.0 109.841 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.462 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.452 2.5 m120 . . . . . 0 C--O 1.225 -0.202 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 -58.21 1.92 Allowed 'General case' 0 C--O 1.246 0.906 1 C-N-CA 132.504 4.321 . . . . 0.0 105.465 160.136 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.436 6.7 mt-10 -63.99 -8.74 12.47 Favored 'General case' 0 C--O 1.205 -1.243 0 O-C-N 119.49 -2.006 . . . . 0.0 115.358 177.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.5 p -67.93 -35.65 72.82 Favored 'Isoleucine or valine' 0 C--N 1.365 1.262 0 C-N-CA 131.488 3.915 . . . . 0.0 113.339 171.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -78.64 -43.81 25.32 Favored 'General case' 0 CA--C 1.497 -1.095 1 C-N-CA 133.062 4.545 . . . . 0.0 107.721 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.7 mt -64.39 -44.1 97.11 Favored 'Isoleucine or valine' 0 C--N 1.374 1.658 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.423 166.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.47 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.267 26.5 mmm-85 -54.8 -50.34 68.76 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 130.576 3.55 . . . . 0.0 111.536 174.259 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -57.89 -36.72 72.8 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 118.596 2.813 . . . . 0.0 118.596 163.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -76.64 -44.43 34.09 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 118.17 -2.831 . . . . 0.0 113.259 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 30.6 mmmt -63.67 -30.43 71.54 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 131.075 3.75 . . . . 0.0 106.95 172.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.533 HD22 ' CD2' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -67.87 -41.02 83.47 Favored 'General case' 0 C--N 1.373 1.619 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 162.334 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.4 mtp180 -60.15 -38.06 82.01 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.404 2.82 . . . . 0.0 112.425 171.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.8 mmt-85 -63.23 -53.25 55.97 Favored 'General case' 0 C--N 1.374 1.641 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB2' HD23 ' A' ' 14' ' ' LEU . 8.4 m-70 -59.07 -50.37 74.33 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 130.226 3.41 . . . . 0.0 112.343 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.546 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.62 -54.1 49.39 Favored 'General case' 0 C--N 1.378 1.819 0 C-N-CA 130.176 3.391 . . . . 0.0 111.165 176.69 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -73.57 -38.75 65.08 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -65.59 -43.73 88.8 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 125.438 1.495 . . . . 0.0 112.826 177.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.626 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.257 44.2 mt-10 -75.26 -28.99 60.03 Favored 'General case' 0 C--N 1.361 1.096 0 O-C-N 121.08 -1.012 . . . . 0.0 111.732 171.525 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.409 ' CE2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -67.89 -28.65 67.69 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 117.883 -3.011 . . . . 0.0 114.827 171.103 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -69.16 -37.04 78.02 Favored 'General case' 0 C--N 1.372 1.567 0 C-N-CA 125.629 1.572 . . . . 0.0 109.393 165.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -58.9 -43.15 90.97 Favored 'General case' 0 C--N 1.369 1.451 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 169.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -72.42 -46.23 57.01 Favored 'Isoleucine or valine' 0 C--N 1.366 1.32 0 O-C-N 121.267 -0.896 . . . . 0.0 111.626 176.288 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.448 ' HA ' ' CG1' ' A' ' 29' ' ' ILE 0.634 17.7 p30 -71.98 -22.62 61.41 Favored 'General case' 0 C--N 1.372 1.586 0 O-C-N 119.733 -1.855 . . . . 0.0 115.447 175.837 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -74.37 -43.11 57.92 Favored 'General case' 0 C--N 1.373 1.591 0 O-C-N 119.754 -1.841 . . . . 0.0 110.508 166.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.5 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.312 0.3 OUTLIER -64.86 -32.73 74.57 Favored 'General case' 0 C--N 1.395 2.576 0 O-C-N 118.756 -2.465 . . . . 0.0 113.526 173.196 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.549 HG21 HD23 ' A' ' 43' ' ' LEU 0.262 1.5 pp -67.84 -43.45 86.11 Favored 'Isoleucine or valine' 0 C--N 1.375 1.681 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 174.03 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.0 ttm105 -62.84 -37.67 87.72 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 119.748 -1.845 . . . . 0.0 115.853 174.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -76.59 -48.66 18.48 Favored 'General case' 0 CA--C 1.478 -1.793 0 C-N-CA 127.756 2.423 . . . . 0.0 111.27 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.473 ' CB ' HG11 ' A' ' 74' ' ' VAL . . . -68.52 -34.74 76.41 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 t -73.45 -43.33 60.53 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.281 1.432 . . . . 0.0 110.73 175.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -70.74 -35.72 72.82 Favored 'General case' 0 C--N 1.375 1.711 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.75 -32.7 62.17 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 126.194 1.798 . . . . 0.0 113.748 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -16.54 60.54 Favored 'General case' 0 C--N 1.385 2.125 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.56 18.38 28.25 Favored Glycine 0 C--N 1.37 2.426 0 O-C-N 121.123 -0.985 . . . . 0.0 115.289 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.52 HG21 ' CB ' ' A' ' 78' ' ' ASN . 0.6 OUTLIER -104.1 166.93 2.85 Favored 'Isoleucine or valine' 0 C--N 1.357 0.917 0 N-CA-C 101.722 -3.436 . . . . 0.0 101.722 176.03 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.442 ' N ' ' CG2' ' A' ' 38' ' ' VAL 0.298 0.0 OUTLIER -39.18 160.87 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.115 1 C-N-CA 134.417 5.087 . . . . 0.0 118.011 159.925 . . . . . . . . 5 4 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.9 p -103.89 117.76 35.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 118.808 -2.433 . . . . 0.0 110.034 -173.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -118.28 153.24 34.28 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-O 122.034 0.921 . . . . 0.0 110.372 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -113.83 105.8 13.7 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 129' ' ' LEU 0.356 0.1 OUTLIER -94.58 120.71 35.24 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 118.845 -2.409 . . . . 0.0 111.671 -169.347 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -132.55 145.23 50.97 Favored 'General case' 0 C--N 1.4 2.801 0 CA-C-N 120.64 1.564 . . . . 0.0 109.426 -170.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.547 ' HA ' ' H ' ' A' ' 132' ' ' ARG . 0.0 OUTLIER -92.65 147.32 22.97 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.582 3.153 . . . . 0.0 114.897 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.4 p -108.45 96.81 6.6 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 128.625 2.77 . . . . 0.0 105.543 175.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.429 ' HG2' ' H ' ' A' ' 47' ' ' GLN . 29.7 mm-40 -48.03 -8.43 0.02 OUTLIER 'General case' 0 C--O 1.2 -1.508 1 C-N-CA 132.056 4.142 . . . . 0.0 119.773 -174.871 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.34 81.43 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 125.383 3.72 . . . . 0.0 116.695 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.657 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.2 -38.96 92.93 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 129.726 3.21 . . . . 0.0 112.997 171.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.657 ' H ' HD22 ' A' ' 49' ' ' LEU . 5.9 tt -72.01 -36.59 69.76 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 127.456 2.303 . . . . 0.0 111.062 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.58 -30.41 71.13 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 129.642 3.177 . . . . 0.0 108.82 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -69.4 -45.68 68.67 Favored 'General case' 0 C--N 1.37 1.499 0 CA-C-O 124.306 2.003 . . . . 0.0 115.315 164.325 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.518 ' HB1' ' CD ' ' A' ' 60' ' ' GLU . . . -75.52 -27.83 58.89 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 117.574 2.435 . . . . 0.0 117.574 -172.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.496 HD12 ' CD2' ' A' ' 50' ' ' LEU . 5.2 tt -74.35 -37.61 45.48 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.845 1 C-N-CA 132.941 4.496 . . . . 0.0 110.587 176.831 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -107.94 -29.17 9.18 Favored 'General case' 0 C--N 1.38 1.904 0 N-CA-C 117.862 2.541 . . . . 0.0 117.862 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.81 -45.32 17.12 Favored 'General case' 0 C--N 1.357 0.933 0 CA-C-N 121.663 2.029 . . . . 0.0 114.35 -172.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.642 ' CG ' HD23 ' A' ' 141' ' ' LEU 0.276 0.0 OUTLIER -103.35 -44.05 5.26 Favored 'General case' 0 CA--C 1.48 -1.749 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 171.423 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.474 HG22 ' O ' ' A' ' 54' ' ' ILE 0.488 0.0 OUTLIER 74.82 -168.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.854 1 C-N-CA 131.984 4.114 . . . . 0.0 112.638 179.132 . . . . . . . . 5 4 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.434 ' HA ' ' HG ' ' A' ' 14' ' ' LEU 0.252 50.2 p30 21.94 49.54 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 1 C-N-CA 131.909 4.083 . . . . 0.0 117.786 179.002 . . . . . . . . 4 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.518 ' CD ' ' HB1' ' A' ' 53' ' ' ALA 0.5 11.4 pt-20 -80.76 62.99 5.0 Favored 'General case' 0 C--N 1.362 1.12 0 CA-C-O 127.308 3.432 . . . . 0.0 112.227 -172.28 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.448 ' HA ' ' HB2' ' A' ' 64' ' ' PHE 0.561 1.4 p -80.64 -15.67 56.0 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.223 2.609 . . . . 0.0 116.994 176.884 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -71.44 -33.28 69.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.823 2.449 . . . . 0.0 107.871 167.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 136' ' ' ILE . 94.0 t -69.61 -36.21 69.66 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 128.059 2.544 . . . . 0.0 108.945 175.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 31.5 m-85 -66.92 -34.91 78.82 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.498 1.919 . . . . 0.0 115.826 164.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -83.01 -36.72 24.79 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-N 122.032 2.196 . . . . 0.0 112.086 -176.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.836 HD13 HD13 ' A' ' 111' ' ' LEU . 2.8 tt -65.41 -42.61 92.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.648 1.579 . . . . 0.0 110.934 167.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.926 0.0 OUTLIER -77.84 -15.15 59.27 Favored 'General case' 0 C--N 1.368 1.387 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 173.596 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . 0.283 21.2 m80 -83.77 -15.83 47.03 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 127.221 2.209 . . . . 0.0 112.042 166.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.489 0.0 OUTLIER -82.91 -27.49 30.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 119.973 -1.705 . . . . 0.0 109.107 155.052 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.453 HG13 ' HG ' ' A' ' 113' ' ' LEU . 18.7 mm -67.57 -9.55 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 C-N-CA 127.502 2.321 . . . . 0.0 113.537 170.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.5 ' HB2' ' CD ' ' A' ' 28' ' ' GLU . 62.2 pttt -49.98 -33.84 19.1 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 120.609 3.559 . . . . 0.0 120.609 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.497 ' HA ' HG12 ' A' ' 74' ' ' VAL . 31.4 t70 -101.62 8.41 41.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.517 -1.364 . . . . 0.0 107.454 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.444 ' NE2' HD12 ' A' ' 70' ' ' ILE . 1.3 m80 -66.87 -8.88 32.32 Favored 'General case' 0 C--N 1.395 2.569 0 C-N-CA 129.125 2.97 . . . . 0.0 110.988 171.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.497 HG12 ' HA ' ' A' ' 72' ' ' ASP . 9.9 p -41.38 -46.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 128.968 2.907 . . . . 0.0 112.02 157.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 71.5 mt -68.46 -23.88 64.65 Favored 'General case' 0 C--N 1.36 1.045 0 N-CA-C 117.563 2.431 . . . . 0.0 117.563 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -75.47 -46.63 31.34 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.541 1.536 . . . . 0.0 111.686 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.39 14.7 p -66.3 -29.0 45.25 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.4 0 C-N-CA 127.474 2.31 . . . . 0.0 110.206 172.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 75' ' ' LEU . 5.2 m120 -74.19 -38.69 63.55 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 128.285 2.634 . . . . 0.0 116.67 169.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -30.42 71.16 Favored 'General case' 0 C--N 1.372 1.555 0 C-N-CA 126.156 1.782 . . . . 0.0 110.896 172.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.22 -38.96 82.42 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 128.577 2.751 . . . . 0.0 112.283 166.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.513 HD11 ' HD2' ' A' ' 127' ' ' PRO . 2.5 tp . . . . . 0 C--N 1.368 1.393 0 C-N-CA 128.551 2.74 . . . . 0.0 118.134 171.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.729 0 CA-C-O 122.408 1.005 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.54 147.63 34.97 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 127.193 2.197 . . . . 0.0 113.975 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.7 tt -135.38 123.74 23.27 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -129.54 130.25 45.52 Favored 'General case' 0 C--N 1.365 1.279 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.41 HG22 HG12 ' A' ' 150' ' ' ILE 0.493 0.0 OUTLIER -135.27 140.72 44.4 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.294 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.9 t -124.71 143.6 50.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 119.223 -2.173 . . . . 0.0 113.213 -173.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.588 ' HB3' HD21 ' A' ' 66' ' ' LEU . 27.0 t70 -124.64 82.77 2.08 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 120.018 -1.677 . . . . 0.0 108.322 174.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.52 -47.0 0.05 OUTLIER Glycine 0 C--N 1.368 2.339 0 C-N-CA 129.78 3.562 . . . . 0.0 119.419 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -119.24 -49.17 2.4 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 128.219 2.608 . . . . 0.0 107.421 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.836 HD13 HD13 ' A' ' 66' ' ' LEU 0.318 5.6 mp -80.05 134.45 36.21 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 122.382 2.355 . . . . 0.0 117.062 179.234 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -104.81 101.64 11.23 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 104.987 -2.227 . . . . 0.0 104.987 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.453 ' HG ' HG13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -102.87 122.01 43.67 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 177.616 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.79 135.38 12.49 Favored Glycine 0 C--N 1.356 1.671 0 N-CA-C 106.76 -2.536 . . . . 0.0 106.76 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.9 135.58 48.52 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 48.5 m -135.5 134.62 39.69 Favored 'General case' 0 C--N 1.371 1.523 0 O-C-N 119.049 -2.282 . . . . 0.0 105.248 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.485 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 14.9 m -66.48 166.46 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.572 0 C-N-CA 125.385 1.474 . . . . 0.0 111.936 177.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.371 24.4 p -67.45 63.19 0.07 Allowed 'General case' 0 C--N 1.35 0.63 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -24.43 -47.0 0.09 OUTLIER Pre-proline 0 C--N 1.353 0.756 1 C-N-CA 137.356 6.262 . . . . 0.0 118.988 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -73.72 53.06 2.66 Favored 'Trans proline' 0 CA--C 1.566 2.109 0 C-N-CA 123.718 2.945 . . . . 0.0 113.364 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -159.23 152.34 22.22 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.914 2.086 . . . . 0.0 110.706 -175.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -126.09 11.25 7.61 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 120.472 1.487 . . . . 0.0 112.465 170.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.314 0.0 OUTLIER -95.34 2.83 54.81 Favored 'General case' 0 C--N 1.364 1.215 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 -176.361 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.536 ' HB2' ' HD3' ' A' ' 125' ' ' LYS 0.53 0.0 OUTLIER -45.66 149.75 0.57 Allowed 'General case' 0 C--N 1.353 0.741 1 N-CA-C 122.074 4.101 . . . . 0.0 122.074 178.427 . . . . . . . . 5 4 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.708 ' H ' ' HD3' ' A' ' 127' ' ' PRO 0.816 10.8 mmtt 125.01 92.79 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.594 1 C-N-CA 134.606 5.162 . . . . 0.0 103.787 169.766 . . . . . . . . 4 3 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.414 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.8 t70 112.51 13.48 0.0 OUTLIER Pre-proline 0 CA--C 1.592 2.572 1 C-N-CA 131.706 4.002 . . . . 0.0 113.49 -156.984 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.708 ' HD3' ' H ' ' A' ' 125' ' ' LYS . 85.0 Cg_endo -63.88 -175.44 0.29 Allowed 'Trans proline' 0 C--N 1.387 2.556 2 C-N-CA 127.987 5.791 . . . . 0.0 119.364 175.23 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 38.4 m -101.99 164.52 11.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 109.905 -3.316 . . . . 0.0 104.467 170.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 43' ' ' LEU . 5.8 mp -102.48 143.5 32.11 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 102.406 -3.183 . . . . 0.0 102.406 171.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.02 53.99 1.97 Allowed 'General case' 0 CA--C 1.484 -1.583 0 N-CA-C 104.243 -2.503 . . . . 0.0 104.243 -170.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 1.8 m 147.28 104.2 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 104.587 -2.375 . . . . 0.0 104.587 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.547 ' H ' ' HA ' ' A' ' 45' ' ' TYR . 7.9 tpt180 -117.39 112.76 21.12 Favored 'General case' 0 N--CA 1.439 -0.992 1 N-CA-C 99.667 -4.198 . . . . 0.0 99.667 166.953 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.0 ttt -109.07 126.83 53.58 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.28 114.91 17.51 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 171.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ILE . . . . . 0.481 HD11 ' CB ' ' A' ' 49' ' ' LEU . 0.5 OUTLIER -137.57 157.58 33.83 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.205 1.802 . . . . 0.0 108.092 178.845 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.662 HD11 HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -142.08 175.08 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 N-CA-C 100.546 -3.872 . . . . 0.0 100.546 173.177 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -115.08 137.86 51.53 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.592 3.157 . . . . 0.0 106.194 168.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.468 ' HB3' ' HG3' ' A' ' 139' ' ' ARG . 17.5 m -140.63 -127.09 0.1 Allowed 'General case' 0 CA--C 1.502 -0.875 0 CA-C-N 121.009 1.731 . . . . 0.0 112.872 -178.001 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.599 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -92.82 -85.11 0.27 Allowed 'General case' 0 N--CA 1.428 -1.55 1 C-N-CA 134.184 4.994 . . . . 0.0 105.671 179.97 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.599 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 5.5 ptp180 -94.23 -9.06 37.43 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 128.376 2.67 . . . . 0.0 112.907 174.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.642 HD23 ' CG ' ' A' ' 57' ' ' GLU 0.508 0.4 OUTLIER . . . . . 0 C--N 1.382 1.984 0 C-N-CA 129.407 3.083 . . . . 0.0 110.315 -177.688 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.41 HG12 HG22 ' A' ' 106' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.357 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.406 ' HD3' HG22 ' A' ' 152' ' ' THR 0.5 0.0 OUTLIER -122.69 153.88 38.82 Favored 'General case' 0 CA--C 1.478 -1.818 1 C-N-CA 132.527 4.331 . . . . 0.0 104.652 167.956 . . . . . . . . 5 4 . 1 . 005 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.406 HG22 ' HD3' ' A' ' 151' ' ' LYS 0.339 9.2 t -70.65 97.9 1.42 Allowed 'General case' 0 N--CA 1.431 -1.375 1 CA-C-O 131.763 5.554 . . . . 0.0 117.932 -150.787 . . . . . . . . 4 3 . 1 . 005 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 . . . . . 0 N--CA 1.42 -1.958 3 C-N-CA 148.359 10.663 . . . . 0.0 121.009 166.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.408 ' HA ' HG13 ' A' ' 7' ' ' VAL . 5.1 t-20 . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -60.81 2.05 Favored 'General case' 0 C--N 1.353 0.72 1 C-N-CA 133.602 4.761 . . . . 0.0 110.253 171.967 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -73.17 -17.28 61.39 Favored 'General case' 0 C--N 1.373 1.588 0 C-N-CA 126.815 2.046 . . . . 0.0 112.571 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.408 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.253 0.6 OUTLIER -80.7 -36.61 15.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 127.133 2.173 . . . . 0.0 110.598 175.153 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -64.63 -46.25 83.39 Favored 'General case' 0 C--N 1.375 1.674 0 C-N-CA 128.344 2.657 . . . . 0.0 108.657 175.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.8 mt -54.59 -43.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.362 1.118 0 C-N-CA 126.279 1.831 . . . . 0.0 112.968 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.38 11.0 ttt180 -67.48 -42.91 82.2 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 171.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -60.27 -27.52 67.32 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 165.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -76.91 -50.72 12.66 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 130.315 3.446 . . . . 0.0 109.99 173.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -57.25 -29.22 63.63 Favored 'General case' 0 C--N 1.378 1.814 0 C-N-CA 128.234 2.614 . . . . 0.0 110.666 170.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' A' ' 54' ' ' ILE . 4.0 tp -72.08 -44.14 63.72 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 124.319 1.048 . . . . 0.0 113.664 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -54.9 -43.66 73.46 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.319 -1.488 . . . . 0.0 110.607 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.2 mtp85 -63.39 -46.1 87.99 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 166.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.38 -47.84 82.55 Favored 'General case' 0 C--N 1.384 2.077 0 C-N-CA 130.111 3.364 . . . . 0.0 113.268 175.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.613 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.91 -46.71 83.6 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 130.407 3.483 . . . . 0.0 110.732 176.212 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.93 -42.66 57.29 Favored 'General case' 0 C--N 1.377 1.765 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.7 m -68.31 -43.09 78.4 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 127.023 2.129 . . . . 0.0 112.281 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.63 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.409 43.8 mt-10 -74.55 -28.72 61.07 Favored 'General case' 0 C--N 1.364 1.208 0 O-C-N 120.442 -1.411 . . . . 0.0 112.223 169.334 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.256 0.6 OUTLIER -60.71 -34.07 73.83 Favored 'General case' 0 C--N 1.38 1.924 0 O-C-N 119.035 -2.291 . . . . 0.0 112.978 165.384 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.7 mtt85 -66.23 -35.81 81.38 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 120.648 -1.283 . . . . 0.0 112.101 166.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -60.8 -46.74 89.32 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 116.879 2.178 . . . . 0.0 116.879 166.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.2 mt -70.98 -45.07 74.81 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 O-C-N 120.657 -1.277 . . . . 0.0 111.756 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.646 0.5 OUTLIER -71.28 -23.68 62.01 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 119.346 -2.097 . . . . 0.0 114.929 175.203 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -73.11 -35.2 66.53 Favored 'General case' 0 C--N 1.384 2.085 0 O-C-N 121.244 -0.91 . . . . 0.0 110.822 169.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -66.51 -39.74 88.84 Favored 'General case' 0 C--N 1.391 2.408 0 O-C-N 119.127 -2.233 . . . . 0.0 112.002 169.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.469 HG13 HG22 ' A' ' 74' ' ' VAL . 1.4 mp -61.99 -46.32 96.75 Favored 'Isoleucine or valine' 0 C--N 1.37 1.457 0 CA-C-N 119.52 1.055 . . . . 0.0 113.567 172.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 -59.46 -39.96 85.33 Favored 'General case' 0 C--N 1.357 0.92 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 173.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -76.49 -44.71 34.19 Favored 'General case' 0 CA--C 1.487 -1.45 0 O-C-N 119.428 -2.045 . . . . 0.0 111.183 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.88 -44.84 60.83 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 124.764 1.226 . . . . 0.0 114.031 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.2 t -69.38 -28.8 66.49 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 120.106 -1.621 . . . . 0.0 110.899 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -75.75 -41.0 54.45 Favored 'General case' 0 C--N 1.389 2.309 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 165.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.22 -31.93 64.45 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 127.059 2.144 . . . . 0.0 114.809 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.67 -12.34 59.99 Favored 'General case' 0 C--N 1.382 1.99 0 O-C-N 121.107 -0.996 . . . . 0.0 111.691 166.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.66 18.16 60.58 Favored Glycine 0 C--N 1.381 3.065 0 O-C-N 120.813 -1.179 . . . . 0.0 114.813 168.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.523 ' HB ' HD12 ' A' ' 81' ' ' LEU 0.394 0.7 OUTLIER -99.2 178.88 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.168 0 C-N-CA 126.917 2.087 . . . . 0.0 110.344 -172.871 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 t -29.23 -55.11 0.14 Allowed 'General case' 0 N--CA 1.488 1.439 1 C-N-CA 132.127 4.171 . . . . 0.0 116.984 -174.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.29 3.2 t 82.46 111.65 0.06 Allowed 'General case' 0 C--N 1.359 1.009 0 C-N-CA 131.652 3.981 . . . . 0.0 108.638 -174.279 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 77' ' ' VAL . 3.9 p90 -113.24 158.42 20.51 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 122.347 1.07 . . . . 0.0 111.065 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -100.72 155.66 17.77 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 127.536 2.334 . . . . 0.0 105.371 175.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -119.34 126.02 50.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 O-C-N 120.442 -1.411 . . . . 0.0 108.596 -174.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -115.27 169.92 8.77 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-O 124.298 1.999 . . . . 0.0 108.038 174.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.636 ' CD2' HD13 ' A' ' 50' ' ' LEU 0.293 14.1 m-30 -107.99 172.13 7.01 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.3 2.24 . . . . 0.0 108.623 176.209 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.34 91.36 3.49 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 101.963 -3.347 . . . . 0.0 101.963 153.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.488 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.321 0.0 OUTLIER -56.25 -10.46 0.88 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 127.631 2.373 . . . . 0.0 115.654 179.858 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.67 -38.74 28.47 Favored 'General case' 0 C--N 1.374 1.652 0 C-N-CA 129.031 2.932 . . . . 0.0 111.222 171.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.599 HD13 ' N ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -62.55 -46.07 90.04 Favored 'General case' 0 C--N 1.372 1.552 0 CA-C-O 125.297 2.475 . . . . 0.0 108.377 167.502 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.673 HD23 ' CG1' ' A' ' 54' ' ' ILE 0.298 0.1 OUTLIER -62.9 -37.54 87.35 Favored 'General case' 0 C--O 1.21 -1.017 0 C-N-CA 127.474 2.31 . . . . 0.0 110.192 172.534 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -54.91 -32.74 61.42 Favored 'General case' 0 C--N 1.37 1.472 0 O-C-N 117.603 -3.186 . . . . 0.0 111.876 168.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -74.94 -58.01 3.55 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 158.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.4 -27.47 66.02 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 119.096 2.999 . . . . 0.0 119.096 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.673 ' CG1' HD23 ' A' ' 50' ' ' LEU . 29.8 mt -75.15 -48.62 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.761 0 C-N-CA 129.977 3.311 . . . . 0.0 110.709 172.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.594 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -106.62 -12.12 15.66 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -176.443 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -78.44 -3.5 43.66 Favored 'General case' 0 C--N 1.365 1.261 0 CA-C-N 122.347 2.339 . . . . 0.0 114.305 -174.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -157.86 -48.99 0.06 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.766 1.626 . . . . 0.0 111.346 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.594 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.542 0.2 OUTLIER 83.59 160.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.372 1.587 1 C-N-CA 131.97 4.108 . . . . 0.0 112.036 178.142 . . . . . . . . 5 4 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.537 ' N ' HD22 ' A' ' 14' ' ' LEU . 13.5 t70 38.14 54.29 1.7 Allowed 'General case' 0 N--CA 1.513 2.685 0 C-N-CA 131.465 3.906 . . . . 0.0 114.642 -176.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.625 ' HA ' HH22 ' A' ' 139' ' ' ARG 0.484 10.4 pt-20 -75.92 66.03 2.09 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 125.499 2.571 . . . . 0.0 113.822 178.643 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.374 18.2 p -79.26 -16.85 55.82 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.925 2.89 . . . . 0.0 114.108 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -65.55 -33.95 77.12 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 129.652 3.181 . . . . 0.0 110.188 166.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -65.77 -46.68 88.24 Favored 'Isoleucine or valine' 0 C--N 1.362 1.116 0 C-N-CA 127.567 2.347 . . . . 0.0 109.888 -174.403 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.63 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 48.7 m-85 -62.41 -39.54 93.6 Favored 'General case' 0 C--O 1.21 -0.996 1 C-N-CA 132.572 4.349 . . . . 0.0 112.473 168.031 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -66.53 -45.41 79.54 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.724 2.056 . . . . 0.0 112.787 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.662 HD12 HD21 ' A' ' 111' ' ' LEU . 1.9 tm? -64.79 -49.3 71.22 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.974 1.309 . . . . 0.0 113.104 168.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.455 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.883 0.0 OUTLIER -76.38 -16.55 59.69 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 118.818 -2.426 . . . . 0.0 114.996 -176.908 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.3 m80 -78.69 -27.57 45.1 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.729 2.412 . . . . 0.0 110.249 162.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -79.92 -18.98 49.15 Favored 'General case' 0 C--N 1.366 1.317 0 O-C-N 119.578 -1.951 . . . . 0.0 111.972 166.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.282 0.0 OUTLIER -97.62 -16.23 7.17 Favored 'Isoleucine or valine' 0 C--N 1.369 1.444 0 C-N-CA 127.168 2.187 . . . . 0.0 114.052 -177.348 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -52.15 -4.12 0.03 OUTLIER 'General case' 0 C--N 1.363 1.161 1 C-N-CA 133.973 4.909 . . . . 0.0 119.536 -175.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.262 29.7 t70 -95.77 -3.92 44.89 Favored 'General case' 0 N--CA 1.416 -2.146 1 C-N-CA 133.261 4.624 . . . . 0.0 108.373 178.783 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 153' ' ' GLN . 0.1 OUTLIER -57.56 -8.24 0.81 Allowed 'General case' 0 C--N 1.385 2.113 0 C-N-CA 130.282 3.433 . . . . 0.0 114.149 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.469 HG22 HG13 ' A' ' 29' ' ' ILE . 40.3 t -42.05 -32.04 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 128.654 2.782 . . . . 0.0 115.225 157.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.52 -37.46 50.89 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.856 2.462 . . . . 0.0 113.326 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.08 -35.81 72.0 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 119.471 -2.018 . . . . 0.0 111.21 172.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.463 HG11 ' CZ ' ' A' ' 41' ' ' PHE 0.541 16.4 t -72.33 -28.55 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.16 0 C-N-CA 129.933 3.293 . . . . 0.0 112.199 173.254 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.406 ' ND2' HG11 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -67.01 -43.89 81.72 Favored 'General case' 0 C--N 1.379 1.876 0 C-N-CA 129.914 3.286 . . . . 0.0 111.278 168.301 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -63.45 -35.77 81.54 Favored 'General case' 0 C--N 1.381 1.973 0 C-N-CA 126.273 1.829 . . . . 0.0 112.182 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.32 -39.14 89.41 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 127.023 2.129 . . . . 0.0 114.539 169.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.523 HD12 ' HB ' ' A' ' 38' ' ' VAL . 2.4 tm? . . . . . 0 C--N 1.373 1.591 0 C-N-CA 130.464 3.506 . . . . 0.0 113.559 173.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.9 0 N-CA-C 117.518 1.767 . . . . 0.0 117.518 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -141.31 155.14 46.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 126.363 1.865 . . . . 0.0 107.483 173.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.0 mt -110.66 140.46 44.99 Favored 'General case' 0 C--N 1.348 0.505 0 C-N-CA 127.011 2.125 . . . . 0.0 110.034 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -129.29 110.85 12.29 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 103.877 -2.638 . . . . 0.0 103.877 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.418 ' HB ' HD11 ' A' ' 150' ' ' ILE . 13.9 pt -134.9 139.68 46.91 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 -177.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.4 m -126.69 111.16 13.95 Favored 'General case' 0 C--N 1.367 1.339 0 N-CA-C 104.234 -2.506 . . . . 0.0 104.234 -176.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 150' ' ' ILE . 4.0 t0 -136.78 161.18 36.68 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 103.618 -2.734 . . . . 0.0 103.618 -171.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.502 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 82.65 -58.01 5.02 Favored Glycine 0 N--CA 1.484 1.846 0 O-C-N 120.072 -1.642 . . . . 0.0 116.837 169.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 162.11 -29.77 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.276 1 C-N-CA 136.344 5.858 . . . . 0.0 106.691 -167.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.693 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.588 0.9 OUTLIER -79.67 137.42 37.07 Favored 'General case' 0 C--N 1.375 1.714 2 C-N-CA 132.33 4.252 . . . . 0.0 122.131 -176.858 . . . . . . . . 5 4 . 1 . 006 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -89.74 101.21 13.91 Favored 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 103.668 -2.716 . . . . 0.0 103.668 171.396 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.343 22.8 mt -94.23 137.49 33.34 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.1 2.16 . . . . 0.0 106.404 -178.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.82 132.69 8.51 Favored Glycine 0 C--N 1.349 1.268 0 O-C-N 119.761 -1.837 . . . . 0.0 110.372 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . 0.266 1.7 m-30 -120.47 140.13 51.86 Favored 'General case' 0 C--N 1.368 1.408 0 N-CA-C 101.407 -3.553 . . . . 0.0 101.407 172.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 92.5 m -124.82 151.84 44.7 Favored 'General case' 0 CA--C 1.49 -1.347 1 N-CA-C 99.833 -4.136 . . . . 0.0 99.833 171.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 118' ' ' CYS . 45.4 t -74.33 156.61 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 126.47 1.908 . . . . 0.0 107.931 169.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.545 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.29 72.2 m -68.54 95.49 0.64 Allowed 'General case' 0 C--N 1.362 1.133 0 CA-C-O 123.849 1.785 . . . . 0.0 109.097 164.76 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -71.94 -40.09 7.58 Favored Pre-proline 0 N--CA 1.432 -1.374 0 C-N-CA 130.795 3.638 . . . . 0.0 112.875 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -74.29 59.74 4.69 Favored 'Trans proline' 0 CA--C 1.559 1.73 0 CA-C-N 127.028 3.546 . . . . 0.0 114.122 174.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.361 4.3 p30 -162.54 -80.55 0.04 OUTLIER 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.405 2.282 . . . . 0.0 110.502 173.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . 0.403 23.9 tt0 19.52 88.29 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.7 2 C-N-CA 137.796 6.438 . . . . 0.0 122.498 -174.741 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -118.66 0.51 11.51 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 129.821 3.248 . . . . 0.0 107.661 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -114.88 -144.46 0.39 Allowed 'General case' 0 C--N 1.349 0.567 0 C-N-CA 128.298 2.639 . . . . 0.0 112.791 -165.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.264 7.9 mptt -116.84 -73.72 0.63 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 -178.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -152.98 92.03 3.36 Favored Pre-proline 0 C--N 1.353 0.752 0 CA-C-O 112.797 -3.478 . . . . 0.0 109.427 171.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -125.59 17.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.243 1 CA-C-N 130.678 4.849 . . . . 0.0 120.615 -174.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.6 t -147.56 148.21 30.91 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 156.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.2 mt -103.32 133.11 48.94 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 170.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.545 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 20.8 tt0 -91.29 44.04 1.17 Allowed 'General case' 0 C--N 1.369 1.427 0 CA-C-N 122.247 2.294 . . . . 0.0 112.355 -173.247 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 30.7 p 129.13 140.39 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 129.087 2.955 . . . . 0.0 106.748 -175.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -116.02 109.54 17.67 Favored 'General case' 0 N--CA 1.441 -0.914 1 N-CA-C 97.407 -5.034 . . . . 0.0 97.407 157.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.17 132.07 40.52 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 127.501 2.321 . . . . 0.0 107.662 -176.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.16 115.03 17.07 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.8 mt -141.58 129.78 22.35 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 CA-C-O 123.868 1.794 . . . . 0.0 106.397 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.693 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -118.88 179.39 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 124.829 2.252 . . . . 0.0 114.27 -170.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.65 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.7 OUTLIER -143.5 136.07 27.27 Favored 'General case' 0 N--CA 1.442 -0.846 2 C-N-CA 134.994 5.318 . . . . 0.0 98.251 171.068 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.592 ' HB2' ' HG ' ' A' ' 141' ' ' LEU . 1.0 OUTLIER -158.71 -110.45 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -169.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.625 HH22 ' HA ' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -113.04 -83.68 0.59 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.184 2.593 . . . . 0.0 111.041 -166.403 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.617 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 1.0 OUTLIER -86.16 7.84 23.37 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 131.556 3.942 . . . . 0.0 109.695 169.161 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER . . . . . 0 CA--C 1.572 1.827 0 CA-C-O 115.82 -2.038 . . . . 0.0 106.741 -169.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 108' ' ' ASP . 1.4 pt . . . . . 0 C--O 1.218 -0.581 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.412 46.4 mtpt -120.56 148.67 43.56 Favored 'General case' 0 CA--C 1.496 -1.115 1 N-CA-C 96.977 -5.194 . . . . 0.0 96.977 162.804 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 6.4 t -74.61 144.06 44.08 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 121.035 3.717 . . . . 0.0 121.035 -131.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 73' ' ' HIS . 66.1 mt-30 . . . . . 0 C--O 1.264 1.852 2 CA-C-N 105.926 -5.125 . . . . 0.0 110.655 -172.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.447 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 6.2 t-20 . . . . . 0 C--O 1.222 -0.363 0 CA-C-O 122.795 1.283 . . . . 0.0 109.442 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -64.7 0.84 Allowed 'General case' 0 C--N 1.355 0.826 0 C-N-CA 130.583 3.553 . . . . 0.0 112.058 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -71.45 -12.02 61.18 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 125.554 1.541 . . . . 0.0 113.241 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.447 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.6 OUTLIER -81.2 -39.31 17.32 Favored 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 127.829 2.452 . . . . 0.0 110.22 174.912 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -66.1 -42.81 88.76 Favored 'General case' 0 C--N 1.371 1.505 0 C-N-CA 129.047 2.939 . . . . 0.0 109.114 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.2 -43.36 89.45 Favored 'Isoleucine or valine' 0 C--N 1.377 1.766 0 C-N-CA 125.348 1.459 . . . . 0.0 111.297 165.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.25 0.0 OUTLIER -58.52 -50.61 73.15 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 169.52 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -56.34 -26.14 51.54 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 117.915 -2.991 . . . . 0.0 115.404 166.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -77.12 -38.23 52.57 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 118.928 -2.358 . . . . 0.0 113.731 165.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.609 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 8.4 mmmt -65.07 -27.78 69.01 Favored 'General case' 0 C--N 1.372 1.557 1 CA-C-O 129.078 4.275 . . . . 0.0 107.376 170.777 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.594 HD12 HG13 ' A' ' 54' ' ' ILE . 0.3 OUTLIER -71.55 -46.38 59.65 Favored 'General case' 0 C--O 1.206 -1.219 0 O-C-N 116.634 -3.791 . . . . 0.0 112.479 166.936 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -55.76 -27.6 51.67 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.632 2.086 . . . . 0.0 116.632 167.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.609 ' HG3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -69.88 -49.79 48.82 Favored 'General case' 0 C--N 1.397 2.647 0 CA-C-N 121.842 2.11 . . . . 0.0 112.896 168.928 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.419 ' CD2' ' HB ' ' A' ' 61' ' ' THR . 0.1 OUTLIER -82.55 -28.67 30.83 Favored 'General case' 0 C--N 1.364 1.218 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -177.827 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -67.67 -53.92 23.81 Favored 'General case' 0 C--O 1.204 -1.339 0 C-N-CA 127.746 2.418 . . . . 0.0 106.547 172.45 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -74.14 -39.77 63.06 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 119.969 3.322 . . . . 0.0 119.969 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 t -73.21 -41.94 63.21 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.531 -1.356 . . . . 0.0 113.858 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . 0.522 3.4 tt0 -77.86 -28.51 50.07 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 120.109 -1.62 . . . . 0.0 112.803 176.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.688 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -72.6 -27.81 62.4 Favored 'General case' 0 C--N 1.381 1.955 0 O-C-N 118.772 -2.455 . . . . 0.0 112.828 170.152 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.8 mtt85 -66.93 -36.84 83.14 Favored 'General case' 0 C--N 1.378 1.807 0 C-N-CA 125.612 1.565 . . . . 0.0 110.156 164.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -63.02 -43.02 99.89 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.444 HG22 HD12 ' A' ' 29' ' ' ILE . 8.0 mt -69.83 -45.34 77.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.396 0 CA-C-N 120.009 1.277 . . . . 0.0 111.859 173.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.526 13.2 p30 -69.12 -24.22 64.09 Favored 'General case' 0 C--N 1.379 1.883 0 O-C-N 119.842 -1.786 . . . . 0.0 115.335 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -73.84 -47.21 40.01 Favored 'General case' 0 C--N 1.378 1.839 0 C-N-CA 126.926 2.09 . . . . 0.0 110.044 169.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -30.9 70.94 Favored 'General case' 0 C--N 1.398 2.716 0 O-C-N 117.697 -3.127 . . . . 0.0 112.95 174.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.444 HD12 HG22 ' A' ' 25' ' ' ILE . 3.2 mt -63.3 -48.63 86.51 Favored 'Isoleucine or valine' 0 C--N 1.378 1.835 0 C-N-CA 124.675 1.19 . . . . 0.0 112.508 171.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.4 ttt85 -64.37 -37.87 89.03 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 122.34 2.336 . . . . 0.0 115.465 176.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -76.5 -38.16 55.66 Favored 'General case' 0 CA--C 1.473 -1.984 0 C-N-CA 127.157 2.183 . . . . 0.0 112.344 -177.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.56 -43.51 14.43 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.605 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.391 1.5 p -66.79 -30.73 71.01 Favored 'General case' 0 C--N 1.359 1.01 0 O-C-N 120.583 -1.323 . . . . 0.0 112.85 -179.377 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -72.04 -46.58 56.47 Favored 'General case' 0 C--N 1.375 1.68 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 162.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.72 -26.16 66.02 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 116.058 1.873 . . . . 0.0 116.058 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.57 -14.49 62.87 Favored 'General case' 0 C--N 1.376 1.738 0 C-N-CA 127.031 2.132 . . . . 0.0 112.489 166.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.41 17.63 30.81 Favored Glycine 0 C--N 1.377 2.826 0 O-C-N 121.317 -0.864 . . . . 0.0 113.291 169.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.673 HG23 HD22 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -115.82 164.1 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 -176.479 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.703 ' HB2' HD11 ' A' ' 81' ' ' LEU 0.308 0.3 OUTLIER -26.4 -57.52 0.08 Allowed 'General case' 0 C--N 1.361 1.105 1 C-N-CA 133.764 4.826 . . . . 0.0 119.429 -175.441 . . . . . . . . 5 4 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.8 t 103.47 122.19 0.01 OUTLIER 'General case' 0 C--N 1.352 0.686 1 C-N-CA 132.103 4.161 . . . . 0.0 107.263 -172.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -113.65 160.53 18.5 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-O 123.037 1.399 . . . . 0.0 112.558 -173.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -110.79 145.76 37.57 Favored 'General case' 0 C--N 1.352 0.681 0 C-N-CA 127.319 2.248 . . . . 0.0 109.481 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' ' 129' ' ' LEU . 15.8 tp -126.35 154.89 42.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 118.897 -2.377 . . . . 0.0 106.665 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -132.37 172.66 12.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 O-C-N 120.202 -1.561 . . . . 0.0 111.016 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.659 ' CD2' HD13 ' A' ' 50' ' ' LEU 0.269 4.3 m-30 -93.49 172.02 8.53 Favored 'General case' 0 CA--C 1.558 1.262 0 CA-C-O 123.125 1.44 . . . . 0.0 109.197 168.17 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.3 t -127.03 98.62 5.39 Favored 'General case' 0 C--N 1.349 0.551 0 N-CA-C 101.562 -3.495 . . . . 0.0 101.562 157.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.486 0.0 OUTLIER -61.58 -10.54 8.37 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 -177.217 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.05 -46.6 13.69 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.851 2.46 . . . . 0.0 111.001 171.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.634 HD13 ' N ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -60.36 -48.49 81.53 Favored 'General case' 0 C--N 1.373 1.625 0 C-N-CA 127.401 2.28 . . . . 0.0 110.153 170.601 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.659 HD13 ' CD2' ' A' ' 45' ' ' TYR 0.252 6.2 tt -64.25 -33.4 75.72 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 112.54 -2.118 . . . . 0.0 112.553 172.56 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -56.82 -30.09 63.4 Favored 'General case' 0 C--N 1.368 1.395 0 CA-C-N 121.033 1.742 . . . . 0.0 112.109 166.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -84.29 -45.14 13.14 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 162.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.24 75.18 Favored 'General case' 0 C--N 1.371 1.501 0 CA-C-N 123.05 2.659 . . . . 0.0 114.005 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.594 HG13 HD12 ' A' ' 14' ' ' LEU . 1.2 tt -48.51 -34.45 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 131.075 3.75 . . . . 0.0 116.658 177.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HA ' HG22 ' A' ' 58' ' ' ILE . 9.8 mt-30 -92.16 -9.44 42.41 Favored 'General case' 0 C--N 1.362 1.127 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 173.176 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -94.28 -47.22 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 127.213 2.205 . . . . 0.0 108.733 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.652 ' HG2' HD11 ' A' ' 136' ' ' ILE . 28.2 mt-10 -85.86 -3.27 58.87 Favored 'General case' 0 CA--C 1.492 -1.287 1 C-N-CA 132.003 4.121 . . . . 0.0 117.997 -176.822 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.447 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -17.82 -3.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.063 2 N-CA-C 125.71 5.448 . . . . 0.0 125.71 -177.738 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.446 ' N ' HD13 ' A' ' 58' ' ' ILE . 44.6 t0 142.86 37.91 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.5 1 C-N-CA 134.798 5.239 . . . . 0.0 105.15 -166.235 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.323 54.7 mm-40 -89.67 85.36 6.43 Favored 'General case' 0 CA--C 1.472 -2.032 0 C-N-CA 131.142 3.777 . . . . 0.0 105.933 175.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.419 ' HB ' ' CD2' ' A' ' 17' ' ' HIS 0.475 0.1 OUTLIER -79.7 -11.32 59.86 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 127.908 2.483 . . . . 0.0 114.086 176.021 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.655 ' HE2' HG21 ' A' ' 136' ' ' ILE 0.281 0.7 OUTLIER -61.83 -34.76 76.53 Favored 'General case' 0 N--CA 1.479 1.021 1 C-N-CA 133.896 4.878 . . . . 0.0 111.347 169.233 . . . . . . . . 5 4 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 111' ' ' LEU 0.303 0.5 OUTLIER -73.42 -49.76 34.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 C-N-CA 131.373 3.869 . . . . 0.0 106.993 -167.313 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.556 ' HA ' ' CD2' ' A' ' 67' ' ' PHE 0.257 30.7 m-85 -71.23 -29.82 65.59 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 130.928 3.691 . . . . 0.0 112.899 168.5 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.1 -41.74 94.65 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 122.018 2.19 . . . . 0.0 112.185 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.688 HD11 ' HD3' ' A' ' 151' ' ' LYS . 1.9 tm? -64.17 -40.31 95.85 Favored 'General case' 0 CA--C 1.578 2.024 0 C-N-CA 126.246 1.818 . . . . 0.0 112.113 167.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.556 ' CD2' ' HA ' ' A' ' 64' ' ' PHE . 2.2 m-85 -74.36 -17.53 60.81 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 117.925 -2.984 . . . . 0.0 113.351 174.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CD2' ' O ' ' A' ' 64' ' ' PHE 0.355 57.8 m-70 -85.83 -17.04 36.8 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 128.211 2.604 . . . . 0.0 109.671 172.952 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -75.25 -40.27 59.05 Favored 'General case' 0 C--N 1.371 1.513 0 CA-C-O 118.07 -0.967 . . . . 0.0 111.652 156.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 151' ' ' LYS . 1.6 mm -52.68 -46.24 49.69 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.787 0 C-N-CA 129.251 3.02 . . . . 0.0 114.617 172.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.6 pttp -50.66 -7.95 0.04 OUTLIER 'General case' 0 CA--C 1.491 -1.296 1 C-N-CA 132.591 4.356 . . . . 0.0 121.232 -160.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -106.62 -16.74 14.43 Favored 'General case' 0 N--CA 1.44 -0.975 0 O-C-N 119.932 -1.73 . . . . 0.0 107.854 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.842 ' CD2' ' HB ' ' A' ' 152' ' ' THR 0.286 1.0 OUTLIER -80.57 16.85 1.24 Allowed 'General case' 0 C--N 1.383 2.062 0 C-N-CA 128.229 2.611 . . . . 0.0 113.484 -178.497 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 78.6 t -40.2 -42.64 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.97 0 C-N-CA 129.658 3.183 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.64 -31.39 70.6 Favored 'General case' 0 C--N 1.364 1.217 0 C-N-CA 127.354 2.262 . . . . 0.0 116.205 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -76.25 -45.64 31.81 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 129.037 2.935 . . . . 0.0 113.139 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.363 4.9 p -66.3 -29.63 47.26 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.321 0 CA-C-O 126.562 3.077 . . . . 0.0 111.221 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.605 HD21 ' HB2' ' A' ' 33' ' ' SER . 5.5 m120 -73.77 -31.37 63.27 Favored 'General case' 0 C--N 1.354 0.762 0 O-C-N 118.622 -2.548 . . . . 0.0 115.353 169.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -67.08 -30.51 70.57 Favored 'General case' 0 C--N 1.37 1.469 0 CA-C-N 120.734 1.606 . . . . 0.0 110.697 168.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.28 -36.33 83.76 Favored 'General case' 0 CA--C 1.572 1.812 0 C-N-CA 125.029 1.332 . . . . 0.0 113.205 167.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.713 HD12 ' HA ' ' A' ' 126' ' ' ASP . 10.1 tt . . . . . 0 N--CA 1.5 2.061 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 168.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 N-CA-C 118.15 2.02 . . . . 0.0 118.15 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -131.36 140.31 49.68 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 126.544 1.938 . . . . 0.0 108.877 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mp -122.56 150.63 42.34 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 127.7 2.4 . . . . 0.0 113.451 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -129.52 113.08 14.42 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 127.432 2.293 . . . . 0.0 105.397 -174.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.655 HG21 ' HG2' ' A' ' 153' ' ' GLN 0.283 1.2 pt -134.85 132.83 53.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -175.045 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . 0.255 0.4 OUTLIER -139.73 127.59 22.05 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 119.973 -1.704 . . . . 0.0 111.416 -175.211 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 171.41 169.62 0.09 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 101.431 -3.544 . . . . 0.0 101.431 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.581 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.97 -33.97 4.62 Favored Glycine 0 N--CA 1.491 2.328 0 O-C-N 120.038 -1.663 . . . . 0.0 112.855 -173.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 121.05 -13.47 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.17 1 C-N-CA 137.659 6.384 . . . . 0.0 108.004 -168.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.774 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.788 0.0 OUTLIER -83.12 135.19 34.91 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 119.752 3.241 . . . . 0.0 119.752 -179.036 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -91.87 100.78 13.39 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 104.872 -2.269 . . . . 0.0 104.872 171.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.546 HD11 ' CE1' ' A' ' 67' ' ' PHE 0.269 3.5 mm? -95.98 132.89 40.83 Favored 'General case' 0 CA--C 1.558 1.268 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 174.28 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -118.36 128.78 7.88 Favored Glycine 0 C--N 1.351 1.392 0 N-CA-C 105.131 -3.188 . . . . 0.0 105.131 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.554 ' CE1' HD11 ' A' ' 106' ' ' ILE 0.258 6.0 m-30 -125.92 151.33 47.1 Favored 'General case' 0 C--N 1.366 1.289 0 CA-C-N 122.465 3.133 . . . . 0.0 102.797 -179.437 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.8 m -151.02 131.67 13.96 Favored 'General case' 0 CA--C 1.481 -1.697 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 13.6 t -69.05 142.85 15.63 Favored 'Isoleucine or valine' 0 C--N 1.371 1.511 0 C-N-CA 128.871 2.869 . . . . 0.0 107.494 172.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.481 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.362 87.4 m -51.05 110.91 0.48 Allowed 'General case' 0 C--N 1.375 1.692 0 CA-C-O 125.317 2.484 . . . . 0.0 116.99 -177.443 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.04 -39.12 7.89 Favored Pre-proline 0 N--CA 1.442 -0.863 0 CA-C-O 115.45 -2.214 . . . . 0.0 114.072 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.95 52.37 4.23 Favored 'Trans proline' 0 CA--C 1.556 1.601 0 CA-C-N 127.049 3.553 . . . . 0.0 114.786 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.97 177.22 3.8 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -173.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.5 -67.25 0.84 Allowed 'General case' 0 C--N 1.371 1.526 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 156.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.43 ' HB3' ' HG3' ' A' ' 127' ' ' PRO 0.441 5.3 mptp? 50.39 -19.28 0.0 OUTLIER 'General case' 0 N--CA 1.424 -1.732 1 C-N-CA 138.666 6.786 . . . . 0.0 118.421 -178.668 . . . . . . . . 4 3 . 1 . 007 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 107.34 -143.13 0.0 OUTLIER 'General case' 0 C--N 1.369 1.423 1 C-N-CA 132.754 4.422 . . . . 0.0 109.734 175.718 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.477 ' HB2' ' HG ' ' A' ' 81' ' ' LEU 0.495 0.0 OUTLIER -102.82 -54.37 2.65 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.58 1.552 . . . . 0.0 110.481 -177.057 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.713 ' HA ' HD12 ' A' ' 81' ' ' LEU 0.333 0.0 OUTLIER -26.73 -74.96 0.03 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 133.786 4.834 . . . . 0.0 117.858 166.145 . . . . . . . . 5 4 . 1 . 007 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.43 ' HG3' ' HB3' ' A' ' 123' ' ' LYS 0.659 0.0 OUTLIER 52.45 -177.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.384 2.406 1 N-CA-C 122.97 4.181 . . . . 0.0 122.97 145.328 . . . . . . . . 5 4 . 1 . 007 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 2.1 p -124.88 152.7 43.69 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.538 ' HB2' HD12 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -102.03 128.69 48.36 Favored 'General case' 0 C--N 1.359 1.021 1 N-CA-C 97.105 -5.146 . . . . 0.0 97.105 172.641 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 30.9 tt0 -80.6 1.81 28.25 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 128.048 2.539 . . . . 0.0 113.11 -154.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 21.8 p 163.49 146.08 0.01 OUTLIER 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 32.8 ttt85 -115.05 122.04 44.93 Favored 'General case' 0 N--CA 1.429 -1.484 1 N-CA-C 99.892 -4.114 . . . . 0.0 99.892 162.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 3.6 ttt -93.14 125.28 37.66 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 102.192 -3.262 . . . . 0.0 102.192 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.18 112.84 14.98 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.77 144.48 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.131 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.858 HD13 HD12 ' A' ' 141' ' ' LEU . 0.1 OUTLIER -140.89 175.84 5.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 115.629 1.715 . . . . 0.0 115.629 -170.482 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.726 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -158.94 71.76 0.54 Allowed 'General case' 0 C--N 1.367 1.354 1 C-N-CA 136.694 5.998 . . . . 0.0 108.105 172.546 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 7.5 t -67.7 -50.0 59.8 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-O 124.038 1.875 . . . . 0.0 110.085 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.445 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -168.27 -56.63 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 110.648 -2.978 . . . . 0.0 109.267 -175.059 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.493 ' HG3' HD22 ' A' ' 141' ' ' LEU . 8.6 ptp180 -109.21 14.98 23.53 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.183 2.593 . . . . 0.0 115.603 -173.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.858 HD12 HD13 ' A' ' 136' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.369 1.437 0 C-N-CA 128.01 2.524 . . . . 0.0 107.163 -163.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.74 HD13 ' H ' ' A' ' 152' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.893 0 N-CA-C 121.25 3.796 . . . . 0.0 121.25 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.688 ' HD3' HD11 ' A' ' 66' ' ' LEU 0.458 0.0 OUTLIER -123.15 101.51 7.44 Favored 'General case' 0 C--N 1.401 2.813 2 N-CA-C 126.64 5.792 . . . . 0.0 126.64 153.488 . . . . . . . . 5 4 . 1 . 007 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.842 ' HB ' ' CD2' ' A' ' 73' ' ' HIS 0.451 68.2 p -121.8 100.57 7.07 Favored 'General case' 0 CA--C 1.457 -2.621 2 O-C-N 115.382 -4.574 . . . . 0.0 105.764 152.316 . . . . . . . . 4 3 . 1 . 007 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.655 ' HG2' HG21 ' A' ' 106' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.389 -3.5 0 N-CA-C 103.759 -2.682 . . . . 0.0 103.759 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.564 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 13.2 m-80 . . . . . 0 N--CA 1.487 1.39 1 N-CA-C 122.228 4.158 . . . . 0.0 122.228 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.2 p -91.25 -68.17 0.81 Allowed 'General case' 0 N--CA 1.466 0.34 1 C-N-CA 133.071 4.548 . . . . 0.0 112.702 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.64 -13.51 62.11 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 127.261 2.225 . . . . 0.0 111.858 176.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.564 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -82.19 -36.26 13.74 Favored 'Isoleucine or valine' 0 C--N 1.359 1.006 0 C-N-CA 129.814 3.246 . . . . 0.0 108.965 175.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -68.07 -42.67 80.1 Favored 'General case' 0 C--N 1.373 1.627 0 C-N-CA 128.553 2.741 . . . . 0.0 109.144 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.3 mt -61.64 -43.1 96.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.386 0 C-N-CA 126.945 2.098 . . . . 0.0 110.722 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.315 0.7 OUTLIER -62.88 -44.66 95.52 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 171.279 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -62.97 -30.38 71.54 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 166.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -76.65 -50.97 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 128.316 2.646 . . . . 0.0 111.794 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.659 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmtt -62.32 -29.71 70.64 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.518 2.727 . . . . 0.0 109.92 174.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.764 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.7 OUTLIER -66.64 -51.79 52.32 Favored 'General case' 0 C--N 1.369 1.442 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.789 164.475 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -54.62 -37.77 66.01 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 120.173 1.351 . . . . 0.0 112.63 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.659 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.28 0.9 OUTLIER -71.88 -41.64 67.75 Favored 'General case' 0 C--N 1.392 2.44 0 O-C-N 120.407 -1.433 . . . . 0.0 112.508 171.48 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -57.92 -44.64 86.99 Favored 'General case' 0 C--N 1.388 2.242 0 C-N-CA 129.116 2.966 . . . . 0.0 111.775 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.556 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -66.54 -55.28 16.25 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 128.773 2.829 . . . . 0.0 111.513 -178.793 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 22' ' ' PHE . 51.5 mt-10 -75.12 -32.98 61.53 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -73.68 -40.81 63.39 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 126.047 1.739 . . . . 0.0 113.513 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.504 ' HB3' ' CD2' ' A' ' 64' ' ' PHE . 0.8 OUTLIER -73.42 -28.78 62.17 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 125.666 1.586 . . . . 0.0 108.626 170.372 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.486 ' HB2' ' HA ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -57.24 -42.27 81.16 Favored 'General case' 0 C--N 1.377 1.774 0 C-N-CA 124.789 1.236 . . . . 0.0 113.901 165.545 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -59.56 -37.92 79.72 Favored 'General case' 0 C--N 1.377 1.803 0 C-N-CA 124.613 1.165 . . . . 0.0 111.612 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -58.3 -49.27 77.75 Favored 'General case' 0 C--N 1.372 1.581 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 21' ' ' GLU . 2.0 mt -66.32 -42.52 90.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 O-C-N 120.53 -1.356 . . . . 0.0 111.709 176.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -73.97 -27.08 60.81 Favored 'General case' 0 C--N 1.372 1.561 0 O-C-N 121.459 -0.776 . . . . 0.0 111.652 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -70.82 -35.98 72.73 Favored 'General case' 0 C--N 1.375 1.703 0 C-N-CA 126.084 1.754 . . . . 0.0 110.687 172.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.475 ' HG2' ' HG3' ' A' ' 71' ' ' LYS . 17.7 tp10 -69.83 -37.29 76.17 Favored 'General case' 0 C--N 1.383 2.058 0 O-C-N 120.722 -1.236 . . . . 0.0 113.538 170.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.468 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 5.2 mt -65.11 -50.29 75.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 C-N-CA 124.707 1.203 . . . . 0.0 113.322 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -63.01 -32.79 74.23 Favored 'General case' 0 C--N 1.361 1.101 0 CA-C-N 121.778 2.081 . . . . 0.0 114.429 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 21.5 pt-20 -77.33 -43.64 32.33 Favored 'General case' 0 C--N 1.376 1.748 0 O-C-N 118.521 -2.612 . . . . 0.0 111.699 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.12 -41.05 64.42 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 124.316 1.046 . . . . 0.0 113.643 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -71.42 -28.84 64.27 Favored 'General case' 0 C--N 1.352 0.705 0 C-N-CA 125.484 1.513 . . . . 0.0 111.448 175.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -77.92 -38.29 45.85 Favored 'General case' 0 C--N 1.387 2.234 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 166.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.86 62.48 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 126.838 2.055 . . . . 0.0 114.592 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.8 -10.04 59.1 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 124.531 1.133 . . . . 0.0 111.753 166.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.11 17.96 56.67 Favored Glycine 0 C--N 1.379 2.93 0 O-C-N 121.122 -0.986 . . . . 0.0 114.675 167.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.425 HG21 ' OD1' ' A' ' 78' ' ' ASN 0.504 0.6 OUTLIER -94.37 -179.46 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.74 0 C-N-CA 125.814 1.646 . . . . 0.0 114.169 -173.346 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -43.87 -50.43 7.98 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 130.645 3.578 . . . . 0.0 115.658 -177.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.313 1.5 t 90.51 125.82 0.03 OUTLIER 'General case' 0 C--N 1.36 1.039 1 C-N-CA 133.492 4.717 . . . . 0.0 110.489 -177.548 . . . . . . . . 3 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.468 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 3.5 p90 -112.6 154.0 26.69 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 124.701 1.2 . . . . 0.0 109.308 -174.003 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.79 162.93 23.23 Favored 'General case' 0 CA--C 1.494 -1.19 0 CA-C-O 122.868 1.318 . . . . 0.0 111.133 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.66 138.17 52.8 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 120.983 -1.073 . . . . 0.0 109.373 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -132.04 141.85 49.36 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 165.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.73 ' CE1' HD12 ' A' ' 50' ' ' LEU . 1.8 m-85 -101.11 153.8 19.27 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 123.395 1.569 . . . . 0.0 109.563 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 72.6 m -131.8 90.03 2.78 Favored 'General case' 0 CA--C 1.499 -0.993 1 N-CA-C 99.495 -4.261 . . . . 0.0 99.495 168.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -47.79 -9.59 0.02 OUTLIER 'General case' 0 C--O 1.191 -2.025 0 CA-C-O 112.764 -3.493 . . . . 0.0 119.781 -168.975 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.05 61.45 Favored 'General case' 0 N--CA 1.5 2.032 1 CA-C-N 129.487 5.585 . . . . 0.0 119.933 -176.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.741 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.12 -42.77 96.71 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 130.646 3.578 . . . . 0.0 111.622 172.402 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.912 HD23 HD11 ' A' ' 54' ' ' ILE . 1.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 129.381 3.072 . . . . 0.0 109.099 171.287 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 47' ' ' GLN . 98.7 m-20 -58.89 -33.96 71.1 Favored 'General case' 0 C--N 1.365 1.268 0 C-N-CA 130.856 3.663 . . . . 0.0 110.699 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -74.71 -33.11 62.34 Favored 'General case' 0 C--N 1.364 1.225 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 164.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.41 -33.21 58.83 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 119.096 -2.252 . . . . 0.0 116.504 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.912 HD11 HD23 ' A' ' 50' ' ' LEU . 54.2 mt -63.34 -44.4 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.626 1 C-N-CA 133.746 4.818 . . . . 0.0 111.38 175.506 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.427 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -108.2 -24.91 11.32 Favored 'General case' 0 C--N 1.366 1.288 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 173.385 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -83.58 -17.09 42.88 Favored 'General case' 0 C--N 1.363 1.179 0 CA-C-N 123.528 2.876 . . . . 0.0 114.292 -173.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 15.0 pm0 -131.98 -50.62 0.96 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.223 1.409 . . . . 0.0 110.788 175.115 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 54' ' ' ILE 0.456 0.1 OUTLIER 73.8 156.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 C-N-CA 125.62 1.568 . . . . 0.0 111.033 177.55 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.488 ' HA ' HD23 ' A' ' 14' ' ' LEU . 14.4 t70 30.69 50.11 0.09 Allowed 'General case' 0 N--CA 1.52 3.049 0 C-N-CA 131.123 3.769 . . . . 0.0 115.458 -178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' A' ' 57' ' ' GLU 0.446 60.7 mm-40 -86.26 79.61 9.01 Favored 'General case' 0 CA--C 1.485 -1.529 0 CA-C-O 126.949 3.262 . . . . 0.0 109.742 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.309 33.2 p -78.44 -15.56 58.52 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 128.742 2.817 . . . . 0.0 112.769 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.65 ' HE2' HG21 ' A' ' 136' ' ' ILE . 1.1 t80 -68.95 -34.25 75.03 Favored 'General case' 0 C--N 1.358 0.961 1 C-N-CA 131.82 4.048 . . . . 0.0 110.45 169.002 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.521 HG13 ' CZ ' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -64.86 -45.94 93.39 Favored 'Isoleucine or valine' 0 C--N 1.358 0.953 0 C-N-CA 130.901 3.68 . . . . 0.0 106.789 -178.698 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.504 ' CD2' ' HB3' ' A' ' 21' ' ' GLU 0.316 57.5 m-85 -62.57 -41.54 98.98 Favored 'General case' 0 C--O 1.21 -1.006 0 C-N-CA 130.322 3.449 . . . . 0.0 114.778 165.539 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -64.28 -43.04 96.02 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 123.898 3.044 . . . . 0.0 113.575 177.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.734 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.2 tm? -68.14 -41.62 81.33 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 125.064 1.346 . . . . 0.0 114.468 171.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.521 ' CZ ' HG13 ' A' ' 63' ' ' VAL 0.886 0.1 OUTLIER -77.76 -17.06 57.94 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 118.394 -2.691 . . . . 0.0 115.512 172.878 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -78.3 -18.98 54.52 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 127.845 2.458 . . . . 0.0 108.349 163.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -78.13 -33.17 50.57 Favored 'General case' 0 CA--C 1.567 1.611 0 O-C-N 119.978 -1.702 . . . . 0.0 112.085 159.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.0 -46.08 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.914 0 C-N-CA 128.155 2.582 . . . . 0.0 113.342 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.475 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 14.0 pttm -52.46 -16.92 1.0 Allowed 'General case' 0 CA--C 1.502 -0.898 0 C-N-CA 130.512 3.525 . . . . 0.0 118.272 -176.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.277 60.7 m-20 -101.24 -14.14 17.8 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.974 2.109 . . . . 0.0 109.718 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.97 11.93 16.85 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 129.823 3.249 . . . . 0.0 113.059 -171.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.544 ' HA ' HG13 ' A' ' 77' ' ' VAL . 99.5 t -37.89 -31.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.384 2.067 0 C-N-CA 129.103 2.961 . . . . 0.0 115.996 166.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.46 ' H ' HD22 ' A' ' 75' ' ' LEU . 0.4 OUTLIER -69.5 -38.09 77.47 Favored 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 130.388 3.475 . . . . 0.0 114.404 175.311 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -76.43 -33.04 58.8 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.581 1.952 . . . . 0.0 112.101 172.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.544 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.744 0.1 OUTLIER -71.51 -26.77 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.787 0 CA-C-O 126.786 3.184 . . . . 0.0 112.517 169.83 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.425 ' OD1' HG21 ' A' ' 38' ' ' VAL . 72.1 m-20 -70.44 -32.57 70.21 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 128.821 2.848 . . . . 0.0 111.997 163.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -63.72 -30.26 71.38 Favored 'General case' 0 C--N 1.377 1.784 0 C-N-CA 125.336 1.454 . . . . 0.0 112.372 161.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -41.29 98.03 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 124.944 1.298 . . . . 0.0 112.611 163.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 125' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.922 0 C-N-CA 127.628 2.371 . . . . 0.0 115.575 173.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.708 0 CA-C-O 122.62 1.122 . . . . 0.0 114.854 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -131.71 145.82 51.84 Favored 'General case' 0 CA--C 1.506 -0.719 0 O-C-N 119.35 -2.264 . . . . 0.0 110.141 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.8 tp -115.82 135.79 53.67 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.865 2.066 . . . . 0.0 109.886 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -129.4 110.69 12.11 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 103.367 -2.827 . . . . 0.0 103.367 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.486 HD11 ' CE1' ' A' ' 115' ' ' PHE . 21.6 pt -134.52 140.92 44.79 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 C-N-CA 124.776 1.231 . . . . 0.0 110.774 -173.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 23.3 m -127.48 130.58 49.46 Favored 'General case' 0 C--N 1.363 1.179 0 O-C-N 120.1 -1.625 . . . . 0.0 112.131 -176.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.445 ' HB3' ' HB ' ' A' ' 152' ' ' THR . 33.0 t0 -173.75 166.51 4.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.8 -3.037 . . . . 0.0 102.8 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.734 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.33 -38.51 3.2 Favored Glycine 0 C--N 1.351 1.411 0 CA-C-O 123.661 1.701 . . . . 0.0 111.072 172.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 108' ' ' ASP . 29.1 m-80 121.23 -8.85 0.0 OUTLIER 'General case' 0 N--CA 1.422 -1.849 1 C-N-CA 139.497 7.119 . . . . 0.0 108.453 -168.213 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.749 ' HA ' HG23 ' A' ' 136' ' ' ILE 0.641 0.0 OUTLIER -79.26 136.01 36.92 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 130.24 3.416 . . . . 0.0 116.596 177.245 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -97.21 100.48 11.95 Favored 'General case' 0 C--N 1.37 1.463 0 N-CA-C 100.26 -3.978 . . . . 0.0 100.26 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.428 HD22 ' HG ' ' A' ' 111' ' ' LEU . 1.3 pt? -119.25 123.06 43.36 Favored 'General case' 0 C--N 1.361 1.086 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -117.36 142.95 17.7 Favored Glycine 0 C--N 1.355 1.621 0 N-CA-C 106.596 -2.602 . . . . 0.0 106.596 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.486 ' CE1' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -131.85 142.22 49.64 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 176.091 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 31.4 m -125.05 129.63 50.65 Favored 'General case' 0 CA--C 1.485 -1.544 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 -173.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.0 144.05 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 127.147 2.179 . . . . 0.0 108.884 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.309 86.4 m -56.87 107.5 0.41 Allowed 'General case' 0 C--N 1.379 1.867 0 CA-C-N 120.9 1.682 . . . . 0.0 111.593 179.697 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.252 22.7 ttmm -68.81 -40.02 15.94 Favored Pre-proline 0 N--CA 1.444 -0.73 0 CA-C-O 116.057 -1.925 . . . . 0.0 115.28 -170.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.48 59.46 5.51 Favored 'Trans proline' 0 CA--C 1.56 1.778 0 CA-C-N 126.042 3.194 . . . . 0.0 113.071 171.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.258 18.8 p-10 163.71 124.24 0.01 OUTLIER 'General case' 0 C--N 1.367 1.359 0 C-N-CA 129.648 3.179 . . . . 0.0 111.47 178.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -146.46 67.15 1.18 Allowed 'General case' 0 N--CA 1.432 -1.341 0 O-C-N 117.331 -3.356 . . . . 0.0 111.241 168.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -105.42 11.99 32.03 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 126.339 1.855 . . . . 0.0 107.832 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -128.31 150.75 49.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.088 2.555 . . . . 0.0 113.354 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.515 ' HB2' HD22 ' A' ' 81' ' ' LEU 0.266 2.4 mppt? -101.82 -45.62 5.16 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.417 1.487 . . . . 0.0 111.183 178.348 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.3 85.25 6.77 Favored Pre-proline 0 C--N 1.367 1.346 0 C-N-CA 129.058 2.943 . . . . 0.0 108.018 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -81.49 -173.12 1.68 Allowed 'Trans proline' 0 CA--C 1.497 -1.342 1 C-N-CA 132.652 8.901 . . . . 0.0 114.106 -177.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.6 p -98.44 138.94 34.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 100.375 -3.935 . . . . 0.0 100.375 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.7 134.91 42.97 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 121.136 1.789 . . . . 0.0 106.629 -167.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' A' ' 118' ' ' CYS 0.252 1.1 pt20 -95.85 66.59 2.65 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 125.486 1.514 . . . . 0.0 109.538 -169.407 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.309 2.1 p 98.68 148.65 0.02 OUTLIER 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.409 1.884 . . . . 0.0 109.669 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -115.09 124.16 50.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 101.164 -3.643 . . . . 0.0 101.164 165.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.486 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . 4.3 ttp -102.95 108.25 19.36 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -121.72 115.16 22.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.605 1.162 . . . . 0.0 108.439 -175.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.7 mm -139.1 136.38 42.16 Favored 'Isoleucine or valine' 0 C--N 1.363 1.186 0 N-CA-C 105.658 -1.979 . . . . 0.0 105.658 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -133.65 -179.39 3.31 Favored 'Isoleucine or valine' 0 C--N 1.351 0.651 0 C-N-CA 127.196 2.198 . . . . 0.0 112.822 -172.706 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.647 ' H ' HG22 ' A' ' 136' ' ' ILE . 25.6 p-10 -135.53 149.52 49.49 Favored 'General case' 0 CA--C 1.557 1.224 1 C-N-CA 135.418 5.487 . . . . 0.0 106.972 167.199 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.436 ' HB2' HD23 ' A' ' 141' ' ' LEU . 51.4 m -164.67 -103.54 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.65 ' CD ' ' HG2' ' A' ' 140' ' ' ARG 0.258 0.0 OUTLIER -118.15 -66.69 1.05 Allowed 'General case' 0 C--N 1.355 0.815 0 C-N-CA 129.671 3.188 . . . . 0.0 113.608 -160.264 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.65 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 12.2 ptp180 -105.66 2.14 27.85 Favored 'General case' 0 CA--C 1.497 -1.079 1 C-N-CA 133.684 4.794 . . . . 0.0 108.659 174.617 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.436 HD23 ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER . . . . . 0 CA--C 1.574 1.895 0 CA-C-O 114.514 -2.66 . . . . 0.0 106.387 -152.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.752 HD11 ' H ' ' A' ' 153' ' ' GLN . 0.4 OUTLIER . . . . . 0 C--O 1.218 -0.578 0 N-CA-C 104.946 -2.242 . . . . 0.0 104.946 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.354 21.3 mttp -93.42 137.13 33.03 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 123.717 2.962 . . . . 0.0 104.382 153.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.445 ' HB ' ' HB3' ' A' ' 108' ' ' ASP 0.355 1.0 OUTLIER -79.17 116.1 19.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 120.033 3.346 . . . . 0.0 120.033 -140.332 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.752 ' H ' HD11 ' A' ' 150' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.433 2 C-N-CA 135.765 5.626 . . . . 0.0 122.93 -173.79 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.521 ' HA ' HG13 ' A' ' 7' ' ' VAL . 5.3 m120 . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 120.26 3.43 . . . . 0.0 120.26 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -58.37 4.31 Favored 'General case' 0 C--O 1.24 0.589 1 C-N-CA 133.172 4.589 . . . . 0.0 111.048 173.004 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -73.55 -13.62 61.06 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.096 1.759 . . . . 0.0 113.07 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.521 HG13 ' HA ' ' A' ' 4' ' ' ASN . 0.7 OUTLIER -84.88 -31.61 7.19 Favored 'Isoleucine or valine' 0 C--N 1.358 0.946 0 C-N-CA 127.808 2.443 . . . . 0.0 110.214 176.605 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.3 -38.39 71.76 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 127.567 2.347 . . . . 0.0 108.413 174.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -61.07 -44.65 98.69 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.887 164.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 1.2 mmp_? -61.4 -47.46 85.7 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 120.951 1.705 . . . . 0.0 113.916 171.439 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -56.83 -27.29 59.94 Favored 'General case' 0 C--N 1.376 1.736 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 164.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -76.77 -50.68 12.96 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 119.486 -2.009 . . . . 0.0 111.877 171.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -56.83 -28.4 61.5 Favored 'General case' 0 C--N 1.376 1.721 0 C-N-CA 126.828 2.051 . . . . 0.0 112.754 171.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.452 ' O ' HD22 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -73.62 -46.56 46.13 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 113.755 -1.566 . . . . 0.0 111.621 170.256 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.434 4.2 ptp180 -58.22 -36.28 72.92 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.16 -1.587 . . . . 0.0 114.586 173.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.9 mtt180 -64.19 -41.96 96.87 Favored 'General case' 0 C--N 1.384 2.069 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 162.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.502 ' CD2' HG22 ' A' ' 61' ' ' THR 0.251 3.0 t60 -62.22 -47.97 82.08 Favored 'General case' 0 C--N 1.383 2.024 0 C-N-CA 127.941 2.496 . . . . 0.0 114.392 174.473 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -59.06 -53.77 54.62 Favored 'General case' 0 C--N 1.369 1.449 1 C-N-CA 132.883 4.473 . . . . 0.0 108.8 177.885 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -70.65 -46.64 62.9 Favored 'General case' 0 C--N 1.37 1.48 0 N-CA-C 118.556 2.799 . . . . 0.0 118.556 173.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m -66.29 -38.58 88.11 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 119.597 -1.94 . . . . 0.0 114.053 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.541 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.327 4.6 mp0 -77.11 -29.15 54.68 Favored 'General case' 0 C--N 1.362 1.113 0 O-C-N 120.708 -1.245 . . . . 0.0 111.013 172.207 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.3 -36.81 83.27 Favored 'General case' 0 C--N 1.387 2.202 0 O-C-N 120.178 -1.576 . . . . 0.0 114.137 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -68.09 -34.91 77.29 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 124.745 1.218 . . . . 0.0 110.47 169.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -63.49 -45.75 89.26 Favored 'General case' 0 C--N 1.364 1.223 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 169.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.51 HG21 HH22 ' A' ' 132' ' ' ARG . 2.1 mt -71.3 -45.48 69.87 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 O-C-N 119.277 -2.14 . . . . 0.0 111.795 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.539 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.336 48.8 m-20 -75.03 -23.75 58.22 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 120.87 -1.144 . . . . 0.0 112.391 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -75.84 -38.46 58.02 Favored 'General case' 0 C--N 1.382 2.012 0 CA-C-O 116.768 -1.587 . . . . 0.0 110.561 165.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.491 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 16.4 tp10 -65.97 -35.68 81.25 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-N 122.965 2.621 . . . . 0.0 115.793 172.004 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.542 HD13 ' CE2' ' A' ' 41' ' ' PHE 0.38 0.7 OUTLIER -73.06 -39.68 57.63 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 115.135 1.532 . . . . 0.0 115.135 174.625 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -74.4 -31.81 62.47 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 171.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.491 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 8.6 pt-20 -77.38 -38.06 50.76 Favored 'General case' 0 C--N 1.374 1.637 0 O-C-N 118.282 -2.762 . . . . 0.0 110.81 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.58 ' HB3' HG21 ' A' ' 74' ' ' VAL . . . -77.27 -36.5 54.31 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.428 1.091 . . . . 0.0 111.899 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.1 t -68.28 -35.45 77.88 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 121.213 -0.929 . . . . 0.0 110.346 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.05 -39.42 69.07 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.83 -28.38 61.58 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 126.48 1.912 . . . . 0.0 115.375 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.95 -15.58 58.11 Favored 'General case' 0 C--N 1.385 2.141 0 C-N-CA 124.75 1.22 . . . . 0.0 110.943 171.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 17.53 59.34 Favored Glycine 0 C--N 1.376 2.779 0 N-CA-C 114.994 0.757 . . . . 0.0 114.994 166.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.505 HG21 ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -109.82 151.76 12.01 Favored 'Isoleucine or valine' 0 C--N 1.36 1.023 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 178.557 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.453 ' HB2' ' CD1' ' A' ' 81' ' ' LEU 0.52 7.7 m -20.74 -47.72 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.743 2 N-CA-C 125.715 5.45 . . . . 0.0 125.715 -167.267 . . . . . . . . 4 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.343 93.7 p 87.35 137.59 0.04 OUTLIER 'General case' 0 CA--C 1.501 -0.919 1 C-N-CA 131.758 4.023 . . . . 0.0 109.543 -178.502 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.542 ' CE2' HD13 ' A' ' 29' ' ' ILE . 9.7 p90 -112.51 140.53 47.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 -175.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.423 ' O ' ' HA ' ' A' ' 128' ' ' SER . 71.1 m80 -101.96 104.61 15.31 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -175.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.401 HD13 HD12 ' A' ' 129' ' ' LEU 0.294 0.3 OUTLIER -105.68 161.18 14.61 Favored 'General case' 0 CA--C 1.504 -0.791 0 O-C-N 116.863 -3.648 . . . . 0.0 115.451 -175.529 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -135.75 153.37 51.58 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.416 3.0 p90 -108.36 135.36 49.78 Favored 'General case' 0 C--N 1.36 1.03 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 167.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.449 ' O ' HD21 ' A' ' 49' ' ' LEU . 15.9 m -106.35 133.41 51.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 174.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -80.82 -10.76 59.69 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 121.717 3.969 . . . . 0.0 121.717 -170.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.47 -48.03 74.05 Favored 'General case' 0 N--CA 1.495 1.778 1 CA-C-N 126.582 4.265 . . . . 0.0 117.054 -175.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.83 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.47 -34.81 78.58 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-O 128.031 3.777 . . . . 0.0 113.804 174.954 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.83 ' H ' HD22 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -72.84 -44.87 60.88 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 109.729 -3.396 . . . . 0.0 108.887 171.378 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.463 ' HA ' ' CG2' ' A' ' 54' ' ' ILE . 19.6 t70 -55.77 -30.03 60.6 Favored 'General case' 0 C--N 1.37 1.467 0 C-N-CA 127.818 2.447 . . . . 0.0 109.665 -179.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.4 ttm-85 -68.16 -55.96 10.48 Favored 'General case' 0 C--N 1.375 1.714 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 157.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.35 71.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 120.603 3.557 . . . . 0.0 120.603 -177.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.724 HD12 HD21 ' A' ' 50' ' ' LEU . 5.4 tt -75.36 -39.65 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 1 C-N-CA 131.962 4.105 . . . . 0.0 110.619 178.635 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.569 ' HG2' HG23 ' A' ' 54' ' ' ILE . 19.3 mm-40 -107.82 -22.43 12.46 Favored 'General case' 0 C--N 1.373 1.617 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -86.5 10.11 16.28 Favored 'General case' 0 C--N 1.377 1.768 0 CA-C-N 122.597 2.453 . . . . 0.0 113.82 -172.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -155.13 -52.85 0.09 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 125.794 1.638 . . . . 0.0 108.88 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.403 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.507 0.0 OUTLIER 75.85 160.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.373 1.629 0 C-N-CA 126.565 1.946 . . . . 0.0 110.125 -179.727 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.451 ' N ' ' HG ' ' A' ' 14' ' ' LEU . 20.8 t70 34.87 45.63 0.16 Allowed 'General case' 0 N--CA 1.512 2.629 1 C-N-CA 131.821 4.048 . . . . 0.0 113.045 -175.244 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.43 ' O ' HG12 ' A' ' 63' ' ' VAL 0.622 0.0 OUTLIER -83.38 68.64 9.79 Favored 'General case' 0 C--O 1.206 -1.201 0 C-N-CA 128.018 2.527 . . . . 0.0 109.971 -178.233 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.502 HG22 ' CD2' ' A' ' 17' ' ' HIS 0.292 23.4 p -79.51 -18.19 52.44 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 130.354 3.461 . . . . 0.0 112.896 177.785 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -65.26 -33.72 76.66 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 131.467 3.907 . . . . 0.0 111.009 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.594 HG23 HD21 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -60.07 -47.43 91.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.24 0 C-N-CA 130.712 3.605 . . . . 0.0 108.351 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.541 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.297 29.2 m-85 -64.61 -40.63 95.84 Favored 'General case' 0 CA--C 1.494 -1.174 1 C-N-CA 134.569 5.148 . . . . 0.0 113.628 171.585 . . . . . . . . 4 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -65.35 -45.26 84.9 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.565 2.346 . . . . 0.0 114.414 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.562 HD12 HD21 ' A' ' 113' ' ' LEU . 3.2 tm? -66.57 -51.04 60.83 Favored 'General case' 0 CA--C 1.567 1.617 0 C-N-CA 124.888 1.275 . . . . 0.0 112.166 171.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.749 0.0 OUTLIER -72.08 -14.71 61.92 Favored 'General case' 0 C--N 1.379 1.864 1 O-C-N 116.155 -4.091 . . . . 0.0 112.417 177.476 . . . . . . . . 5 4 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -75.82 -27.6 57.97 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 129.124 2.969 . . . . 0.0 111.136 165.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.336 43.6 mmtm -69.1 -27.02 65.23 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.269 -1.52 . . . . 0.0 109.836 159.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 153' ' ' GLN 0.495 5.5 mt -70.39 -9.08 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 N-CA-C 119.296 3.072 . . . . 0.0 119.296 166.544 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.445 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 16.3 pttm -75.21 -13.38 60.44 Favored 'General case' 0 CA--C 1.512 -0.517 1 O-C-N 116.027 -4.171 . . . . 0.0 114.054 177.97 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.381 70.4 m-20 -92.84 -27.31 17.22 Favored 'General case' 0 N--CA 1.432 -1.369 0 C-N-CA 129.422 3.089 . . . . 0.0 112.694 -178.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.457 ' CD2' HG12 ' A' ' 70' ' ' ILE . 3.6 t-80 -70.93 -1.09 10.76 Favored 'General case' 0 CA--C 1.493 -1.228 1 C-N-CA 135.012 5.325 . . . . 0.0 115.544 -170.773 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.58 HG21 ' HB3' ' A' ' 32' ' ' ALA . 55.0 t -27.33 -45.25 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.361 1.075 1 C-N-CA 132.104 4.162 . . . . 0.0 117.502 169.424 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.13 -31.39 62.73 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.458 2.303 . . . . 0.0 112.753 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -75.38 -43.26 51.16 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 126.415 1.886 . . . . 0.0 111.926 176.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.306 8.6 p -70.15 -31.2 46.59 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 C-N-CA 126.709 2.004 . . . . 0.0 110.804 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.505 ' HB3' HG21 ' A' ' 38' ' ' VAL . 49.0 m-20 -71.9 -30.65 65.6 Favored 'General case' 0 C--N 1.357 0.93 0 O-C-N 119.293 -2.13 . . . . 0.0 115.373 169.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -68.89 -34.62 75.72 Favored 'General case' 0 C--N 1.37 1.484 0 O-C-N 118.08 -2.887 . . . . 0.0 109.551 165.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.49 9.6 t80 -73.53 -4.39 33.61 Favored 'General case' 0 C--N 1.367 1.338 1 C-N-CA 131.779 4.032 . . . . 0.0 115.678 171.634 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.628 HD13 ' HB3' ' A' ' 125' ' ' LYS . 2.1 mt . . . . . 0 N--CA 1.503 2.178 0 C-N-CA 130.867 3.667 . . . . 0.0 113.152 -172.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.519 0 N-CA-C 117.154 1.622 . . . . 0.0 117.154 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.573 ' HE ' ' HG2' ' A' ' 120' ' ' PRO . 93.6 mtt180 -132.95 144.05 49.87 Favored 'General case' 0 C--N 1.351 0.668 0 N-CA-C 100.336 -3.95 . . . . 0.0 100.336 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.5 pp -120.79 147.94 44.67 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.201 -0.937 . . . . 0.0 112.333 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.422 ' HA ' ' HA2' ' A' ' 114' ' ' GLY . 41.2 tt0 -130.24 120.64 24.77 Favored 'General case' 0 C--N 1.368 1.397 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 178.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 6.3 pt -134.64 138.23 49.85 Favored 'Isoleucine or valine' 0 C--N 1.35 0.604 0 C-N-CA 125.089 1.355 . . . . 0.0 109.723 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.4 t -118.62 129.22 55.2 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 -178.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.403 ' HB2' HG13 ' A' ' 150' ' ' ILE . 6.4 t0 -154.5 -174.74 5.09 Favored 'General case' 0 C--N 1.367 1.346 0 N-CA-C 102.253 -3.24 . . . . 0.0 102.253 174.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.0 -66.65 3.9 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 119.23 -2.169 . . . . 0.0 113.547 173.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 159.64 -31.4 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.066 1 C-N-CA 139.902 7.281 . . . . 0.0 104.209 -163.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.833 ' HG ' HG23 ' A' ' 136' ' ' ILE . 4.5 mp -78.53 137.23 37.81 Favored 'General case' 0 C--N 1.368 1.393 1 C-N-CA 133.845 4.858 . . . . 0.0 121.064 -171.129 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -94.2 103.34 15.38 Favored 'General case' 0 C--N 1.375 1.676 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 164.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.562 HD21 HD12 ' A' ' 66' ' ' LEU . 3.1 mm? -100.12 133.51 44.41 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 105' ' ' GLU . . . -110.21 141.52 16.28 Favored Glycine 0 C--N 1.343 0.937 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 173.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -129.16 133.91 47.8 Favored 'General case' 0 C--N 1.353 0.755 1 N-CA-C 99.403 -4.295 . . . . 0.0 99.403 179.041 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 42.1 p -134.37 137.65 44.28 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 -171.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . 0.27 1.6 p -92.02 151.72 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 C-N-CA 125.39 1.476 . . . . 0.0 112.602 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 15.5 p -58.73 97.94 0.03 OUTLIER 'General case' 0 C--N 1.39 2.348 0 C-N-CA 128.063 2.545 . . . . 0.0 113.583 -177.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.597 17.8 ptpt 46.52 86.66 0.13 Allowed Pre-proline 0 C--N 1.351 0.651 0 C-N-CA 129.1 2.96 . . . . 0.0 115.501 -165.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.573 ' HG2' ' HE ' ' A' ' 103' ' ' ARG . 4.9 Cg_exo -45.33 108.87 0.15 Allowed 'Trans proline' 0 C--N 1.364 1.368 1 C-N-CA 125.914 4.409 . . . . 0.0 118.863 -159.625 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -157.95 149.76 21.82 Favored 'General case' 0 C--N 1.364 1.216 0 C-N-CA 130.056 3.342 . . . . 0.0 109.268 -169.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -146.52 100.47 3.35 Favored 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 123.181 1.467 . . . . 0.0 110.11 166.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -108.1 -7.39 16.09 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.554 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.437 17.4 m-85 -157.0 176.01 13.33 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -164.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.628 ' HB3' HD13 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -138.28 104.99 5.34 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 103.641 -2.725 . . . . 0.0 103.641 177.841 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.9 t70 160.28 -25.89 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.542 0 C-N-CA 129.567 3.147 . . . . 0.0 115.94 -167.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.343 76.1 Cg_exo -53.12 -178.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.385 2.474 1 C-N-CA 127.638 5.559 . . . . 0.0 119.131 -179.195 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' SER . . . . . 0.423 ' HA ' ' O ' ' A' ' 42' ' ' HIS . 30.2 t -103.29 152.37 21.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.335 2.254 . . . . 0.0 109.392 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.401 HD12 HD13 ' A' ' 43' ' ' LEU . 20.2 mt -102.34 130.85 49.19 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 177.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -89.53 38.55 0.91 Allowed 'General case' 0 C--N 1.383 2.042 0 C-N-CA 128.427 2.691 . . . . 0.0 111.26 -163.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 19.5 t 98.66 143.93 0.02 OUTLIER 'General case' 0 C--N 1.371 1.521 0 C-N-CA 125.754 1.622 . . . . 0.0 106.929 -168.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.51 HH22 HG21 ' A' ' 25' ' ' ILE . 38.1 mtm180 -107.18 122.37 46.39 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 100.452 -3.907 . . . . 0.0 100.452 168.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.444 ' SD ' ' HB2' ' A' ' 49' ' ' LEU . 1.6 tmm? -93.02 118.67 31.45 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 104.313 -2.477 . . . . 0.0 104.313 -174.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -124.67 114.96 20.01 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . 0.267 80.4 mt -140.08 148.59 22.53 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.833 HG23 ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -133.96 -178.76 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 124.877 2.275 . . . . 0.0 110.461 -169.129 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.686 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.3 OUTLIER -157.28 138.67 13.79 Favored 'General case' 0 N--CA 1.441 -0.89 1 C-N-CA 134.268 5.027 . . . . 0.0 102.02 176.416 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.527 ' HB2' ' HG ' ' A' ' 141' ' ' LEU . 0.9 OUTLIER -164.91 -115.07 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 120.137 3.384 . . . . 0.0 120.137 -168.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.635 ' CD ' ' HG2' ' A' ' 140' ' ' ARG 0.25 0.0 OUTLIER -103.44 -69.48 0.8 Allowed 'General case' 0 C--N 1.354 0.763 1 C-N-CA 133.515 4.726 . . . . 0.0 114.594 -159.482 . . . . . . . . 5 4 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.635 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 12.5 ptp180 -111.55 9.92 21.22 Favored 'General case' 0 N--CA 1.446 -0.647 1 C-N-CA 133.05 4.54 . . . . 0.0 107.25 173.95 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.623 HD23 ' CD ' ' A' ' 139' ' ' ARG . 0.3 OUTLIER . . . . . 0 CA--C 1.574 1.868 0 CA-C-O 115.658 -2.115 . . . . 0.0 106.878 -156.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.564 HD12 ' O ' ' A' ' 151' ' ' LYS 0.424 0.1 OUTLIER . . . . . 0 CA--C 1.546 0.795 1 N-CA-C 125.988 5.551 . . . . 0.0 125.988 . . . . . . . . . 4 3 . 1 . 009 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.564 ' O ' HD12 ' A' ' 150' ' ' ILE 0.324 0.0 OUTLIER -78.92 149.04 32.48 Favored 'General case' 0 CA--C 1.496 -1.116 1 C-N-CA 140.861 7.664 . . . . 0.0 101.059 159.66 . . . . . . . . 5 4 . 1 . 009 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.608 ' O ' HG23 ' A' ' 152' ' ' THR . 11.7 t -79.35 97.21 6.23 Favored 'General case' 0 CA--C 1.566 1.561 1 CA-C-O 129.689 4.566 . . . . 0.0 111.108 168.76 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.563 ' HB2' HD11 ' A' ' 70' ' ' ILE . 10.5 tt0 . . . . . 1 N--CA 1.37 -4.46 2 C-N-CA 138.226 6.611 . . . . 0.0 106.838 173.063 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.615 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.366 10.8 t-20 . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 120.306 3.447 . . . . 0.0 120.306 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.05 -59.2 2.56 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 130.894 3.678 . . . . 0.0 111.145 172.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.77 -12.31 61.48 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 128.142 2.577 . . . . 0.0 112.47 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.615 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.7 t -88.43 -30.11 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 C-N-CA 130.508 3.523 . . . . 0.0 108.39 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.4 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 45.2 t80 -73.57 -42.11 62.04 Favored 'General case' 0 C--N 1.369 1.426 0 C-N-CA 125.778 1.631 . . . . 0.0 109.038 174.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.69 -42.91 93.75 Favored 'Isoleucine or valine' 0 C--N 1.369 1.433 0 C-N-CA 126.958 2.103 . . . . 0.0 110.875 168.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.289 11.4 tpp180 -65.07 -47.29 77.81 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.4 mtm180 -57.89 -31.82 67.12 Favored 'General case' 0 C--N 1.379 1.849 0 C-N-CA 128.77 2.828 . . . . 0.0 117.507 167.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -77.15 -46.62 22.81 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 127.384 2.273 . . . . 0.0 110.683 170.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.64 ' HA ' ' HG3' ' A' ' 16' ' ' ARG 0.337 31.1 mtpt -59.3 -28.42 66.75 Favored 'General case' 0 C--N 1.367 1.341 0 C-N-CA 126.646 1.979 . . . . 0.0 111.36 172.271 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.6 OUTLIER -71.81 -49.31 39.72 Favored 'General case' 0 C--O 1.21 -1.018 0 C-N-CA 125.504 1.522 . . . . 0.0 111.591 169.474 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.386 15.5 ptt180 -55.78 -33.34 64.27 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 170.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.64 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.292 0.1 OUTLIER -75.43 -38.16 59.96 Favored 'General case' 0 C--N 1.399 2.747 0 O-C-N 120.393 -1.442 . . . . 0.0 113.772 167.009 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.296 89.6 m-70 -56.93 -44.89 82.93 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 130.177 3.391 . . . . 0.0 109.402 172.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.602 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -65.51 -53.49 41.71 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 129.78 3.232 . . . . 0.0 110.802 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -69.07 -40.01 78.74 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.3 m -73.56 -35.47 65.47 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.861 2.064 . . . . 0.0 112.371 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.536 ' HB3' ' CD2' ' A' ' 64' ' ' PHE 0.281 50.7 mt-10 -77.3 -29.09 53.52 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 119.279 -2.138 . . . . 0.0 109.988 168.976 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -34.21 74.64 Favored 'General case' 0 C--N 1.376 1.72 0 O-C-N 119.196 -2.19 . . . . 0.0 112.637 169.232 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.321 7.4 ptm180 -69.65 -35.91 75.6 Favored 'General case' 0 C--N 1.375 1.7 0 CA-C-O 118.17 -0.919 . . . . 0.0 113.473 164.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -59.46 -50.41 74.03 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.3 mt -71.77 -44.56 68.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 C-N-CA 125.475 1.51 . . . . 0.0 110.35 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.596 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.625 0.0 OUTLIER -70.15 -24.11 63.11 Favored 'General case' 0 C--N 1.375 1.679 0 O-C-N 119.396 -2.065 . . . . 0.0 114.247 174.443 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -75.02 -37.35 61.8 Favored 'General case' 0 C--N 1.375 1.693 0 O-C-N 119.683 -1.886 . . . . 0.0 112.879 170.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.505 ' HA ' ' HG2' ' A' ' 31' ' ' GLU 0.451 0.0 OUTLIER -69.3 -34.4 74.62 Favored 'General case' 0 C--N 1.402 2.89 0 CA-C-N 122.816 2.553 . . . . 0.0 113.735 172.866 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.73 HD13 ' CE1' ' A' ' 41' ' ' PHE 0.257 2.2 pp -67.19 -44.94 87.42 Favored 'Isoleucine or valine' 0 C--N 1.387 2.202 0 C-N-CA 124.624 1.169 . . . . 0.0 112.183 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -61.25 -38.57 87.18 Favored 'General case' 0 C--N 1.363 1.167 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 170.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.9 pt-20 -76.87 -41.57 43.34 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 119.432 -2.043 . . . . 0.0 113.031 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB3' HG21 ' A' ' 74' ' ' VAL . . . -73.46 -39.66 64.76 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.3 t -71.46 -35.5 70.89 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.896 1.278 . . . . 0.0 110.356 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -70.4 -38.0 74.59 Favored 'General case' 0 C--N 1.388 2.244 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 167.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.42 62.41 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.298 1.839 . . . . 0.0 114.251 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.25 -18.9 61.18 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 120.018 1.281 . . . . 0.0 112.162 170.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.14 18.23 47.39 Favored Glycine 0 C--N 1.376 2.753 0 CA-C-O 121.82 0.678 . . . . 0.0 113.355 168.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.511 HG23 HD22 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -119.89 162.76 18.0 Favored 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 123.774 0.83 . . . . 0.0 109.343 -175.212 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 22.67 -51.09 0.0 OUTLIER 'General case' 0 C--N 1.371 1.504 1 C-N-CA 137.974 6.51 . . . . 0.0 120.718 176.665 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.2 m 72.75 92.48 0.08 Allowed 'General case' 0 C--N 1.364 1.209 0 C-N-CA 131.141 3.776 . . . . 0.0 109.737 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.73 ' CE1' HD13 ' A' ' 29' ' ' ILE . 36.7 p90 -113.96 140.87 48.05 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 122.019 0.914 . . . . 0.0 111.568 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -102.71 167.64 9.77 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 129.163 2.985 . . . . 0.0 105.114 170.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.397 2.8 pp -122.64 156.6 33.99 Favored 'General case' 0 CA--C 1.495 -1.162 0 O-C-N 119.639 -1.913 . . . . 0.0 110.829 167.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -138.83 146.01 40.74 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 100.33 -3.952 . . . . 0.0 100.33 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -142.66 151.8 41.77 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 121.719 0.771 . . . . 0.0 110.151 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.3 t -105.23 140.62 38.11 Favored 'General case' 0 C--N 1.358 0.952 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . 0.327 7.4 mm-40 -80.82 -9.27 59.83 Favored 'General case' 0 C--O 1.203 -1.369 0 C-N-CA 127.874 2.47 . . . . 0.0 116.309 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.06 -48.3 82.38 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 125.731 3.878 . . . . 0.0 118.367 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.676 HD23 ' H ' ' A' ' 134' ' ' ALA . 0.0 OUTLIER -64.81 -34.23 77.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-O 125.024 2.345 . . . . 0.0 112.365 172.799 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.755 ' CD2' HD11 ' A' ' 54' ' ' ILE 0.292 0.7 OUTLIER -68.09 -44.43 76.26 Favored 'General case' 0 C--O 1.196 -1.729 0 C-N-CA 129.671 3.188 . . . . 0.0 107.03 172.79 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -54.58 -37.83 65.99 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 129.461 3.104 . . . . 0.0 111.253 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -71.87 -39.34 69.7 Favored 'General case' 0 C--N 1.374 1.645 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 163.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.66 95.03 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 124.607 3.367 . . . . 0.0 115.345 170.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.755 HD11 ' CD2' ' A' ' 50' ' ' LEU . 56.7 mt -58.8 -45.79 91.22 Favored 'Isoleucine or valine' 0 C--N 1.368 1.389 1 C-N-CA 133.686 4.795 . . . . 0.0 112.562 176.925 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -106.99 -21.89 12.85 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 118.659 2.836 . . . . 0.0 118.659 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.4 ttp-105 -87.32 -30.91 20.48 Favored 'General case' 0 C--N 1.366 1.305 0 CA-C-N 123.893 3.042 . . . . 0.0 111.498 -178.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.705 ' HA ' HD22 ' A' ' 141' ' ' LEU . 23.4 mt-10 -102.75 -57.56 2.03 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.689 1.595 . . . . 0.0 111.309 -176.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.457 HD12 ' N ' ' A' ' 59' ' ' ASP 0.557 0.2 OUTLIER 55.44 135.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 C-N-CA 129.152 2.981 . . . . 0.0 114.379 178.475 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.457 ' N ' HD12 ' A' ' 58' ' ' ILE 0.718 32.8 t70 61.07 25.26 15.3 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 127.784 2.433 . . . . 0.0 113.73 -174.54 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.534 ' O ' HG12 ' A' ' 63' ' ' VAL 0.873 0.4 OUTLIER -65.42 58.31 0.03 OUTLIER 'General case' 0 C--O 1.2 -1.539 0 C-N-CA 129.597 3.159 . . . . 0.0 117.314 -177.09 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.503 1.7 p -78.6 -10.01 59.58 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 130.977 3.711 . . . . 0.0 114.681 174.05 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 136' ' ' ILE . 71.1 t80 -68.18 -34.23 75.91 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.238 3.015 . . . . 0.0 108.156 165.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 60' ' ' GLU 0.279 0.4 OUTLIER -62.87 -46.04 97.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.362 0 C-N-CA 129.623 3.169 . . . . 0.0 107.929 177.957 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.536 ' CD2' ' HB3' ' A' ' 21' ' ' GLU . 85.1 m-85 -61.44 -32.61 72.59 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 131.678 3.991 . . . . 0.0 115.175 164.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -73.61 -43.44 59.64 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-N 123.63 2.923 . . . . 0.0 112.016 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.642 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 0.9 OUTLIER -70.64 -40.32 73.13 Favored 'General case' 0 CA--C 1.559 1.324 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.968 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.913 0.0 OUTLIER -77.76 -16.28 58.51 Favored 'General case' 0 C--N 1.377 1.787 0 O-C-N 119.972 -1.705 . . . . 0.0 114.754 176.315 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.432 ' CD2' ' O ' ' A' ' 64' ' ' PHE . 31.3 m-70 -76.29 -30.24 57.69 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.972 2.509 . . . . 0.0 108.622 163.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -72.26 -25.49 61.63 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.473 -2.017 . . . . 0.0 112.301 163.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.429 HG13 ' HA ' ' A' ' 67' ' ' PHE . 1.0 OUTLIER -74.68 -31.63 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 C-N-CA 128.463 2.705 . . . . 0.0 111.581 172.339 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 pttp -52.68 -24.54 8.75 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 129.949 3.299 . . . . 0.0 118.676 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.267 35.8 t70 -97.37 -27.24 14.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.155 2.182 . . . . 0.0 109.513 -175.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.505 ' CE1' ' H ' ' A' ' 152' ' ' THR . 16.0 m-70 -77.28 6.79 6.09 Favored 'General case' 0 C--N 1.368 1.377 1 C-N-CA 132.454 4.302 . . . . 0.0 114.708 -174.501 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 32' ' ' ALA . 93.0 t -36.72 -35.68 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 C-N-CA 129.16 2.984 . . . . 0.0 115.915 166.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.417 HD22 ' H ' ' A' ' 75' ' ' LEU . 0.8 OUTLIER -70.29 -34.25 72.53 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.783 -1.823 . . . . 0.0 113.6 177.651 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 79' ' ' GLU 0.323 35.0 mt-10 -76.41 -34.04 58.81 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.294 1.438 . . . . 0.0 113.794 171.715 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.345 1.9 m -70.72 -36.96 67.24 Favored 'Isoleucine or valine' 0 C--N 1.377 1.785 0 CA-C-O 125.439 2.542 . . . . 0.0 110.68 172.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.564 ' O ' HD23 ' A' ' 81' ' ' LEU . 1.7 m120 -65.34 -32.41 74.03 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 128.107 2.563 . . . . 0.0 112.559 169.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 76' ' ' GLU 0.404 5.6 pt-20 -71.5 -29.66 65.05 Favored 'General case' 0 C--N 1.369 1.439 0 O-C-N 117.7 -3.125 . . . . 0.0 112.33 164.464 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -74.41 -5.59 43.29 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 128.14 2.576 . . . . 0.0 114.197 168.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 78' ' ' ASN . 2.9 pp . . . . . 0 N--CA 1.508 2.43 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 -164.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.939 0 CA-C-O 121.7 0.611 . . . . 0.0 113.701 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -137.01 158.01 45.44 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 120.467 -1.607 . . . . 0.0 111.411 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.665 HD23 HD11 ' A' ' 106' ' ' ILE . 12.7 tp -133.02 151.77 52.03 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.397 1.879 . . . . 0.0 113.132 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -125.92 118.2 24.91 Favored 'General case' 0 C--N 1.369 1.433 0 N-CA-C 103.649 -2.722 . . . . 0.0 103.649 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.665 HD11 HD23 ' A' ' 104' ' ' LEU . 1.0 OUTLIER -122.95 119.19 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 126.882 2.073 . . . . 0.0 106.676 -174.173 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.9 m -127.21 108.23 10.71 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.417 ' CG ' HD21 ' A' ' 66' ' ' LEU . 53.0 t0 -159.17 161.61 36.23 Favored 'General case' 0 CA--C 1.482 -1.657 0 N-CA-C 101.087 -3.671 . . . . 0.0 101.087 -172.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.642 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 83.8 -38.0 2.81 Favored Glycine 0 N--CA 1.474 1.222 0 O-C-N 119.708 -1.87 . . . . 0.0 114.251 174.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 108.95 0.3 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.613 1 C-N-CA 136.157 5.783 . . . . 0.0 108.19 -161.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.839 ' HA ' HG23 ' A' ' 136' ' ' ILE . 2.3 tp -79.78 129.36 34.41 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 128.867 2.867 . . . . 0.0 109.264 175.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.7 m95 -96.73 100.97 12.5 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 170.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.319 2.0 mm? -97.26 131.24 44.17 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 173.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -105.92 125.3 8.15 Favored Glycine 0 C--N 1.351 1.394 0 N-CA-C 107.234 -2.346 . . . . 0.0 107.234 162.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.565 ' CE1' HD12 ' A' ' 106' ' ' ILE 0.294 1.0 OUTLIER -118.56 152.54 35.82 Favored 'General case' 0 C--N 1.374 1.667 0 CA-C-N 122.373 3.087 . . . . 0.0 106.712 179.163 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.7 m -122.27 137.8 54.72 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 100.438 -3.912 . . . . 0.0 100.438 166.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.22 128.64 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.369 0 N-CA-C 100.702 -3.814 . . . . 0.0 100.702 165.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.438 ' HB2' HD22 ' A' ' 121' ' ' ASN . 14.2 p 40.31 -137.4 0.12 Allowed 'General case' 0 C--N 1.363 1.163 0 N-CA-C 121.266 3.802 . . . . 0.0 121.266 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.359 88.3 tttt 159.31 -65.72 0.0 OUTLIER Pre-proline 0 N--CA 1.421 -1.885 2 C-N-CA 133.879 4.872 . . . . 0.0 109.182 161.812 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -75.46 53.62 3.59 Favored 'Trans proline' 0 CA--C 1.554 1.515 0 C-N-CA 123.267 2.644 . . . . 0.0 115.431 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.438 HD22 ' HB2' ' A' ' 118' ' ' CYS . 18.5 p30 -170.16 172.32 6.41 Favored 'General case' 0 C--N 1.371 1.5 0 N-CA-C 117.148 2.277 . . . . 0.0 117.148 -177.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.623 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 29.0 tt0 -141.83 -91.29 0.14 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 128.495 2.718 . . . . 0.0 105.634 156.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 6.9 mptt 50.77 14.85 0.2 Allowed 'General case' 0 C--N 1.364 1.223 1 C-N-CA 136.735 6.014 . . . . 0.0 117.505 -172.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.623 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -169.83 -119.83 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.171 0 C-N-CA 130.669 3.588 . . . . 0.0 106.964 -167.563 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.465 ' H ' ' HB3' ' A' ' 124' ' ' PHE . 10.0 mmtt -108.72 -65.53 1.13 Allowed 'General case' 0 N--CA 1.425 -1.712 0 N-CA-C 102.634 -3.098 . . . . 0.0 102.634 171.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -177.31 145.98 0.62 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 128.341 2.657 . . . . 0.0 107.893 169.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -147.2 38.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.065 0 N-CA-C 118.681 2.531 . . . . 0.0 118.681 -171.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.8 m -144.06 156.37 44.35 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 170.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.24 130.47 53.38 Favored 'General case' 0 C--N 1.358 0.978 1 N-CA-C 99.001 -4.444 . . . . 0.0 99.001 159.739 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . 0.327 35.9 mt-30 -119.99 72.39 0.93 Allowed 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 120.232 -1.542 . . . . 0.0 107.311 -172.002 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.256 4.8 t 104.12 117.1 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 125.597 1.559 . . . . 0.0 110.124 -177.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -114.87 113.86 24.76 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 173.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.407 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 6.0 ttp -94.01 108.16 20.01 Favored 'General case' 0 CA--C 1.497 -1.063 0 C-N-CA 126.077 1.751 . . . . 0.0 108.465 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.676 ' H ' HD23 ' A' ' 49' ' ' LEU . . . -123.61 114.81 20.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 121.276 0.56 . . . . 0.0 110.227 -172.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 6.3 mm -134.68 134.17 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.398 1.079 . . . . 0.0 110.544 178.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.839 HG23 ' HA ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -142.65 -179.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.15 0 C-N-CA 127.488 2.315 . . . . 0.0 113.278 -173.087 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.88 106.34 18.32 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 131.156 3.782 . . . . 0.0 107.719 155.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.729 ' CB ' HD21 ' A' ' 141' ' ' LEU 0.277 0.4 OUTLIER -96.59 -91.91 0.23 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 120.069 3.359 . . . . 0.0 120.069 -175.838 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.574 ' HB2' ' HG2' ' A' ' 140' ' ' ARG . 27.0 mtp180 -127.55 -51.99 1.37 Allowed 'General case' 0 C--N 1.371 1.5 0 CA-C-O 123.384 1.564 . . . . 0.0 109.2 -158.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.574 ' HG2' ' HB2' ' A' ' 139' ' ' ARG . 1.6 ptm180 -123.58 19.95 9.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 129.729 3.212 . . . . 0.0 111.335 -168.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.729 HD21 ' CB ' ' A' ' 138' ' ' SER . 0.4 OUTLIER . . . . . 0 CA--C 1.492 -1.255 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.871 -170.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.467 HD11 ' CG2' ' A' ' 106' ' ' ILE . 1.2 pp . . . . . 0 C--O 1.219 -0.509 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.443 68.6 mttt -114.43 148.19 38.12 Favored 'General case' 0 C--N 1.355 0.845 1 N-CA-C 98.48 -4.637 . . . . 0.0 98.48 148.268 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.505 ' H ' ' CE1' ' A' ' 73' ' ' HIS 0.994 0.5 OUTLIER -76.82 146.05 38.04 Favored 'General case' 0 N--CA 1.494 1.74 1 N-CA-C 129.65 6.907 . . . . 0.0 129.65 -134.56 . . . . . . . . 5 4 . 1 . 010 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 . . . . . 0 N--CA 1.416 -2.133 2 C-N-CA 135.27 5.428 . . . . 0.0 105.418 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.669 ' HA ' HG13 ' A' ' 7' ' ' VAL . 18.1 m-80 . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.74 -57.91 10.39 Favored 'General case' 0 C--N 1.347 0.495 1 C-N-CA 133.268 4.627 . . . . 0.0 111.694 171.594 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.0 -15.24 61.1 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.562 2.345 . . . . 0.0 113.294 177.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.669 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.252 0.6 OUTLIER -87.77 -37.03 10.28 Favored 'Isoleucine or valine' 0 C--N 1.355 0.827 0 C-N-CA 127.514 2.325 . . . . 0.0 110.565 179.304 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -70.26 -40.42 74.38 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 129.435 3.094 . . . . 0.0 108.795 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.17 -43.91 99.08 Favored 'Isoleucine or valine' 0 C--N 1.376 1.759 0 C-N-CA 125.02 1.328 . . . . 0.0 109.629 165.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.269 0.3 OUTLIER -58.11 -49.35 77.26 Favored 'General case' 0 C--N 1.37 1.472 0 N-CA-C 116.175 1.917 . . . . 0.0 116.175 171.939 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.4 -31.39 72.06 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 169.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -77.15 -51.24 11.33 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 126.93 2.092 . . . . 0.0 111.846 174.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -59.11 -28.76 66.83 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.173 3.389 . . . . 0.0 110.15 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.4 OUTLIER -70.14 -51.6 30.18 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 124.779 1.232 . . . . 0.0 111.27 167.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.3 ttt-85 -55.08 -39.56 69.43 Favored 'General case' 0 CA--C 1.566 1.587 0 C-N-CA 125.692 1.597 . . . . 0.0 112.622 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.5 mmt-85 -63.39 -43.86 96.37 Favored 'General case' 0 C--N 1.38 1.9 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 165.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.2 m-70 -56.89 -49.6 75.05 Favored 'General case' 0 C--N 1.39 2.368 0 C-N-CA 128.878 2.871 . . . . 0.0 110.327 171.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.661 ' CE2' HD11 ' A' ' 50' ' ' LEU . 1.4 t80 -54.92 -54.21 45.58 Favored 'General case' 0 C--N 1.379 1.864 0 C-N-CA 131.107 3.763 . . . . 0.0 110.079 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.72 -42.48 67.27 Favored 'General case' 0 C--N 1.372 1.58 0 N-CA-C 119.336 3.088 . . . . 0.0 119.336 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.6 m -69.95 -42.74 72.82 Favored 'General case' 0 C--N 1.363 1.183 0 C-N-CA 127.047 2.139 . . . . 0.0 113.337 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.626 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 4.5 mp0 -74.84 -29.19 60.97 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.208 1.403 . . . . 0.0 109.878 171.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.264 0.2 OUTLIER -62.26 -34.18 76.05 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.043 -1.66 . . . . 0.0 113.275 166.393 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -62.99 -37.55 87.62 Favored 'General case' 0 C--N 1.381 1.974 0 C-N-CA 124.313 1.045 . . . . 0.0 111.432 167.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 tp60 -60.16 -47.71 84.77 Favored 'General case' 0 C--N 1.371 1.537 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 166.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.6 mt -66.84 -45.11 88.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 O-C-N 120.942 -1.099 . . . . 0.0 112.162 178.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.59 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.56 0.7 OUTLIER -72.75 -23.02 60.77 Favored 'General case' 0 C--N 1.366 1.322 0 O-C-N 120.248 -1.533 . . . . 0.0 114.796 173.528 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -73.38 -36.09 66.01 Favored 'General case' 0 C--N 1.362 1.149 0 O-C-N 120.223 -1.548 . . . . 0.0 112.41 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.545 ' HG2' ' HG2' ' A' ' 71' ' ' LYS . 4.0 tp10 -74.03 -43.32 58.34 Favored 'General case' 0 C--N 1.394 2.521 0 O-C-N 119.281 -2.137 . . . . 0.0 109.645 171.146 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.59 HG13 ' HA ' ' A' ' 26' ' ' ASN 0.431 0.7 OUTLIER -63.66 -42.55 96.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 CA-C-N 120.714 1.597 . . . . 0.0 115.058 176.507 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -71.12 -32.34 68.89 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 120.204 1.366 . . . . 0.0 114.114 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -76.45 -39.62 52.83 Favored 'General case' 0 C--N 1.377 1.781 0 O-C-N 119.449 -2.032 . . . . 0.0 111.275 177.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.63 -44.58 56.61 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.348 1.459 . . . . 0.0 114.277 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.263 59.5 p -68.43 -30.37 69.25 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 120.092 -1.63 . . . . 0.0 112.481 175.039 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -70.05 -47.35 62.37 Favored 'General case' 0 C--N 1.379 1.848 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 162.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.41 -33.09 74.92 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 126.421 1.888 . . . . 0.0 115.988 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -14.96 61.48 Favored 'General case' 0 C--N 1.376 1.72 0 CA-C-N 119.865 1.211 . . . . 0.0 112.645 168.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 17.91 47.41 Favored Glycine 0 C--N 1.385 3.251 0 O-C-N 121.076 -1.015 . . . . 0.0 113.324 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.512 HG11 ' CG ' ' A' ' 78' ' ' ASN 0.277 0.6 OUTLIER -107.84 177.24 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.987 0 C-N-CA 126.534 1.934 . . . . 0.0 107.224 -174.868 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 6.94 -65.89 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.564 2 C-N-CA 135.758 5.623 . . . . 0.0 122.019 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.0 m 80.28 88.72 0.05 OUTLIER 'General case' 0 C--N 1.36 1.05 1 C-N-CA 132.075 4.15 . . . . 0.0 102.422 -165.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.462 ' CZ ' HG21 ' A' ' 77' ' ' VAL 0.321 52.0 p90 -111.15 140.87 45.34 Favored 'General case' 0 C--N 1.361 1.1 0 CA-C-O 122.743 1.259 . . . . 0.0 109.666 -167.173 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -100.96 162.4 12.92 Favored 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 126.148 1.779 . . . . 0.0 106.808 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.72 122.46 44.59 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.014 0.926 . . . . 0.0 108.916 -178.048 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -137.49 141.38 41.5 Favored 'General case' 0 N--CA 1.426 -1.663 1 N-CA-C 99.233 -4.358 . . . . 0.0 99.233 174.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.401 ' CD2' ' CD1' ' A' ' 50' ' ' LEU . 3.6 p90 -130.96 155.02 47.5 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 174.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.9 m -99.62 139.61 35.03 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 104.782 -2.303 . . . . 0.0 104.782 167.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -79.44 -8.74 59.33 Favored 'General case' 0 C--O 1.208 -1.129 0 C-N-CA 128.805 2.842 . . . . 0.0 116.374 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.38 96.6 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 124.447 3.294 . . . . 0.0 116.539 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.778 HD22 ' H ' ' A' ' 49' ' ' LEU 0.321 0.2 OUTLIER -68.62 -39.07 80.98 Favored 'General case' 0 CA--C 1.444 -3.127 0 C-N-CA 130.065 3.346 . . . . 0.0 113.151 174.884 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.888 HD23 HD11 ' A' ' 54' ' ' ILE 0.286 0.2 OUTLIER -65.01 -45.98 83.3 Favored 'General case' 0 C--O 1.202 -1.415 1 CA-C-N 108.304 -4.044 . . . . 0.0 108.991 170.71 . . . . . . . . 5 4 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -55.02 -34.32 63.39 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 117.28 -3.387 . . . . 0.0 110.915 170.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -76.63 -27.05 55.55 Favored 'General case' 0 C--N 1.365 1.281 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 166.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.0 -49.26 11.16 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 117.493 -3.254 . . . . 0.0 113.921 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.888 HD11 HD23 ' A' ' 50' ' ' LEU . 66.8 mt -51.56 -43.3 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 1 C-N-CA 134.686 5.194 . . . . 0.0 111.461 174.975 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.436 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -107.0 -26.0 11.36 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 119.549 3.166 . . . . 0.0 119.549 171.555 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -85.44 -16.6 39.16 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-N 124.394 3.27 . . . . 0.0 113.015 -175.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.605 ' HA ' HD22 ' A' ' 141' ' ' LEU . 16.6 mt-10 -121.59 -56.76 1.86 Allowed 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 128.443 2.697 . . . . 0.0 110.268 -175.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.553 HD13 ' N ' ' A' ' 59' ' ' ASP 0.608 0.0 OUTLIER 73.6 -169.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 C-N-CA 129.894 3.278 . . . . 0.0 108.925 -178.089 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.553 ' N ' HD13 ' A' ' 58' ' ' ILE . 13.2 t70 -8.25 69.24 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.791 1 C-N-CA 133.756 4.822 . . . . 0.0 116.275 173.741 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.5 ' O ' HG12 ' A' ' 63' ' ' VAL 0.393 11.7 pt-20 -98.51 62.17 1.42 Allowed 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 129.469 3.108 . . . . 0.0 108.682 -173.993 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.389 24.3 p -79.21 -11.91 59.97 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 126.793 3.187 . . . . 0.0 113.244 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.626 ' CE2' HG21 ' A' ' 136' ' ' ILE . 25.2 t80 -69.56 -33.58 72.96 Favored 'General case' 0 CA--C 1.551 1.003 1 C-N-CA 133.131 4.572 . . . . 0.0 109.692 166.499 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.548 HG23 HD13 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -61.98 -44.96 99.64 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 C-N-CA 128.477 2.711 . . . . 0.0 108.767 -178.381 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.287 43.9 m-85 -62.42 -45.27 93.84 Favored 'General case' 0 C--O 1.205 -1.249 1 C-N-CA 134.38 5.072 . . . . 0.0 111.976 167.34 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -61.48 -46.21 90.98 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 124.902 3.501 . . . . 0.0 115.575 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.641 HD12 HD21 ' A' ' 111' ' ' LEU . 2.0 tm? -67.76 -45.94 73.5 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.744 1.217 . . . . 0.0 113.908 169.004 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.41 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.964 0.0 OUTLIER -77.05 -16.13 59.36 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.153 -2.217 . . . . 0.0 115.869 -179.616 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -72.65 -36.64 68.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 130.066 3.346 . . . . 0.0 107.214 162.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.95 -15.85 61.11 Favored 'General case' 0 CA--C 1.59 2.518 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.663 HG23 ' CD2' ' A' ' 73' ' ' HIS . 4.4 mm -86.23 -40.15 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 128.079 2.552 . . . . 0.0 113.743 171.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.545 ' HG2' ' HG2' ' A' ' 28' ' ' GLU . 31.6 ttpt -52.75 -14.27 0.52 Allowed 'General case' 0 N--CA 1.503 2.203 1 C-N-CA 136.104 5.762 . . . . 0.0 115.951 175.496 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.343 35.3 t70 -80.89 -34.51 33.47 Favored 'General case' 0 N--CA 1.432 -1.369 1 C-N-CA 135.97 5.708 . . . . 0.0 111.014 176.914 . . . . . . . . 3 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.663 ' CD2' HG23 ' A' ' 70' ' ' ILE 0.371 0.0 OUTLIER -88.12 24.31 1.88 Allowed 'General case' 0 CA--C 1.487 -1.459 0 C-N-CA 130.103 3.361 . . . . 0.0 116.573 -168.407 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.593 ' HA ' HG13 ' A' ' 77' ' ' VAL . 73.1 t -38.4 -33.51 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 129.206 3.002 . . . . 0.0 113.989 158.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.436 ' H ' HD22 ' A' ' 75' ' ' LEU . 2.6 mm? -64.92 -39.5 93.6 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 131.217 3.807 . . . . 0.0 115.628 171.293 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -74.82 -36.74 62.42 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 127.039 2.135 . . . . 0.0 111.921 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.593 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.514 0.2 OUTLIER -71.34 -28.85 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-O 124.178 1.942 . . . . 0.0 113.149 172.801 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.512 ' CG ' HG11 ' A' ' 38' ' ' VAL . 0.8 OUTLIER -63.53 -47.66 80.71 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 128.765 2.826 . . . . 0.0 110.957 164.464 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -59.26 -30.49 68.33 Favored 'General case' 0 C--N 1.382 2.002 0 C-N-CA 126.459 1.903 . . . . 0.0 114.58 168.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -68.57 -37.9 80.27 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 127.652 2.381 . . . . 0.0 112.697 171.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.686 HD22 ' HB2' ' A' ' 125' ' ' LYS . 2.3 tm? . . . . . 0 C--N 1.377 1.791 0 C-N-CA 129.227 3.011 . . . . 0.0 111.489 170.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.491 -1.429 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 43.1 ptt85 -118.57 149.57 41.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.937 1.827 . . . . 0.0 113.996 -176.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.87 143.39 47.0 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 129.255 3.022 . . . . 0.0 108.305 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -129.88 117.83 20.78 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 103.035 -2.95 . . . . 0.0 103.035 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.432 ' HB ' HD11 ' A' ' 150' ' ' ILE 0.319 15.4 pt -135.57 140.98 43.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 C-N-CA 127.175 2.19 . . . . 0.0 107.664 -175.58 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.6 m -132.93 125.09 29.07 Favored 'General case' 0 CA--C 1.497 -1.087 0 O-C-N 118.252 -2.78 . . . . 0.0 106.29 -172.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.574 ' HB3' HD11 ' A' ' 66' ' ' LEU . 2.1 t0 -148.12 162.49 39.31 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 103.128 -2.915 . . . . 0.0 103.128 -169.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.617 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 84.29 -61.33 4.73 Favored Glycine 0 N--CA 1.479 1.552 0 O-C-N 119.885 -1.759 . . . . 0.0 115.793 170.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 162.12 -30.34 0.0 OUTLIER 'General case' 0 CA--C 1.563 1.456 1 C-N-CA 137.845 6.458 . . . . 0.0 106.611 -167.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.751 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.559 0.5 OUTLIER -79.56 136.61 36.91 Favored 'General case' 0 C--N 1.379 1.878 2 C-N-CA 132.657 4.383 . . . . 0.0 122.358 -175.908 . . . . . . . . 5 4 . 1 . 011 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -90.32 101.84 14.57 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.276 0.2 OUTLIER -94.49 131.57 40.06 Favored 'General case' 0 C--N 1.383 2.032 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 177.847 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.92 127.19 7.69 Favored Glycine 0 C--N 1.353 1.514 0 N-CA-C 105.95 -2.86 . . . . 0.0 105.95 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -120.95 139.93 52.57 Favored 'General case' 0 C--N 1.368 1.405 0 N-CA-C 104.121 -2.548 . . . . 0.0 104.121 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -132.52 137.42 47.16 Favored 'General case' 0 CA--C 1.481 -1.688 0 N-CA-C 100.956 -3.72 . . . . 0.0 100.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -68.62 164.04 2.9 Favored 'Isoleucine or valine' 0 C--N 1.368 1.39 0 CA-C-N 120.282 1.401 . . . . 0.0 109.41 169.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.503 ' SG ' ' HD2' ' A' ' 127' ' ' PRO . 24.8 p -39.04 99.2 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 126.662 1.985 . . . . 0.0 115.813 169.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.264 54.5 tptt -68.02 -40.62 23.3 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 119.404 3.113 . . . . 0.0 119.404 -168.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -100.15 58.46 0.04 OUTLIER 'Trans proline' 0 CA--C 1.549 1.271 0 CA-C-N 125.327 2.938 . . . . 0.0 111.165 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 174.34 -173.83 0.07 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 125.721 1.609 . . . . 0.0 107.009 -175.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.436 ' H ' ' HD2' ' A' ' 123' ' ' LYS . 2.9 tp10 -156.09 -77.54 0.09 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 153.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.436 ' HD2' ' H ' ' A' ' 122' ' ' GLU 0.3 1.7 mptp? 60.84 -32.54 0.07 Allowed 'General case' 0 N--CA 1.436 -1.15 1 C-N-CA 135.58 5.552 . . . . 0.0 117.137 -172.872 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.31 -149.07 0.43 Allowed 'General case' 0 N--CA 1.442 -0.827 1 C-N-CA 132.119 4.168 . . . . 0.0 109.602 -179.523 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.686 ' HB2' HD22 ' A' ' 81' ' ' LEU 0.306 0.0 OUTLIER -99.7 -54.01 3.03 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 129.066 2.947 . . . . 0.0 107.456 172.534 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -171.65 107.36 0.38 Allowed Pre-proline 0 C--N 1.356 0.886 0 C-N-CA 125.485 1.514 . . . . 0.0 114.199 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.503 ' HD2' ' SG ' ' A' ' 118' ' ' CYS . 8.2 Cg_endo -121.69 19.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.375 1.957 0 CA-C-N 124.015 2.47 . . . . 0.0 118.125 174.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.26 0.7 OUTLIER -146.29 153.5 40.63 Favored 'General case' 0 CA--C 1.479 -1.769 0 N-CA-C 103.361 -2.829 . . . . 0.0 103.361 159.256 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mt -103.82 135.03 46.13 Favored 'General case' 0 C--N 1.365 1.27 1 N-CA-C 99.758 -4.164 . . . . 0.0 99.758 161.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -129.95 74.85 1.61 Allowed 'General case' 0 CA--C 1.488 -1.41 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 -173.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.285 71.7 m 120.85 78.48 0.0 OUTLIER 'General case' 0 C--N 1.359 1.013 0 N-CA-C 103.845 -2.65 . . . . 0.0 103.845 -174.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -101.66 109.03 20.74 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 102.537 -3.134 . . . . 0.0 102.537 170.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.35 135.17 50.09 Favored 'General case' 0 C--N 1.348 0.528 0 C-N-CA 127.06 2.144 . . . . 0.0 111.134 -174.115 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.07 116.29 19.06 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 126.62 1.968 . . . . 0.0 110.647 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -135.2 133.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.365 1.255 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 174.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.796 HG22 ' H ' ' A' ' 137' ' ' ASN . 0.2 OUTLIER -121.35 -167.92 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.764 0 C-N-CA 127.432 2.293 . . . . 0.0 112.225 -172.243 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.796 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -177.19 -173.49 0.45 Allowed 'General case' 0 CA--C 1.476 -1.885 1 C-N-CA 137.991 6.517 . . . . 0.0 106.989 177.353 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.574 ' HB2' ' CD ' ' A' ' 139' ' ' ARG 0.375 12.5 m 153.81 -49.94 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 109.923 -3.308 . . . . 0.0 103.975 -168.064 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.574 ' CD ' ' HB2' ' A' ' 138' ' ' SER . 0.0 OUTLIER -133.17 -78.66 0.48 Allowed 'General case' 0 N--CA 1.424 -1.765 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.985 -157.421 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.558 ' HG3' ' HD3' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -105.89 -19.44 13.74 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 130.222 3.409 . . . . 0.0 119.394 -165.413 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.724 ' HB2' ' HA ' ' A' ' 137' ' ' ASN . 2.7 mt . . . . . 0 N--CA 1.439 -1.019 0 C-N-CA 129.647 3.179 . . . . 0.0 114.049 -162.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.432 HD11 ' HB ' ' A' ' 106' ' ' ILE . 4.5 pt . . . . . 0 CA--C 1.547 0.846 0 CA-C-O 122.114 0.959 . . . . 0.0 113.226 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.385 38.7 mttm -116.65 146.98 42.35 Favored 'General case' 0 CA--C 1.5 -0.956 1 N-CA-C 98.969 -4.456 . . . . 0.0 98.969 155.043 . . . . . . . . 3 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 5.9 t -77.62 139.47 39.5 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 -132.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 . . . . . 0 C--O 1.262 1.761 0 CA-C-N 109.01 -3.723 . . . . 0.0 117.51 -162.011 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.711 ' HA ' HG13 ' A' ' 7' ' ' VAL . 35.4 m-80 . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 117.322 2.341 . . . . 0.0 117.322 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.33 -57.7 9.53 Favored 'General case' 0 C--N 1.349 0.571 1 C-N-CA 131.956 4.102 . . . . 0.0 111.728 172.839 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -75.13 -14.57 60.58 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.013 2.125 . . . . 0.0 112.616 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.711 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.316 0.8 OUTLIER -86.66 -33.67 7.26 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 126.791 2.036 . . . . 0.0 110.696 176.395 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -66.76 -44.69 80.76 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 128.599 2.759 . . . . 0.0 109.002 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mt -58.2 -43.21 85.23 Favored 'Isoleucine or valine' 0 C--N 1.363 1.169 0 CA-C-N 113.615 -1.629 . . . . 0.0 111.696 165.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 12.6 ttm105 -59.94 -49.44 77.66 Favored 'General case' 0 C--N 1.369 1.435 0 O-C-N 119.733 -1.855 . . . . 0.0 115.654 170.332 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.431 ' HD2' ' HG2' ' A' ' 55' ' ' GLN . 75.9 mtm180 -58.59 -30.53 67.27 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 119.113 3.005 . . . . 0.0 119.113 167.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -77.16 -49.02 16.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.696 3.198 . . . . 0.0 111.035 173.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 14.2 mmtp -57.49 -29.14 64.02 Favored 'General case' 0 C--N 1.376 1.752 0 C-N-CA 128.629 2.772 . . . . 0.0 109.679 170.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.66 HD13 HG23 ' A' ' 54' ' ' ILE . 0.0 OUTLIER -72.32 -43.45 64.12 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.038 1.335 . . . . 0.0 113.854 168.821 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -55.8 -40.92 73.38 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 119.764 -1.835 . . . . 0.0 112.496 168.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.3 mmt-85 -63.38 -48.09 79.36 Favored 'General case' 0 C--N 1.379 1.879 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 165.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.407 ' CG ' ' O ' ' A' ' 13' ' ' LYS 0.29 11.4 m-70 -57.03 -46.89 82.04 Favored 'General case' 0 C--N 1.39 2.354 1 C-N-CA 131.932 4.093 . . . . 0.0 110.27 175.81 . . . . . . . . 4 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.625 ' CE1' HD21 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -58.55 -54.54 45.91 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 130.144 3.378 . . . . 0.0 110.889 175.238 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.17 -45.16 58.11 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 118.046 2.609 . . . . 0.0 118.046 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.9 m -65.78 -41.41 92.06 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.252 2.221 . . . . 0.0 112.748 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.567 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.392 3.7 mp0 -77.28 -29.25 53.7 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 120.611 -1.306 . . . . 0.0 111.249 172.071 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.67 -31.27 70.52 Favored 'General case' 0 C--N 1.388 2.258 0 O-C-N 119.18 -2.2 . . . . 0.0 112.76 167.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -69.17 -38.33 78.64 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 125.203 1.401 . . . . 0.0 110.632 165.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 31.4 tp60 -58.47 -46.87 85.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 168.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.7 mt -70.75 -45.46 73.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 O-C-N 121.24 -0.912 . . . . 0.0 112.285 175.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.628 0.5 OUTLIER -70.61 -23.69 62.6 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 119.825 1.193 . . . . 0.0 113.662 177.099 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -69.31 -45.95 68.3 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.19 -1.569 . . . . 0.0 109.814 167.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.42 ' HG2' ' CG ' ' A' ' 71' ' ' LYS . 18.9 tp10 -64.19 -36.75 85.09 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.764 -1.835 . . . . 0.0 114.308 174.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.409 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 4.8 mt -62.31 -50.09 81.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 C-N-CA 125.055 1.342 . . . . 0.0 113.943 171.228 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttm105 -68.31 -28.6 67.32 Favored 'General case' 0 C--N 1.361 1.085 0 CA-C-N 121.534 1.97 . . . . 0.0 115.056 176.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -76.21 -45.38 33.34 Favored 'General case' 0 C--N 1.37 1.489 0 O-C-N 119.776 -1.827 . . . . 0.0 110.331 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.6 -40.42 66.53 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.443 ' HA ' HD21 ' A' ' 78' ' ' ASN 0.348 4.0 p -68.93 -39.04 79.84 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.617 1.167 . . . . 0.0 111.19 177.801 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 mmtp -66.32 -46.25 77.53 Favored 'General case' 0 C--N 1.376 1.758 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 167.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.93 71.93 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 126.114 1.766 . . . . 0.0 114.783 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.33 -13.89 60.81 Favored 'General case' 0 C--N 1.376 1.736 0 CA-C-N 119.411 1.005 . . . . 0.0 113.495 169.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.98 18.02 30.68 Favored Glycine 0 C--N 1.38 2.988 0 CA-C-N 119.567 1.076 . . . . 0.0 114.094 171.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.556 HG23 HD11 ' A' ' 81' ' ' LEU . 1.9 m -118.83 175.8 3.56 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 -175.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.316 3.6 m -52.44 162.04 0.59 Allowed 'General case' 0 N--CA 1.428 -1.546 1 C-N-CA 132.574 4.35 . . . . 0.0 118.966 176.86 . . . . . . . . 3 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.6 m -92.82 112.71 24.76 Favored 'General case' 0 CA--C 1.49 -1.335 0 C-N-CA 124.821 1.249 . . . . 0.0 107.632 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.489 ' HA ' ' O ' ' A' ' 127' ' ' PRO 0.277 42.9 p90 -114.0 144.53 42.95 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.056 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -118.35 163.12 17.19 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-O 123.601 1.667 . . . . 0.0 112.359 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -122.06 121.78 37.76 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 125.766 1.626 . . . . 0.0 114.403 -174.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -122.01 162.05 21.84 Favored 'General case' 0 C--N 1.373 1.621 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 171.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.46 ' CD2' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -116.34 172.55 7.12 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 170.035 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.9 m -97.59 117.84 32.76 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 102.893 -3.002 . . . . 0.0 102.893 159.163 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.54 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.529 0.0 OUTLIER -78.12 -10.16 59.5 Favored 'General case' 0 CA--C 1.556 1.18 0 O-C-N 120.004 -1.685 . . . . 0.0 115.281 -175.298 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.7 -38.82 46.57 Favored 'General case' 0 C--N 1.376 1.746 0 CA-C-O 126.127 2.87 . . . . 0.0 110.071 172.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.402 HD21 ' HA ' ' A' ' 133' ' ' MET . 21.0 tp -64.45 -35.01 79.55 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 127.809 2.444 . . . . 0.0 111.213 168.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.625 HD21 ' CE1' ' A' ' 18' ' ' PHE . 1.8 mp -74.71 -28.09 60.66 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.123 166.152 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.15 -30.6 64.6 Favored 'General case' 0 C--N 1.365 1.262 0 O-C-N 118.299 -2.75 . . . . 0.0 109.747 171.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -79.53 -55.43 5.04 Favored 'General case' 0 C--N 1.386 2.195 0 N-CA-C 117.821 2.526 . . . . 0.0 117.821 158.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.16 -30.69 70.55 Favored 'General case' 0 N--CA 1.502 2.15 1 CA-C-N 127.366 4.621 . . . . 0.0 118.852 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.66 HG23 HD13 ' A' ' 14' ' ' LEU . 42.1 mt -68.53 -46.49 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 128.08 2.552 . . . . 0.0 112.529 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.551 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.1 mt-30 -102.54 -18.98 15.04 Favored 'General case' 0 C--N 1.371 1.517 0 N-CA-C 119.031 2.975 . . . . 0.0 119.031 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -90.0 -7.41 54.05 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-N 123.168 2.713 . . . . 0.0 111.794 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 141' ' ' LEU . 28.4 mt-10 -125.96 -65.25 1.0 Allowed 'General case' 0 C--N 1.354 0.786 0 C-N-CA 126.403 1.881 . . . . 0.0 108.93 -176.097 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.551 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.49 0.2 OUTLIER 71.47 147.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 128.574 2.75 . . . . 0.0 112.593 178.243 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.421 ' HB2' HD12 ' A' ' 58' ' ' ILE . 22.0 t70 58.6 -61.52 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 129.409 3.084 . . . . 0.0 113.679 -175.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.59 ' O ' HG12 ' A' ' 63' ' ' VAL 0.508 7.0 pt-20 27.69 61.56 0.1 Allowed 'General case' 0 C--O 1.205 -1.275 1 C-N-CA 133.799 4.84 . . . . 0.0 114.301 -178.101 . . . . . . . . 4 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.438 34.9 p -78.03 -10.82 59.79 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 118.171 -2.831 . . . . 0.0 114.043 -172.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.435 ' HE2' HG21 ' A' ' 136' ' ' ILE . 10.8 t80 -68.95 -33.49 73.8 Favored 'General case' 0 CA--C 1.552 1.032 1 C-N-CA 133.653 4.781 . . . . 0.0 110.56 164.314 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.59 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -67.52 -44.33 86.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.412 0 C-N-CA 129.785 3.234 . . . . 0.0 108.804 -178.518 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.567 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.292 28.1 m-85 -63.81 -43.94 94.74 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 130.591 3.556 . . . . 0.0 112.682 166.445 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -59.25 -44.91 92.36 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.259 2.3 . . . . 0.0 114.681 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.73 ' HG ' HD21 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -59.47 -50.72 72.83 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 129.4 3.08 . . . . 0.0 113.125 169.797 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.812 0.1 OUTLIER -77.67 -17.48 57.64 Favored 'General case' 0 C--N 1.377 1.779 0 O-C-N 119.201 -2.187 . . . . 0.0 114.64 176.842 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -80.03 -16.29 55.42 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 126.852 2.061 . . . . 0.0 111.405 166.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -84.36 -40.93 17.27 Favored 'General case' 0 CA--C 1.556 1.201 0 O-C-N 120.38 -1.45 . . . . 0.0 110.488 160.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.676 HD13 ' N ' ' A' ' 153' ' ' GLN 0.327 0.9 OUTLIER -58.51 -26.16 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.808 0 C-N-CA 128.521 2.728 . . . . 0.0 113.896 176.009 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.42 ' CG ' ' HG2' ' A' ' 28' ' ' GLU . 29.5 pttt -61.72 -11.95 14.39 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 129.615 3.166 . . . . 0.0 117.431 174.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.316 80.5 m-20 -89.18 -36.81 15.46 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 123.8 1.762 . . . . 0.0 109.987 -173.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.529 ' NE2' ' HG3' ' A' ' 151' ' ' LYS . 1.9 t-80 -87.46 24.14 1.73 Allowed 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 131.48 3.912 . . . . 0.0 116.206 -166.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.561 ' HA ' HG13 ' A' ' 77' ' ' VAL 0.283 95.7 t -41.95 -31.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 128.171 2.589 . . . . 0.0 114.118 161.168 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.97 -39.07 92.92 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 127.108 2.163 . . . . 0.0 115.748 171.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.47 ' HG3' ' HE1' ' A' ' 73' ' ' HIS 0.368 63.9 mm-40 -76.24 -34.74 59.2 Favored 'General case' 0 C--N 1.366 1.324 0 O-C-N 118.908 -2.37 . . . . 0.0 113.698 170.413 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.561 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.404 1.9 p -70.81 -29.29 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.699 0 CA-C-O 124.084 1.897 . . . . 0.0 113.654 173.318 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.443 HD21 ' HA ' ' A' ' 33' ' ' SER . 4.6 m120 -64.43 -45.37 87.79 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 130.36 3.464 . . . . 0.0 110.326 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.28 -30.28 71.13 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 126.187 1.795 . . . . 0.0 112.762 172.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.518 ' CE1' HG23 ' A' ' 77' ' ' VAL 0.609 0.2 OUTLIER -74.86 -29.6 61.08 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 169.381 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.556 HD11 HG23 ' A' ' 38' ' ' VAL 0.307 0.4 OUTLIER . . . . . 0 C--N 1.377 1.795 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 168.955 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.616 0 CA-C-O 122.562 1.09 . . . . 0.0 113.347 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.1 ptt180 -119.42 146.56 45.27 Favored 'General case' 0 C--N 1.349 0.546 0 C-N-CA 125.59 1.556 . . . . 0.0 111.695 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pp -140.16 150.42 44.2 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 126.423 1.889 . . . . 0.0 111.715 -175.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -130.16 130.87 45.29 Favored 'General case' 0 C--N 1.367 1.336 0 C-N-CA 127.277 2.231 . . . . 0.0 105.444 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.855 HD13 ' HG2' ' A' ' 153' ' ' GLN . 4.9 pt -134.51 138.68 49.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.662 ' O ' HG22 ' A' ' 150' ' ' ILE . 8.9 t -101.64 106.97 18.09 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 173.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.39 143.77 34.14 Favored 'General case' 0 CA--C 1.477 -1.845 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 -168.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 81.71 -21.76 6.23 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.866 2.174 . . . . 0.0 112.23 178.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 116.53 -9.49 0.0 OUTLIER 'General case' 0 C--N 1.376 1.73 1 C-N-CA 135.653 5.581 . . . . 0.0 110.623 -167.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.826 HD13 HD12 ' A' ' 136' ' ' ILE 0.64 0.0 OUTLIER -78.82 138.2 38.07 Favored 'General case' 0 CA--C 1.481 -1.68 1 C-N-CA 135.025 5.33 . . . . 0.0 118.654 -178.649 . . . . . . . . 5 4 . 1 . 012 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 54.8 m95 -90.45 98.48 11.8 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 103.191 -2.892 . . . . 0.0 103.191 172.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.571 HD13 HD11 ' A' ' 66' ' ' LEU 0.369 0.1 OUTLIER -108.46 119.43 39.49 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.758 176.085 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -106.76 131.73 10.79 Favored Glycine 0 C--N 1.361 1.943 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.672 ' CE1' HD11 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -115.53 145.97 42.14 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 103.249 -2.871 . . . . 0.0 103.249 177.997 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -138.86 124.42 19.5 Favored 'General case' 0 CA--C 1.488 -1.42 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -79.57 145.03 9.94 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 120.116 1.326 . . . . 0.0 110.876 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 25.0 m -4.44 84.1 0.0 OUTLIER 'General case' 0 C--N 1.37 1.458 0 C-N-CA 130.353 3.461 . . . . 0.0 119.856 -172.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.266 19.0 tptm -43.39 -48.63 17.57 Favored Pre-proline 0 C--N 1.365 1.266 0 C-N-CA 129.955 3.302 . . . . 0.0 116.238 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -87.06 90.02 0.6 Allowed 'Trans proline' 0 CA--C 1.561 1.87 0 C-N-CA 123.464 2.776 . . . . 0.0 107.589 156.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.264 11.0 m120 -47.78 116.97 1.65 Allowed 'General case' 0 C--N 1.369 1.413 0 C-N-CA 131.19 3.796 . . . . 0.0 119.226 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -83.48 -7.41 59.55 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 130.927 3.691 . . . . 0.0 120.652 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.295 19.4 mmtm 53.51 46.69 25.63 Favored 'General case' 0 N--CA 1.434 -1.229 1 C-N-CA 132.017 4.127 . . . . 0.0 119.958 176.71 . . . . . . . . 3 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.271 38.1 m-85 -156.63 170.36 22.56 Favored 'General case' 0 CA--C 1.489 -1.384 0 CA-C-N 114.475 -1.238 . . . . 0.0 113.972 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.78 76.27 0.97 Allowed 'General case' 0 C--N 1.364 1.224 0 C-N-CA 127.575 2.35 . . . . 0.0 109.416 174.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.449 ' N ' ' HD3' ' A' ' 127' ' ' PRO . 1.2 p30 -175.48 49.9 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.321 1 C-N-CA 137.937 6.495 . . . . 0.0 110.564 177.151 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.489 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 11.1 Cg_exo -98.7 -178.23 0.26 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.057 3.172 . . . . 0.0 114.182 -164.056 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.5 p -125.74 163.98 21.65 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.08 130.38 48.66 Favored 'General case' 0 C--N 1.361 1.104 0 N-CA-C 100.288 -3.967 . . . . 0.0 100.288 176.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -109.68 58.49 0.61 Allowed 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 -168.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 17.2 t 119.08 120.39 0.0 OUTLIER 'General case' 0 C--N 1.364 1.22 0 O-C-N 126.796 2.56 . . . . 0.0 106.259 -169.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -114.55 109.42 18.24 Favored 'General case' 0 C--N 1.357 0.907 1 N-CA-C 97.199 -5.112 . . . . 0.0 97.199 159.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' MET . . . . . 0.421 ' O ' ' HA ' ' A' ' 113' ' ' LEU . 0.0 OUTLIER -93.88 119.52 32.91 Favored 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 125.632 1.573 . . . . 0.0 107.87 -177.26 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -127.77 114.93 17.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 120.347 1.43 . . . . 0.0 108.422 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 5.3 mt -142.35 144.19 25.2 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.826 HD12 HD13 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -125.51 177.66 4.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.65 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -164.161 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.407 ' H ' HG22 ' A' ' 136' ' ' ILE . 4.7 p-10 -133.14 117.5 17.56 Favored 'General case' 0 C--N 1.361 1.082 2 N-CA-C 98.023 -4.806 . . . . 0.0 98.023 162.202 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.99 -61.65 0.03 OUTLIER 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 103.838 -2.652 . . . . 0.0 103.838 -173.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.718 ' CD ' ' H ' ' A' ' 140' ' ' ARG 0.716 0.2 OUTLIER 94.88 132.09 0.02 OUTLIER 'General case' 0 C--N 1.369 1.417 0 CA-C-O 122.524 1.154 . . . . 0.0 112.704 -177.736 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.718 ' H ' ' CD ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER 124.5 -41.32 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.454 3 C-N-CA 135.705 5.602 . . . . 0.0 99.018 -144.388 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.64 HD13 ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.38 1.893 2 N-CA-C 127.924 6.268 . . . . 0.0 127.924 171.046 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.861 HD13 ' HG2' ' A' ' 151' ' ' LYS 0.432 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 122.05 0.929 . . . . 0.0 109.783 . . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.861 ' HG2' HD13 ' A' ' 150' ' ' ILE 0.381 7.2 ptmt -73.87 152.82 40.11 Favored 'General case' 0 CA--C 1.511 -0.523 1 C-N-CA 135.177 5.391 . . . . 0.0 105.095 175.73 . . . . . . . . 4 3 . 1 . 012 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.484 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 82.8 p -86.21 93.64 9.1 Favored 'General case' 0 C--O 1.203 -1.38 2 O-C-N 114.173 -5.33 . . . . 0.0 109.077 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.855 ' HG2' HD13 ' A' ' 106' ' ' ILE 0.426 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 1 N-CA-C 126.395 5.702 . . . . 0.0 126.395 -162.303 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.37 3.4 m120 . . . . . 0 N--CA 1.466 0.347 0 N-CA-C 119.673 3.212 . . . . 0.0 119.673 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -50.75 72.8 Favored 'General case' 0 N--CA 1.445 -0.717 1 C-N-CA 133.341 4.656 . . . . 0.0 111.696 166.922 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -80.35 -16.83 53.64 Favored 'General case' 0 C--N 1.372 1.57 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.0 t -81.55 -39.42 17.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.213 0 C-N-CA 130.41 3.484 . . . . 0.0 108.828 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.56 -47.99 76.7 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.363 2.665 . . . . 0.0 110.339 173.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.81 -43.22 66.47 Favored 'Isoleucine or valine' 0 C--N 1.362 1.14 0 C-N-CA 125.708 1.603 . . . . 0.0 113.495 166.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.1 mtm180 -60.45 -50.78 72.19 Favored 'General case' 0 CA--C 1.56 1.345 0 C-N-CA 126.132 1.773 . . . . 0.0 114.086 171.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -60.47 -26.98 67.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 128.793 2.837 . . . . 0.0 117.634 167.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -77.72 -51.09 11.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 130.381 3.472 . . . . 0.0 110.991 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.8 mmtt -57.75 -29.75 65.04 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 128.907 2.883 . . . . 0.0 109.739 169.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' A' ' 54' ' ' ILE . 0.2 OUTLIER -66.68 -49.75 65.11 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 114.233 -1.349 . . . . 0.0 113.887 164.27 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -57.64 -39.56 77.27 Favored 'General case' 0 C--N 1.371 1.533 0 CA-C-N 123.474 2.852 . . . . 0.0 114.452 171.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -61.18 -53.18 60.15 Favored 'General case' 0 C--N 1.379 1.85 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 167.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.293 50.1 m-70 -58.21 -48.73 79.45 Favored 'General case' 0 C--N 1.383 2.046 0 C-N-CA 129.157 2.983 . . . . 0.0 111.922 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.612 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU 0.287 0.9 OUTLIER -57.07 -55.64 32.04 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 128.372 2.669 . . . . 0.0 114.583 174.947 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.98 -35.46 62.05 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -176.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -67.96 -45.01 75.39 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 124.634 1.174 . . . . 0.0 112.806 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.64 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 38.1 mt-10 -77.56 -29.96 52.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.263 -1.523 . . . . 0.0 112.491 173.023 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.312 2.2 m-85 -67.38 -25.96 66.22 Favored 'General case' 0 C--N 1.383 2.05 0 O-C-N 118.706 -2.497 . . . . 0.0 112.362 169.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -66.31 -46.97 75.09 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-O 117.088 -1.434 . . . . 0.0 109.827 161.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -56.68 -47.61 79.47 Favored 'General case' 0 C--N 1.364 1.227 0 N-CA-C 118.842 2.904 . . . . 0.0 118.842 171.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 6.8 mt -70.21 -42.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 O-C-N 120.638 -1.289 . . . . 0.0 111.49 176.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.729 0.0 OUTLIER -74.75 -23.27 58.52 Favored 'General case' 0 C--N 1.373 1.59 0 O-C-N 119.224 -2.173 . . . . 0.0 115.345 177.186 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.61 -37.38 73.84 Favored 'General case' 0 C--N 1.383 2.026 0 C-N-CA 125.652 1.581 . . . . 0.0 110.724 167.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.93 -39.36 93.39 Favored 'General case' 0 C--N 1.388 2.245 0 O-C-N 118.961 -2.337 . . . . 0.0 112.013 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.456 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.6 mt -61.55 -42.0 92.34 Favored 'Isoleucine or valine' 0 C--N 1.373 1.59 0 CA-C-N 120.177 1.353 . . . . 0.0 114.321 172.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.424 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 44.8 ttm180 -59.71 -49.52 77.41 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 124.815 1.246 . . . . 0.0 114.356 174.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -77.06 -37.97 53.54 Favored 'General case' 0 C--N 1.372 1.58 0 C-N-CA 128.527 2.731 . . . . 0.0 113.912 -176.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.534 ' HB3' HG11 ' A' ' 74' ' ' VAL . . . -80.31 -29.16 38.09 Favored 'General case' 0 CA--C 1.494 -1.175 0 CA-C-O 122.49 1.138 . . . . 0.0 113.336 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.461 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.344 23.2 p -79.11 -32.78 44.66 Favored 'General case' 0 C--N 1.357 0.904 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.727 173.277 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 90.2 mttt -60.43 -38.78 85.15 Favored 'General case' 0 C--N 1.374 1.647 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 163.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.09 -36.76 64.29 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.764 2.426 . . . . 0.0 112.843 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.61 61.25 Favored 'General case' 0 C--N 1.383 2.033 0 CA-C-N 119.342 0.974 . . . . 0.0 112.508 168.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.36 17.15 51.16 Favored Glycine 0 C--N 1.364 2.114 0 C-N-CA 127.161 2.315 . . . . 0.0 114.076 172.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.8 HG23 HD11 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -119.52 148.13 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.607 0 CA-C-O 124.482 2.086 . . . . 0.0 108.824 -174.776 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.322 0.1 OUTLIER -11.25 -58.77 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.655 2 C-N-CA 135.757 5.623 . . . . 0.0 121.846 -179.584 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.302 90.8 p 100.23 171.28 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.743 0 C-N-CA 129.3 3.04 . . . . 0.0 108.542 -171.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.456 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 54.2 p90 -151.12 154.79 37.62 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 126.189 1.796 . . . . 0.0 107.195 176.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.428 ' O ' ' HA ' ' A' ' 128' ' ' SER . 72.0 t60 -116.33 124.15 49.41 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 122.296 1.046 . . . . 0.0 109.835 174.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -94.55 160.91 14.43 Favored 'General case' 0 C--N 1.338 0.105 0 O-C-N 118.275 -2.765 . . . . 0.0 114.356 -175.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -138.73 141.41 38.91 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.25 1.82 . . . . 0.0 106.631 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -108.56 154.61 21.7 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 125.445 1.498 . . . . 0.0 108.238 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 110.71 22.76 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 125.063 1.345 . . . . 0.0 113.067 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.563 ' HA ' ' CB ' ' A' ' 50' ' ' LEU 0.965 0.0 OUTLIER -72.73 -8.28 54.62 Favored 'General case' 0 C--N 1.355 0.816 1 C-N-CA 134.004 4.922 . . . . 0.0 120.656 -175.304 . . . . . . . . 5 4 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 -47.08 15.82 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 125.292 2.472 . . . . 0.0 109.707 167.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.8 tp -60.67 -36.07 77.83 Favored 'General case' 0 C--N 1.369 1.429 0 C-N-CA 128.339 2.656 . . . . 0.0 110.06 164.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.612 ' HG ' ' CZ ' ' A' ' 18' ' ' PHE 0.367 0.2 OUTLIER -74.52 -28.51 61.0 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 113.203 -1.817 . . . . 0.0 111.443 170.414 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -59.93 -29.47 68.41 Favored 'General case' 0 CA--C 1.559 1.31 0 O-C-N 116.524 -3.86 . . . . 0.0 109.287 171.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -73.21 -50.93 19.72 Favored 'General case' 0 C--N 1.381 1.948 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 158.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.456 ' HB3' HD13 ' A' ' 50' ' ' LEU . . . -61.8 -29.48 70.18 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 123.945 3.066 . . . . 0.0 116.919 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.573 ' HA ' HD23 ' A' ' 14' ' ' LEU . 1.3 tt -75.58 -39.01 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.139 1 C-N-CA 132.754 4.422 . . . . 0.0 112.693 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.19 -26.28 15.0 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 118.525 -1.27 . . . . 0.0 112.8 172.289 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -74.03 -52.31 13.12 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 120.617 -1.302 . . . . 0.0 112.179 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.511 ' HG2' HD11 ' A' ' 141' ' ' LEU . 2.6 mp0 -109.51 8.42 25.16 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 116.826 2.158 . . . . 0.0 116.826 -175.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 59' ' ' ASP 0.474 0.0 OUTLIER 23.83 -26.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.633 2 C-N-CA 136.656 5.982 . . . . 0.0 125.723 175.096 . . . . . . . . 5 4 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.487 ' N ' HD13 ' A' ' 58' ' ' ILE . 10.6 p-10 -112.92 -47.47 3.04 Favored 'General case' 0 CA--C 1.467 -2.214 1 C-N-CA 132.334 4.253 . . . . 0.0 108.706 176.613 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.469 ' O ' ' HB ' ' A' ' 63' ' ' VAL 0.892 0.0 OUTLIER 15.47 55.61 0.01 OUTLIER 'General case' 0 C--N 1.359 0.995 0 N-CA-C 121.348 3.833 . . . . 0.0 121.348 -166.887 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.258 21.6 p -78.78 -19.07 53.08 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 129.605 3.162 . . . . 0.0 110.705 174.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.412 ' HE2' HG21 ' A' ' 136' ' ' ILE 0.266 40.5 t80 -65.48 -34.51 78.43 Favored 'General case' 0 CA--C 1.543 0.703 1 C-N-CA 132.458 4.303 . . . . 0.0 111.636 168.621 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.484 ' CG2' HD21 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -60.66 -45.87 96.77 Favored 'Isoleucine or valine' 0 C--N 1.364 1.233 0 C-N-CA 130.231 3.413 . . . . 0.0 109.076 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.64 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 43.2 m-85 -62.61 -46.0 90.29 Favored 'General case' 0 CA--C 1.493 -1.241 1 C-N-CA 132.422 4.289 . . . . 0.0 112.79 170.078 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.89 -42.47 97.46 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 121.564 1.984 . . . . 0.0 114.902 177.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.459 HD21 ' HB3' ' A' ' 108' ' ' ASP . 2.2 tm? -65.02 -49.27 70.83 Favored 'General case' 0 CA--C 1.565 1.526 0 C-N-CA 127.797 2.439 . . . . 0.0 113.516 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.431 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.782 0.0 OUTLIER -78.5 -16.26 57.7 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 118.485 -2.634 . . . . 0.0 115.909 178.23 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -76.81 -28.31 55.52 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 129.405 3.082 . . . . 0.0 106.797 164.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -70.08 -34.89 73.74 Favored 'General case' 0 CA--C 1.569 1.704 0 O-C-N 118.769 -2.457 . . . . 0.0 112.483 159.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.804 HD13 ' HB2' ' A' ' 153' ' ' GLN . 20.1 mm -72.1 -11.88 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.087 1 C-N-CA 132.258 4.223 . . . . 0.0 118.05 176.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.3 pttm -60.06 -26.94 66.55 Favored 'General case' 0 C--N 1.32 -0.699 2 N-CA-C 124.157 4.873 . . . . 0.0 124.157 -175.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.34 -20.26 15.93 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 127.239 2.215 . . . . 0.0 108.735 -172.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.631 ' CG ' ' HG2' ' A' ' 153' ' ' GLN . 6.1 m80 -77.22 16.07 0.64 Allowed 'General case' 0 C--N 1.372 1.563 0 C-N-CA 129.174 2.99 . . . . 0.0 112.414 172.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.571 ' HA ' ' CG1' ' A' ' 77' ' ' VAL . 3.9 p -49.99 -27.93 4.08 Favored 'Isoleucine or valine' 0 C--N 1.378 1.82 0 C-N-CA 128.678 2.791 . . . . 0.0 111.569 157.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.24 -31.01 69.29 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 128.215 2.606 . . . . 0.0 113.22 174.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -76.28 -40.06 52.69 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 126.967 2.107 . . . . 0.0 112.324 172.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.571 ' CG1' ' HA ' ' A' ' 74' ' ' VAL 0.461 3.0 p -70.11 -27.82 33.81 Favored 'Isoleucine or valine' 0 C--N 1.367 1.353 0 CA-C-O 124.629 2.156 . . . . 0.0 111.636 171.405 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.461 HD21 ' HB2' ' A' ' 33' ' ' SER . 9.1 m120 -70.12 -38.7 75.64 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.991 2.116 . . . . 0.0 114.39 167.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -30.43 70.0 Favored 'General case' 0 C--N 1.369 1.423 0 CA-C-N 121.075 1.761 . . . . 0.0 111.269 170.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -64.04 -36.17 83.11 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 129.139 2.976 . . . . 0.0 112.03 167.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.8 HD11 HG23 ' A' ' 38' ' ' VAL 0.275 0.5 OUTLIER . . . . . 0 C--N 1.39 2.365 0 O-C-N 119.81 -1.806 . . . . 0.0 113.769 170.321 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.171 0 N-CA-C 119.017 2.367 . . . . 0.0 119.017 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -140.99 140.96 34.44 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 120.961 -1.317 . . . . 0.0 107.695 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 mt -115.95 129.3 56.33 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 127.004 2.122 . . . . 0.0 108.54 -176.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -129.89 110.87 12.04 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 18.0 pt -135.72 139.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 110.673 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -112.49 127.71 56.13 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 173.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.459 ' HB3' HD21 ' A' ' 66' ' ' LEU . 47.8 t0 -139.11 -174.54 3.88 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 100.625 -3.843 . . . . 0.0 100.625 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.81 -59.44 3.01 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 121.468 3.347 . . . . 0.0 121.468 154.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . 0.272 1.1 m-80 129.74 -28.57 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 131.163 3.785 . . . . 0.0 104.403 -144.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.484 HD21 ' CG2' ' A' ' 63' ' ' VAL . 0.2 OUTLIER -79.47 132.47 36.36 Favored 'General case' 0 C--N 1.359 1.006 1 C-N-CA 132.412 4.285 . . . . 0.0 117.959 -171.853 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -92.02 101.48 14.02 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 167.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.443 HD11 ' CD1' ' A' ' 66' ' ' LEU 0.294 1.4 mm? -95.09 121.53 36.82 Favored 'General case' 0 C--N 1.383 2.037 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 176.456 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -116.19 122.65 5.6 Favored Glycine 0 C--N 1.355 1.611 0 N-CA-C 106.484 -2.647 . . . . 0.0 106.484 171.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -117.6 147.0 43.25 Favored 'General case' 0 C--N 1.367 1.347 0 CA-C-N 121.402 2.601 . . . . 0.0 104.656 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.9 m -134.57 133.31 40.09 Favored 'General case' 0 C--N 1.367 1.334 0 N-CA-C 103.118 -2.919 . . . . 0.0 103.118 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -92.84 139.96 17.12 Favored 'Isoleucine or valine' 0 C--N 1.352 0.698 0 C-N-CA 125.497 1.519 . . . . 0.0 109.514 177.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.306 20.0 p -7.41 73.15 0.0 OUTLIER 'General case' 0 C--N 1.38 1.898 0 C-N-CA 131.571 3.948 . . . . 0.0 119.869 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.333 44.5 tttp -44.3 -53.68 13.56 Favored Pre-proline 0 C--N 1.363 1.161 1 C-N-CA 133.585 4.754 . . . . 0.0 116.959 -171.869 . . . . . . . . 3 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.64 71.52 1.45 Allowed 'Trans proline' 0 CA--C 1.564 1.983 0 C-N-CA 123.368 2.712 . . . . 0.0 110.429 161.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -55.66 141.25 38.54 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 120.692 3.59 . . . . 0.0 120.692 -173.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.15 113.48 2.96 Favored 'General case' 0 N--CA 1.425 -1.706 2 N-CA-C 95.529 -5.73 . . . . 0.0 95.529 167.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 33.6 mmtm -71.43 55.98 0.24 Allowed 'General case' 0 C--N 1.345 0.382 0 C-N-CA 129.937 3.295 . . . . 0.0 117.241 -172.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -58.28 148.83 26.04 Favored 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.538 4.335 . . . . 0.0 117.586 177.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.307 0.0 OUTLIER -110.82 48.78 0.9 Allowed 'General case' 0 C--N 1.368 1.391 0 CA-C-O 123.816 1.769 . . . . 0.0 107.546 176.024 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.408 ' N ' ' HD3' ' A' ' 127' ' ' PRO . 31.4 t70 -173.36 62.77 0.28 Allowed Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 130.789 3.635 . . . . 0.0 108.448 176.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.41 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 29.8 Cg_exo -71.78 -177.07 2.32 Favored 'Trans proline' 0 C--N 1.355 0.88 1 C-N-CA 126.589 4.859 . . . . 0.0 118.838 -175.018 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 128' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 42' ' ' HIS . 77.7 p -137.63 153.07 49.92 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-N 110.413 -3.085 . . . . 0.0 103.343 167.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 43.1 mt -103.24 130.68 50.53 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 101.329 -3.582 . . . . 0.0 101.329 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -126.34 67.4 1.22 Allowed 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -160.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 72.5 m 110.8 84.04 0.0 OUTLIER 'General case' 0 C--N 1.372 1.587 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -101.58 109.81 21.68 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 101.418 -3.549 . . . . 0.0 101.418 173.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.52 121.98 45.39 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 127.325 2.25 . . . . 0.0 107.355 -174.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.15 114.76 17.42 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 176.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -133.8 149.73 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-O 123.053 1.406 . . . . 0.0 109.211 -176.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.537 HD13 HD21 ' A' ' 141' ' ' LEU . 0.1 OUTLIER -129.02 -179.7 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 C-N-CA 125.275 1.43 . . . . 0.0 108.597 -175.975 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.524 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -133.6 124.52 27.0 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 128.735 2.814 . . . . 0.0 116.863 -170.876 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 138' ' ' SER . . . . . 0.401 ' HB3' HH11 ' A' ' 139' ' ' ARG 0.36 14.5 m 150.22 -83.8 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.089 1 C-N-CA 132.135 4.174 . . . . 0.0 102.926 176.561 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.65 ' HG2' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER 153.83 152.23 0.01 OUTLIER 'General case' 0 CA--C 1.483 -1.596 1 N-CA-C 96.747 -5.279 . . . . 0.0 96.747 -166.309 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.65 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 39.77 -51.78 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.975 2 CA-C-N 129.347 5.522 . . . . 0.0 124.173 -178.657 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.537 HD21 HD13 ' A' ' 136' ' ' ILE 0.416 0.0 OUTLIER . . . . . 0 N--CA 1.427 -1.621 1 C-N-CA 150.524 11.53 . . . . 0.0 118.821 178.175 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.466 ' CD1' ' HG2' ' A' ' 151' ' ' LYS 0.543 0.0 OUTLIER . . . . . 0 N--CA 1.448 -0.537 0 CA-C-O 124.772 2.225 . . . . 0.0 110.089 . . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.517 ' HD2' ' CE1' ' A' ' 73' ' ' HIS . 0.0 OUTLIER -75.12 158.31 33.29 Favored 'General case' 0 N--CA 1.416 -2.127 1 C-N-CA 145.279 9.432 . . . . 0.0 110.91 -171.888 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.506 ' O ' HG23 ' A' ' 152' ' ' THR . 14.6 t -74.18 113.88 11.89 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 128.003 3.763 . . . . 0.0 102.883 166.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.804 ' HB2' HD13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.402 -2.844 0 CA-C-N 109.582 -3.463 . . . . 0.0 108.841 -167.476 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.1 m120 . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 124.09 1.9 . . . . 0.0 114.264 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -58.23 1.93 Allowed 'General case' 0 N--CA 1.448 -0.557 1 C-N-CA 135.515 5.526 . . . . 0.0 106.768 164.557 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 13.5 mt-10 -66.21 -9.82 35.79 Favored 'General case' 0 C--N 1.369 1.449 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.31 -38.14 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 C-N-CA 129.561 3.145 . . . . 0.0 112.035 177.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -71.56 -47.4 55.29 Favored 'General case' 0 C--N 1.357 0.933 1 C-N-CA 132.148 4.179 . . . . 0.0 107.665 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.9 mt -58.72 -43.88 88.76 Favored 'Isoleucine or valine' 0 C--N 1.37 1.497 0 C-N-CA 125.254 1.422 . . . . 0.0 112.132 168.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HB3' HD13 ' A' ' 58' ' ' ILE 0.296 91.2 mtm-85 -64.09 -50.14 69.48 Favored 'General case' 0 C--N 1.376 1.739 0 O-C-N 120.046 -1.659 . . . . 0.0 114.33 169.09 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 29.7 mtp180 -57.5 -28.64 63.63 Favored 'General case' 0 C--N 1.374 1.639 0 CA-C-N 124.405 3.275 . . . . 0.0 119.165 172.076 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -77.6 -51.64 10.32 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 130.374 3.47 . . . . 0.0 112.006 172.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -57.44 -28.62 63.48 Favored 'General case' 0 C--N 1.378 1.809 0 C-N-CA 128.131 2.572 . . . . 0.0 110.742 170.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.661 HD12 ' HA ' ' A' ' 58' ' ' ILE . 0.2 OUTLIER -70.71 -45.36 65.08 Favored 'General case' 0 C--O 1.206 -1.215 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.544 167.585 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -55.81 -40.39 72.67 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.747 -1.221 . . . . 0.0 114.106 169.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 mmt-85 -63.45 -49.08 75.08 Favored 'General case' 0 C--N 1.374 1.654 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 166.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -56.77 -43.51 80.87 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 129.397 3.079 . . . . 0.0 110.875 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.446 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.76 -54.95 39.01 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 130.546 3.538 . . . . 0.0 112.174 175.753 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -75.82 -39.62 56.42 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 -178.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -73.2 -36.11 66.46 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.749 2.42 . . . . 0.0 112.426 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.654 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.341 33.4 mt-10 -77.64 -29.37 51.66 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 120.463 -1.398 . . . . 0.0 110.89 167.953 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.515 ' CZ ' ' CE2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -59.18 -32.58 70.04 Favored 'General case' 0 C--N 1.383 2.049 0 O-C-N 119.175 -2.203 . . . . 0.0 113.511 168.59 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -45.98 74.27 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 127.774 2.43 . . . . 0.0 109.527 167.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -57.47 -39.75 77.06 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 170.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.1 mt -72.07 -45.56 62.59 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 O-C-N 120.908 -1.12 . . . . 0.0 111.657 177.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.488 1.0 OUTLIER -70.84 -24.16 62.48 Favored 'General case' 0 C--N 1.373 1.61 0 O-C-N 120.179 -1.575 . . . . 0.0 114.283 173.746 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -73.77 -29.99 62.52 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.159 2.184 . . . . 0.0 110.182 169.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.402 ' OE1' ' HD2' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -73.68 -38.46 64.9 Favored 'General case' 0 C--N 1.39 2.346 0 O-C-N 118.315 -2.741 . . . . 0.0 109.739 172.87 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.436 HG12 ' CE2' ' A' ' 41' ' ' PHE . 1.3 mt -64.62 -46.13 93.37 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 CA-C-O 118.04 -0.981 . . . . 0.0 111.101 167.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.8 tpp180 -55.38 -45.0 76.62 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 122.632 2.469 . . . . 0.0 116.705 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.59 -41.16 47.27 Favored 'General case' 0 CA--C 1.488 -1.418 0 C-N-CA 128.018 2.527 . . . . 0.0 112.639 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.13 -31.4 30.6 Favored 'General case' 0 C--N 1.355 0.835 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.297 25.6 p -75.4 -34.82 61.1 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.388 1.475 . . . . 0.0 108.722 177.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -71.15 -35.88 71.85 Favored 'General case' 0 C--N 1.368 1.395 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 165.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 -36.2 64.31 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.79 -14.74 60.31 Favored 'General case' 0 C--N 1.375 1.697 0 CA-C-N 120.761 1.619 . . . . 0.0 114.016 171.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.37 15.42 44.15 Favored Glycine 0 C--N 1.376 2.8 0 O-C-N 121.187 -0.945 . . . . 0.0 114.51 172.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.776 HG22 HD23 ' A' ' 81' ' ' LEU . 7.5 p -99.98 179.37 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 126.379 1.872 . . . . 0.0 107.026 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.82 ' HB3' HD21 ' A' ' 81' ' ' LEU 0.27 32.5 t -83.56 155.71 23.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 124.676 2.179 . . . . 0.0 110.957 167.444 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.9 m -92.89 130.1 38.59 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.935 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.436 ' CE2' HG12 ' A' ' 29' ' ' ILE . 5.0 p90 -113.41 152.73 29.66 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 129.09 2.956 . . . . 0.0 105.704 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -101.5 161.35 13.7 Favored 'General case' 0 C--N 1.354 0.795 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -121.41 120.3 34.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.146 -1.596 . . . . 0.0 111.281 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.55 141.46 51.36 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.768 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 4.3 m-85 -101.48 150.16 23.33 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.892 1.277 . . . . 0.0 108.871 172.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.4 m -123.06 85.78 2.48 Favored 'General case' 0 C--N 1.349 0.587 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 165.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.415 ' HG2' ' H ' ' A' ' 47' ' ' GLN . 4.7 mm-40 -48.24 -10.9 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 121.217 3.784 . . . . 0.0 121.217 -168.034 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.68 -37.55 79.09 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 125.948 3.976 . . . . 0.0 116.166 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.799 HD13 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -68.28 -43.38 77.86 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-O 125.968 2.794 . . . . 0.0 111.132 171.458 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.799 ' H ' HD13 ' A' ' 49' ' ' LEU . 2.7 tt -64.11 -38.72 92.07 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 118.62 -2.55 . . . . 0.0 109.533 176.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -60.43 -32.46 71.38 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 129.621 3.168 . . . . 0.0 109.585 171.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 78.0 mtm180 -63.02 -47.12 84.42 Favored 'General case' 0 C--N 1.391 2.383 0 O-C-N 120.357 -1.464 . . . . 0.0 113.625 161.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -28.59 68.47 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.581 HD12 ' CD2' ' A' ' 50' ' ' LEU 0.336 0.1 OUTLIER -70.3 -39.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 131.698 3.999 . . . . 0.0 111.179 179.299 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.4 mt-30 -107.39 -26.48 10.96 Favored 'General case' 0 C--N 1.372 1.559 0 N-CA-C 117.24 2.311 . . . . 0.0 117.24 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -83.5 -18.6 37.92 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.801 2.091 . . . . 0.0 113.933 -175.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 140' ' ' ARG . 1.9 mp0 -115.21 -67.68 0.98 Allowed 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 127.528 2.331 . . . . 0.0 109.085 166.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.661 ' HA ' HD12 ' A' ' 14' ' ' LEU 0.487 0.3 OUTLIER 74.91 135.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.429 -1.419 . . . . 0.0 111.121 -173.477 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.543 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 21.6 t70 44.88 45.19 8.4 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 130.922 3.689 . . . . 0.0 114.77 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.514 ' HG2' HD11 ' A' ' 14' ' ' LEU 0.399 10.4 pt-20 -74.33 62.26 0.95 Allowed 'General case' 0 CA--C 1.491 -1.308 0 C-N-CA 129.632 3.173 . . . . 0.0 114.436 179.43 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.39 14.0 p -79.0 -20.94 47.82 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.862 2.865 . . . . 0.0 113.18 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.523 ' CD2' HD21 ' A' ' 141' ' ' LEU . 5.9 t80 -64.21 -33.35 75.61 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.726 2.01 . . . . 0.0 111.151 166.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.5 HG23 HD13 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -57.62 -46.48 86.42 Favored 'Isoleucine or valine' 0 C--N 1.37 1.466 0 C-N-CA 128.846 2.858 . . . . 0.0 109.392 -175.674 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.654 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 45.9 m-85 -61.68 -45.39 94.19 Favored 'General case' 0 CA--C 1.495 -1.171 1 C-N-CA 134.184 4.994 . . . . 0.0 112.65 169.527 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -66.12 -44.62 83.76 Favored 'General case' 0 C--N 1.35 0.597 0 CA-C-N 122.001 2.182 . . . . 0.0 114.503 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.717 ' HG ' HD21 ' A' ' 111' ' ' LEU . 1.4 tm? -63.09 -50.46 70.45 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.36 1.864 . . . . 0.0 114.177 166.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.429 ' CZ ' HG13 ' A' ' 63' ' ' VAL 0.742 0.0 OUTLIER -76.7 -29.15 56.16 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 118.979 -2.326 . . . . 0.0 111.59 -175.829 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.402 ' HD2' ' OE1' ' A' ' 28' ' ' GLU . 24.9 m80 -64.17 -28.17 69.57 Favored 'General case' 0 C--N 1.367 1.353 0 C-N-CA 125.489 1.515 . . . . 0.0 112.147 162.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -77.27 -26.66 52.67 Favored 'General case' 0 C--N 1.377 1.786 0 O-C-N 121.214 -0.929 . . . . 0.0 112.017 171.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.322 0.0 OUTLIER -88.13 -44.29 15.68 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 C-N-CA 126.353 1.861 . . . . 0.0 115.054 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.553 9.1 mmpt? -49.02 0.21 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 1 C-N-CA 137.194 6.197 . . . . 0.0 120.365 -178.129 . . . . . . . . 3 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.62 -24.04 67.46 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 131.033 3.733 . . . . 0.0 107.859 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.413 ' NE2' ' HB2' ' A' ' 153' ' ' GLN . 0.1 OUTLIER -42.07 1.55 0.0 OUTLIER 'General case' 0 C--N 1.389 2.315 1 C-N-CA 139.394 7.078 . . . . 0.0 119.207 176.659 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.485 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 46.2 t -50.03 -49.22 22.21 Favored 'Isoleucine or valine' 0 CA--C 1.461 -2.463 1 C-N-CA 135.864 5.666 . . . . 0.0 107.382 170.486 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.49 ' H ' HD22 ' A' ' 75' ' ' LEU . 1.7 mm? -58.88 -29.26 66.88 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 117.468 2.395 . . . . 0.0 117.468 176.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -75.19 -50.84 14.96 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 127.523 2.329 . . . . 0.0 112.634 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.372 14.6 p -66.93 -29.55 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.043 0 C-N-CA 127.631 2.373 . . . . 0.0 111.545 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.485 ' HB3' ' O ' ' A' ' 74' ' ' VAL . 8.0 t-20 -75.11 -32.75 61.49 Favored 'General case' 0 C--N 1.365 1.255 1 C-N-CA 132.322 4.249 . . . . 0.0 112.826 169.135 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . 0.356 6.7 pt-20 -67.74 -29.81 69.13 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 122.407 2.367 . . . . 0.0 110.034 169.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -66.47 -47.66 72.37 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 163.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.82 HD21 ' HB3' ' A' ' 39' ' ' SER 0.381 15.9 tp . . . . . 0 C--N 1.373 1.595 0 C-N-CA 130.011 3.325 . . . . 0.0 119.762 176.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.899 0 N-CA-C 118.164 2.026 . . . . 0.0 118.164 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.2 ptt-85 -141.06 152.54 44.91 Favored 'General case' 0 N--CA 1.44 -0.974 0 O-C-N 121.067 -1.255 . . . . 0.0 109.024 177.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -109.24 125.84 52.68 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 126.37 1.868 . . . . 0.0 107.223 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -128.51 109.4 11.35 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.523 HD11 ' CZ ' ' A' ' 115' ' ' PHE . 9.7 pt -135.97 140.59 43.76 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 C-N-CA 125.235 1.414 . . . . 0.0 112.61 -174.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.419 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 2.7 m -111.57 121.85 46.24 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 119.871 -1.768 . . . . 0.0 108.73 173.658 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.708 ' HB2' HG22 ' A' ' 150' ' ' ILE . 42.1 t0 -139.19 171.77 13.8 Favored 'General case' 0 CA--C 1.504 -0.826 1 N-CA-C 100.093 -4.04 . . . . 0.0 100.093 177.411 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.75 -68.37 3.03 Favored Glycine 0 N--CA 1.475 1.288 0 O-C-N 118.033 -2.917 . . . . 0.0 113.378 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.612 HD21 HD11 ' A' ' 141' ' ' LEU . 0.1 OUTLIER 156.01 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.366 1.294 2 C-N-CA 134.324 5.05 . . . . 0.0 109.474 -152.609 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.717 HD21 ' HG ' ' A' ' 66' ' ' LEU 0.476 1.1 pt? -78.22 137.4 38.11 Favored 'General case' 0 CA--C 1.507 -0.706 1 C-N-CA 134.978 5.311 . . . . 0.0 119.813 -177.543 . . . . . . . . 4 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.34 100.66 13.42 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.435 HD11 ' CD1' ' A' ' 66' ' ' LEU 0.314 0.0 OUTLIER -94.84 127.78 41.1 Favored 'General case' 0 C--N 1.38 1.907 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 176.191 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -125.16 130.43 7.34 Favored Glycine 0 C--N 1.352 1.464 0 N-CA-C 106.138 -2.785 . . . . 0.0 106.138 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.523 ' CZ ' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -131.95 137.17 47.83 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.469 2.634 . . . . 0.0 105.671 178.384 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.0 m -124.99 102.05 7.34 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.841 1.655 . . . . 0.0 106.808 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.08 116.35 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 121.328 1.876 . . . . 0.0 107.276 172.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 1.6 m 3.66 104.58 0.0 OUTLIER 'General case' 0 C--N 1.38 1.921 0 C-N-CA 130.937 3.695 . . . . 0.0 117.677 -160.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.522 ' H ' ' HB2' ' A' ' 130' ' ' GLN . 34.4 ttpt -34.31 -44.25 0.56 Allowed Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 118.474 2.768 . . . . 0.0 118.474 -178.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -98.13 18.7 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.288 0 C-N-CA 123.47 2.78 . . . . 0.0 114.305 172.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.461 12.9 p30 -161.53 108.05 1.38 Allowed 'General case' 0 CA--C 1.562 1.417 0 N-CA-C 118.899 2.926 . . . . 0.0 118.899 -178.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -99.3 -45.05 6.0 Favored 'General case' 0 C--N 1.351 0.671 0 O-C-N 118.67 -2.519 . . . . 0.0 115.193 170.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.411 0.0 OUTLIER -40.2 -14.74 0.01 OUTLIER 'General case' 0 C--N 1.353 0.726 1 C-N-CA 136.278 5.831 . . . . 0.0 120.754 -172.347 . . . . . . . . 4 3 . 1 . 014 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -110.46 -6.07 15.01 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.773 2.029 . . . . 0.0 113.073 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.552 ' HB2' HD13 ' A' ' 81' ' ' LEU 0.416 0.0 OUTLIER 64.65 -51.71 0.31 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 128.379 2.672 . . . . 0.0 117.567 176.341 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.283 2.5 p30 -64.03 -15.97 0.33 Allowed Pre-proline 0 CA--C 1.551 1.004 1 C-N-CA 132.08 4.152 . . . . 0.0 119.562 173.386 . . . . . . . . 3 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.358 39.7 Cg_exo -37.78 -176.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.486 1 C-N-CA 128.771 6.314 . . . . 0.0 121.008 166.464 . . . . . . . . 3 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.0 m -99.61 164.3 12.13 Favored 'General case' 0 CA--C 1.486 -1.518 0 N-CA-C 104.113 -2.551 . . . . 0.0 104.113 -173.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.3 mp -100.12 129.04 46.11 Favored 'General case' 0 C--N 1.348 0.505 0 N-CA-C 100.208 -3.997 . . . . 0.0 100.208 176.079 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.522 ' HB2' ' H ' ' A' ' 119' ' ' LYS . 0.6 OUTLIER -93.19 60.21 3.18 Favored 'General case' 0 C--N 1.364 1.198 0 C-N-CA 126.258 1.823 . . . . 0.0 107.635 -171.038 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.304 1.9 p 102.8 138.27 0.01 OUTLIER 'General case' 0 C--N 1.373 1.593 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 -171.113 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -114.87 133.69 55.76 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 100.796 -3.779 . . . . 0.0 100.796 163.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 7.7 ttp -109.29 120.36 42.27 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 127.263 2.225 . . . . 0.0 105.446 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.627 ' H ' HD21 ' A' ' 49' ' ' LEU . . . -127.71 116.16 19.83 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.0 mm -139.8 138.44 38.66 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 CA-C-N 119.341 0.973 . . . . 0.0 109.495 178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.621 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -127.68 169.03 19.74 Favored 'Isoleucine or valine' 0 C--N 1.349 0.583 0 C-N-CA 128.164 2.586 . . . . 0.0 108.022 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.512 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -100.33 123.64 44.81 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.13 2.972 . . . . 0.0 114.398 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.261 2.5 p 171.86 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 123.934 1.825 . . . . 0.0 115.424 175.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.0 -50.32 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 109.628 -3.442 . . . . 0.0 107.871 -155.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.485 ' HA ' ' O ' ' A' ' 57' ' ' GLU . 14.6 ptp180 175.74 73.81 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.564 0 CA-C-O 126.005 2.812 . . . . 0.0 104.081 -170.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.612 HD11 HD21 ' A' ' 110' ' ' ASN 0.285 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.599 0 N-CA-C 117.764 2.505 . . . . 0.0 117.764 -162.62 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.708 HG22 ' HB2' ' A' ' 108' ' ' ASP 0.506 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.391 0 CA-C-O 126.722 3.153 . . . . 0.0 116.488 . . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.46 ' O ' HG23 ' A' ' 150' ' ' ILE 0.334 5.6 ptpt -78.02 149.6 33.99 Favored 'General case' 0 N--CA 1.423 -1.802 2 C-N-CA 138.292 6.637 . . . . 0.0 113.584 177.24 . . . . . . . . 4 3 . 1 . 014 nuclear build core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 20.2 p -96.33 97.73 9.72 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 118.314 -2.741 . . . . 0.0 107.809 169.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.413 ' HB2' ' NE2' ' A' ' 73' ' ' HIS . 2.5 mt-30 . . . . . 0 C--O 1.257 1.472 1 C-N-CA 135.319 5.448 . . . . 0.0 109.155 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.47 ' HA ' HG13 ' A' ' 7' ' ' VAL . 14.1 m120 . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 122.32 1.057 . . . . 0.0 113.414 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -81.86 -62.56 1.6 Allowed 'General case' 0 C--N 1.348 0.516 1 C-N-CA 133.714 4.806 . . . . 0.0 110.3 176.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -71.29 -9.23 57.79 Favored 'General case' 0 C--N 1.368 1.387 0 C-N-CA 125.585 1.554 . . . . 0.0 112.279 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.47 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.286 0.7 OUTLIER -88.41 -28.45 5.38 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 C-N-CA 126.877 2.071 . . . . 0.0 108.969 174.368 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -72.86 -38.96 66.87 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 125.7 1.6 . . . . 0.0 108.688 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 28.8 mt -61.68 -44.52 98.85 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 C-N-CA 125.051 1.34 . . . . 0.0 110.636 165.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.314 0.6 OUTLIER -58.85 -48.91 79.7 Favored 'General case' 0 C--N 1.367 1.336 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 173.301 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -57.74 -34.11 69.17 Favored 'General case' 0 C--N 1.374 1.636 0 N-CA-C 118.835 2.902 . . . . 0.0 118.835 166.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -77.08 -49.28 15.66 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 128.141 2.576 . . . . 0.0 111.917 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -58.18 -29.28 65.51 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 130.04 3.336 . . . . 0.0 109.375 170.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.717 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -76.14 -37.56 57.84 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 169.832 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -58.45 -44.19 89.1 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.767 1.227 . . . . 0.0 111.419 166.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -62.85 -45.14 93.98 Favored 'General case' 0 C--N 1.382 2.019 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 166.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -42.92 80.85 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 129.542 3.137 . . . . 0.0 112.207 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.448 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -66.01 -54.41 26.34 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 128.509 2.724 . . . . 0.0 113.114 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -74.67 -36.03 62.81 Favored 'General case' 0 C--N 1.367 1.361 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.5 m -72.78 -40.81 65.63 Favored 'General case' 0 C--N 1.365 1.256 0 C-N-CA 125.958 1.703 . . . . 0.0 111.946 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.621 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.545 52.0 mt-10 -77.77 -29.92 51.19 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 119.982 -1.699 . . . . 0.0 114.066 169.519 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -59.32 -36.95 76.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 118.284 -2.76 . . . . 0.0 112.665 168.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.251 7.4 ptm180 -71.22 -33.35 69.8 Favored 'General case' 0 C--N 1.376 1.756 0 C-N-CA 124.031 0.933 . . . . 0.0 112.368 168.458 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -61.91 -48.22 81.41 Favored 'General case' 0 C--N 1.362 1.134 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 170.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.1 mt -72.33 -46.42 57.02 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 O-C-N 121.333 -0.855 . . . . 0.0 110.975 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.567 0.0 OUTLIER -74.23 -23.5 59.17 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 119.761 -1.837 . . . . 0.0 114.29 177.698 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -72.83 -32.78 65.73 Favored 'General case' 0 C--N 1.388 2.24 0 O-C-N 120.213 -1.554 . . . . 0.0 110.515 168.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.52 -40.73 85.1 Favored 'General case' 0 C--N 1.389 2.307 0 O-C-N 118.509 -2.619 . . . . 0.0 112.407 168.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.486 ' HB ' ' CZ ' ' A' ' 41' ' ' PHE 0.395 0.1 OUTLIER -64.77 -44.63 96.43 Favored 'Isoleucine or valine' 0 C--N 1.369 1.422 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 176.461 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -67.97 -38.84 83.23 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -76.51 -35.91 58.06 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 125.325 1.45 . . . . 0.0 111.463 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.8 -33.74 60.15 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 176.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.3 t -73.77 -37.3 65.04 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 125.512 1.525 . . . . 0.0 109.852 175.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp -68.66 -44.65 73.65 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 168.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.25 -30.47 64.91 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.094 1.758 . . . . 0.0 113.543 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.03 -17.53 60.49 Favored 'General case' 0 C--N 1.383 2.022 0 CA-C-N 119.307 0.958 . . . . 0.0 113.197 169.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.37 18.31 28.9 Favored Glycine 0 C--N 1.374 2.693 0 O-C-N 121.179 -0.95 . . . . 0.0 114.775 174.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.488 HG23 HD23 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -111.48 171.59 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 t -59.06 177.84 0.15 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 129.398 3.079 . . . . 0.0 115.979 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.6 m -96.86 126.39 41.97 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 125.689 1.596 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.486 ' CZ ' ' HB ' ' A' ' 29' ' ' ILE 0.286 41.8 p90 -113.6 141.02 47.69 Favored 'General case' 0 C--N 1.357 0.921 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 174.858 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -116.14 164.9 13.79 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 123.42 1.581 . . . . 0.0 113.326 -172.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -121.18 133.96 55.2 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.361 1.864 . . . . 0.0 113.872 -174.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -139.44 162.04 36.02 Favored 'General case' 0 C--N 1.37 1.496 0 N-CA-C 105.026 -2.212 . . . . 0.0 105.026 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.287 9.8 m-85 -125.31 161.34 27.19 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 126.688 1.995 . . . . 0.0 113.589 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.1 m -132.66 89.83 2.69 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 103.334 -2.839 . . . . 0.0 103.334 159.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' A' ' 51' ' ' ASP . 11.1 mp0 -47.45 -10.25 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 131.658 3.983 . . . . 0.0 118.354 -175.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.47 -37.12 56.39 Favored 'General case' 0 N--CA 1.503 2.212 1 CA-C-N 128.417 5.099 . . . . 0.0 119.201 -176.085 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.678 HD12 ' H ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -69.6 -41.37 75.82 Favored 'General case' 0 C--O 1.242 0.7 1 C-N-CA 134.415 5.086 . . . . 0.0 110.82 173.798 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.678 ' H ' HD12 ' A' ' 49' ' ' LEU 0.282 4.2 tt -74.8 -28.99 60.95 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 127.343 2.257 . . . . 0.0 110.707 171.011 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.473 ' HA ' HG22 ' A' ' 54' ' ' ILE . 10.1 t70 -68.05 -31.95 71.96 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 130.323 3.449 . . . . 0.0 108.165 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -70.99 -40.79 71.66 Favored 'General case' 0 C--N 1.373 1.594 0 O-C-N 119.874 -1.766 . . . . 0.0 114.984 160.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.22 62.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.597 ' HA ' HD12 ' A' ' 14' ' ' LEU . 2.7 tt -72.89 -35.9 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 1 C-N-CA 132.064 4.146 . . . . 0.0 110.828 178.292 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.498 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.2 mt-30 -108.63 -30.14 8.37 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 119.155 3.02 . . . . 0.0 119.155 171.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -88.91 -5.24 58.13 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 119.701 -1.875 . . . . 0.0 114.067 -172.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' A' ' 60' ' ' GLU . 2.9 tt0 -137.73 -64.58 0.54 Allowed 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 -178.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.498 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.697 0.0 OUTLIER 119.55 -28.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.374 1.659 0 N-CA-C 121.768 3.988 . . . . 0.0 121.768 167.37 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.717 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 31.1 t70 -147.37 80.34 1.51 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 130.735 3.614 . . . . 0.0 105.992 -170.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.554 ' O ' HG12 ' A' ' 63' ' ' VAL 0.54 12.5 pt-20 -79.77 59.1 3.0 Favored 'General case' 0 C--N 1.38 1.922 0 O-C-N 118.883 -2.386 . . . . 0.0 112.301 177.216 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.369 36.0 p -79.56 -21.66 44.81 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 129.816 3.247 . . . . 0.0 113.955 177.238 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -67.45 -30.24 69.92 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 130.643 3.577 . . . . 0.0 111.132 167.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.693 HG23 HD21 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -64.9 -44.68 96.17 Favored 'Isoleucine or valine' 0 C--N 1.367 1.328 0 C-N-CA 126.078 1.751 . . . . 0.0 110.579 178.773 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.621 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 59.5 m-85 -58.88 -43.33 90.91 Favored 'General case' 0 C--O 1.204 -1.293 1 C-N-CA 133.727 4.811 . . . . 0.0 111.542 170.984 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -67.57 -45.6 75.11 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 121.786 2.084 . . . . 0.0 115.954 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.66 ' CD2' ' HA3' ' A' ' 109' ' ' GLY . 2.8 tm? -62.19 -49.21 76.72 Favored 'General case' 0 CA--C 1.57 1.738 0 O-C-N 119.198 -2.189 . . . . 0.0 112.315 169.015 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.645 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.859 0.0 OUTLIER -77.49 -16.28 58.82 Favored 'General case' 0 C--N 1.379 1.869 0 O-C-N 118.923 -2.361 . . . . 0.0 115.078 -178.657 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . 0.295 22.7 m80 -75.65 -23.13 56.28 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.437 2.295 . . . . 0.0 109.896 163.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.44 71.6 mmtt -75.47 -40.19 57.67 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 114.767 -2.773 . . . . 0.0 114.28 153.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.523 HD13 ' OXT' ' A' ' 153' ' ' GLN . 16.1 mm -53.63 -25.87 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 C-N-CA 129.643 3.177 . . . . 0.0 115.126 175.059 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -52.91 -26.1 13.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 C-N-CA 131.056 3.742 . . . . 0.0 118.209 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -101.3 2.89 40.22 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 125.282 1.433 . . . . 0.0 107.551 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 151' ' ' LYS 0.279 94.3 m-70 -86.17 13.22 8.19 Favored 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.622 2.769 . . . . 0.0 112.177 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.497 ' HB ' HD22 ' A' ' 75' ' ' LEU . 78.6 t -39.16 -55.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.576 1 C-N-CA 133.334 4.654 . . . . 0.0 109.55 157.368 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.497 HD22 ' HB ' ' A' ' 74' ' ' VAL . 3.6 mm? -58.59 -28.52 65.66 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.546 2.338 . . . . 0.0 115.996 176.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -75.47 -44.78 42.27 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 125.319 1.448 . . . . 0.0 112.23 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.415 HG21 ' CE2' ' A' ' 41' ' ' PHE 0.341 0.3 OUTLIER -67.83 -32.11 55.1 Favored 'Isoleucine or valine' 0 C--N 1.371 1.54 0 CA-C-O 124.338 2.018 . . . . 0.0 112.684 175.56 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -74.98 -39.49 61.25 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 129.883 3.273 . . . . 0.0 114.319 173.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.41 -29.2 70.53 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-N 120.694 1.588 . . . . 0.0 112.191 166.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -70.74 -32.08 69.13 Favored 'General case' 0 CA--C 1.58 2.098 0 C-N-CA 126.046 1.739 . . . . 0.0 114.485 167.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.509 HD22 ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.566 0 C-N-CA 128.814 2.846 . . . . 0.0 112.239 169.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.093 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -128.87 159.56 35.41 Favored 'General case' 0 CA--C 1.501 -0.91 0 CA-C-O 123.931 1.824 . . . . 0.0 113.265 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.5 128.8 53.77 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.311 2.645 . . . . 0.0 104.647 174.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -129.78 131.86 46.36 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 103.526 -2.768 . . . . 0.0 103.526 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.511 HD12 HD12 ' A' ' 70' ' ' ILE . 2.8 mt -131.54 133.37 61.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.886 0 C-N-CA 126.487 1.915 . . . . 0.0 108.266 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.6 m -134.1 115.51 14.35 Favored 'General case' 0 C--N 1.353 0.743 0 O-C-N 120.72 -1.237 . . . . 0.0 110.615 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 176.14 -173.2 0.09 Allowed 'General case' 0 C--N 1.365 1.274 0 N-CA-C 100.217 -3.994 . . . . 0.0 100.217 173.098 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.66 ' HA3' ' CD2' ' A' ' 66' ' ' LEU . . . 72.6 9.23 73.77 Favored Glycine 1 CA--C 1.44 -4.597 0 O-C-N 118.285 -2.759 . . . . 0.0 117.29 175.375 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.542 ' O ' HG22 ' A' ' 136' ' ' ILE . 1.5 m-80 70.61 9.24 6.84 Favored 'General case' 0 C--N 1.377 1.781 0 C-N-CA 128.624 2.77 . . . . 0.0 110.876 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.693 HD21 HG23 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -120.56 130.33 54.16 Favored 'General case' 0 N--CA 1.44 -0.946 1 C-N-CA 134.45 5.1 . . . . 0.0 114.601 -164.587 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -112.51 100.15 8.52 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 101.065 -3.68 . . . . 0.0 101.065 174.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.296 1.3 pt? -107.51 138.59 43.45 Favored 'General case' 0 C--N 1.368 1.381 0 O-C-N 120.554 -1.341 . . . . 0.0 109.894 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.76 142.35 13.44 Favored Glycine 0 C--N 1.355 1.616 0 N-CA-C 107.452 -2.259 . . . . 0.0 107.452 172.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.45 132.36 44.23 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 104.636 -2.357 . . . . 0.0 104.636 176.395 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.4 m -109.97 108.94 19.36 Favored 'General case' 0 C--N 1.367 1.342 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.403 HG13 ' CB ' ' A' ' 127' ' ' PRO . 1.0 OUTLIER -75.03 105.31 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 C-N-CA 127.827 2.451 . . . . 0.0 111.663 -176.655 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 16.7 m 42.83 72.58 0.17 Allowed 'General case' 0 C--N 1.368 1.408 0 C-N-CA 129.831 3.252 . . . . 0.0 115.282 -170.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.363 37.9 ttpt -30.81 -62.04 0.25 Allowed Pre-proline 0 C--N 1.361 1.095 1 C-N-CA 132.275 4.23 . . . . 0.0 118.768 -171.924 . . . . . . . . 3 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -71.84 66.97 3.17 Favored 'Trans proline' 0 CA--C 1.556 1.621 0 C-N-CA 125.087 3.858 . . . . 0.0 111.039 169.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.345 7.9 m120 -36.53 149.73 0.02 OUTLIER 'General case' 0 C--N 1.363 1.153 2 N-CA-C 125.615 5.413 . . . . 0.0 125.615 -170.012 . . . . . . . . 3 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -162.65 -46.23 0.04 OUTLIER 'General case' 0 C--N 1.358 0.955 0 C-N-CA 130.91 3.684 . . . . 0.0 113.96 -174.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.353 0.0 OUTLIER 75.54 100.27 0.07 Allowed 'General case' 0 N--CA 1.424 -1.763 1 C-N-CA 133.185 4.594 . . . . 0.0 113.246 -178.833 . . . . . . . . 4 3 . 1 . 015 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -105.62 16.68 25.01 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 117.86 2.541 . . . . 0.0 117.86 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.72 0.0 OUTLIER 19.86 55.11 0.01 OUTLIER 'General case' 0 C--N 1.366 1.289 0 N-CA-C 121.292 3.812 . . . . 0.0 121.292 174.17 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.509 ' HA ' HD22 ' A' ' 81' ' ' LEU . 44.9 m-20 170.59 46.42 0.0 OUTLIER Pre-proline 0 CA--C 1.568 1.667 1 C-N-CA 140.319 7.448 . . . . 0.0 105.785 -172.889 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.43 ' CD ' ' H ' ' A' ' 126' ' ' ASP . 13.7 Cg_exo -92.56 -179.25 1.03 Allowed 'Trans proline' 0 C--N 1.361 1.205 0 CA-C-N 127.349 3.66 . . . . 0.0 118.951 -158.302 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 12.1 p -124.62 150.08 46.39 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.675 -2.342 . . . . 0.0 104.675 174.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 mp -101.82 130.34 48.24 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 102.174 -3.269 . . . . 0.0 102.174 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -114.62 45.72 1.51 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 119.949 -1.72 . . . . 0.0 109.364 -170.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' CYS . . . . . 0.437 ' SG ' HD21 ' A' ' 49' ' ' LEU . 45.4 t 141.81 126.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.522 0 C-N-CA 128.201 2.6 . . . . 0.0 105.194 -170.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -115.36 111.47 20.9 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 102.583 -3.117 . . . . 0.0 102.583 165.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 4.5 ttt -99.43 121.22 40.83 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.03 3.332 . . . . 0.0 108.505 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ALA . . . . . 0.486 ' HB1' HG21 ' A' ' 63' ' ' VAL . . . -128.69 116.44 19.55 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.56 1.544 . . . . 0.0 109.174 178.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.5 mm -136.03 128.29 45.59 Favored 'Isoleucine or valine' 0 C--N 1.365 1.252 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 176.299 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.542 HG22 ' O ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -103.88 171.39 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 C-N-CA 127.723 2.409 . . . . 0.0 108.61 -179.079 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.72 -178.78 5.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.148 1.779 . . . . 0.0 106.398 163.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.744 52.6 p -65.24 75.8 0.06 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 117.644 2.461 . . . . 0.0 117.644 175.02 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ARG . . . . . 0.535 ' CD ' ' H ' ' A' ' 141' ' ' LEU . 0.0 OUTLIER -71.83 -21.49 61.68 Favored 'General case' 0 C--N 1.377 1.772 0 CA-C-N 110.989 -2.823 . . . . 0.0 106.614 148.891 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 139' ' ' ARG 0.402 70.6 mtt85 165.8 -45.86 0.0 OUTLIER 'General case' 0 CA--C 1.473 -2.009 1 C-N-CA 144.85 9.26 . . . . 0.0 114.218 -179.217 . . . . . . . . 4 3 . 1 . 015 nuclear build core ' A' A ' 141' ' ' LEU . . . . . 0.535 ' H ' ' CD ' ' A' ' 139' ' ' ARG 0.262 0.1 OUTLIER . . . . . 0 CA--C 1.55 0.946 0 C-N-CA 129.298 3.039 . . . . 0.0 117.513 -175.756 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.666 HD13 ' O ' ' A' ' 151' ' ' LYS 0.396 0.1 OUTLIER . . . . . 0 CA--C 1.568 1.646 1 N-CA-C 122.548 4.277 . . . . 0.0 122.548 . . . . . . . . . 4 3 . 1 . 015 nuclear build core ' A' A ' 151' ' ' LYS . . . . . 0.666 ' O ' HD13 ' A' ' 150' ' ' ILE . 0.0 OUTLIER -94.16 149.55 21.13 Favored 'General case' 0 CA--C 1.48 -1.744 2 C-N-CA 146.004 9.722 . . . . 0.0 97.652 167.87 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 152' ' ' THR . . . . . 0.584 ' O ' HG23 ' A' ' 152' ' ' THR 0.322 11.3 t -76.1 96.14 3.78 Favored 'General case' 0 CA--C 1.575 1.93 3 CA-C-O 130.563 4.982 . . . . 0.0 122.666 -162.49 . . . . . . . . 4 3 . 1 . 015 nuclear build core ' A' A ' 153' ' ' GLN . . . . . 0.546 ' HA ' HD12 ' A' ' 150' ' ' ILE 0.481 0.0 OUTLIER . . . . . 0 N--CA 1.381 -3.913 2 C-N-CA 136.099 5.759 . . . . 0.0 117.524 166.591 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.7 mmm . . . . . 0 C--O 1.231 0.129 0 CA-C-O 123.04 1.4 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.7 m -168.83 165.83 11.61 Favored 'General case' 0 C--N 1.357 0.924 0 N-CA-C 101.343 -3.577 . . . . 0.0 101.343 -173.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 mm -80.89 54.51 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.365 1.263 0 C-N-CA 128.651 2.78 . . . . 0.0 112.468 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.455 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 2.3 t-20 -44.67 -15.85 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 1 C-N-CA 136.564 5.946 . . . . 0.0 117.743 -176.813 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -58.76 6.66 Favored 'General case' 0 N--CA 1.445 -0.715 1 C-N-CA 132.95 4.5 . . . . 0.0 112.274 169.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.84 -25.87 62.14 Favored 'General case' 0 C--N 1.37 1.469 0 C-N-CA 126.907 2.083 . . . . 0.0 113.065 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.455 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.9 OUTLIER -77.01 -39.52 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.947 0 C-N-CA 129.721 3.208 . . . . 0.0 112.551 176.698 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.431 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 27.3 t80 -65.36 -45.05 85.69 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 129.039 2.935 . . . . 0.0 109.611 175.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.3 -43.73 86.72 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 126.625 1.97 . . . . 0.0 110.99 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.651 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.257 9.2 ttp-105 -66.34 -47.32 73.84 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.547 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.431 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.8 mtm180 -61.17 -27.63 68.55 Favored 'General case' 0 C--N 1.377 1.762 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 167.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -77.12 -48.75 16.89 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 128.691 2.796 . . . . 0.0 110.139 173.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.606 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 27.6 mmtt -57.8 -28.44 64.02 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 127.529 2.331 . . . . 0.0 110.573 169.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 58' ' ' ILE . 0.3 OUTLIER -66.68 -49.07 67.31 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.519 166.271 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.416 ' HB2' HD11 ' A' ' 54' ' ' ILE . 39.2 ttt85 -55.81 -34.68 65.55 Favored 'General case' 0 C--N 1.353 0.742 0 CA-C-N 121.15 1.795 . . . . 0.0 115.21 169.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.606 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.289 0.1 OUTLIER -73.7 -37.04 65.31 Favored 'General case' 0 C--N 1.386 2.17 0 O-C-N 120.065 -1.647 . . . . 0.0 113.812 170.088 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.13 -44.27 97.59 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 129.063 2.945 . . . . 0.0 111.041 172.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.508 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -61.17 -52.59 64.18 Favored 'General case' 0 C--N 1.371 1.508 1 C-N-CA 132.003 4.121 . . . . 0.0 110.315 175.598 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -74.56 -39.53 62.22 Favored 'General case' 0 C--N 1.373 1.608 0 N-CA-C 118.218 2.673 . . . . 0.0 118.218 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -73.16 -40.52 64.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.024 1.73 . . . . 0.0 112.18 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.307 4.1 mp0 -75.95 -28.92 58.12 Favored 'General case' 0 C--N 1.355 0.812 0 O-C-N 118.637 -2.539 . . . . 0.0 110.41 171.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.339 0.3 OUTLIER -65.18 -31.21 72.27 Favored 'General case' 0 C--N 1.384 2.077 0 O-C-N 119.824 -1.797 . . . . 0.0 113.688 166.956 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.394 0.0 OUTLIER -66.36 -35.49 80.49 Favored 'General case' 0 C--N 1.382 2.02 0 CA-C-N 119.033 0.833 . . . . 0.0 111.8 166.604 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.519 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 47.2 tt0 -62.55 -45.02 94.85 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 169.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.488 HG12 ' CE1' ' A' ' 68' ' ' HIS . 3.1 mt -69.77 -43.48 79.88 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 O-C-N 120.617 -1.302 . . . . 0.0 113.06 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER -70.34 -26.49 63.77 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 119.379 0.991 . . . . 0.0 113.004 176.205 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -69.41 -39.78 77.72 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 121.109 -0.994 . . . . 0.0 110.166 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.401 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.492 0.0 OUTLIER -67.07 -35.01 78.9 Favored 'General case' 0 C--N 1.403 2.911 0 CA-C-N 120.405 1.457 . . . . 0.0 113.21 168.575 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.402 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.7 mt -61.92 -44.73 99.29 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 120.797 1.635 . . . . 0.0 114.702 174.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -59.96 -47.31 86.31 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 172.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -77.34 -37.45 52.41 Favored 'General case' 0 C--N 1.372 1.553 0 C-N-CA 125.165 1.386 . . . . 0.0 114.265 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.609 ' CB ' HG11 ' A' ' 74' ' ' VAL . . . -80.35 -34.01 36.87 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-O 121.638 0.732 . . . . 0.0 112.409 -178.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.6 t -71.35 -36.15 71.41 Favored 'General case' 0 C--N 1.365 1.245 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 42.2 mmtt -64.14 -42.42 96.8 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 167.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.38 -32.11 66.14 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 126.881 2.073 . . . . 0.0 113.936 176.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.32 -19.36 58.3 Favored 'General case' 0 C--N 1.375 1.692 0 C-N-CA 125.382 1.473 . . . . 0.0 111.94 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.03 17.7 31.5 Favored Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.272 0.869 . . . . 0.0 115.272 171.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.561 HG23 HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -123.76 147.18 28.24 Favored 'Isoleucine or valine' 0 C--N 1.358 0.974 0 CA-C-O 123.544 1.64 . . . . 0.0 108.998 -178.249 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.498 ' HB2' HD11 ' A' ' 81' ' ' LEU 0.277 10.0 t 5.8 -79.88 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.302 1 C-N-CA 132.715 4.406 . . . . 0.0 119.736 -173.777 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.0 m 121.71 124.27 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.689 2 N-CA-C 98.863 -4.495 . . . . 0.0 98.863 -169.243 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.454 ' CZ ' HG22 ' A' ' 77' ' ' VAL . 10.7 p90 -113.24 142.54 45.69 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -100.7 126.63 47.24 Favored 'General case' 0 C--N 1.361 1.103 0 C-N-CA 125.758 1.623 . . . . 0.0 108.039 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 HD22 ' A' ' 129' ' ' LEU . 0.1 OUTLIER -95.78 128.29 42.53 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.838 -173.856 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -139.34 143.97 38.03 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 101.994 -3.335 . . . . 0.0 101.994 177.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.533 ' CE1' HD13 ' A' ' 50' ' ' LEU . 2.4 p90 -131.09 154.39 48.33 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.61 118.79 28.51 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 127.26 2.224 . . . . 0.0 107.585 173.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.446 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.502 0.0 OUTLIER -68.39 -10.32 54.33 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 129.224 3.01 . . . . 0.0 116.936 -174.404 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.64 -41.29 27.3 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 128.09 2.556 . . . . 0.0 111.489 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 133' ' ' MET . 0.1 OUTLIER -59.42 -47.7 84.45 Favored 'General case' 0 C--N 1.375 1.675 0 CA-C-O 127.738 3.637 . . . . 0.0 109.102 170.777 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.533 HD13 ' CE1' ' A' ' 45' ' ' TYR 0.279 7.0 tt -74.11 -31.58 62.84 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-N 110.567 -3.015 . . . . 0.0 111.116 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -62.34 -34.33 76.44 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 125.821 1.648 . . . . 0.0 109.537 170.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -62.63 -47.86 81.91 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.53 -1.356 . . . . 0.0 113.232 167.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.48 -27.26 65.99 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 117.885 2.55 . . . . 0.0 117.885 171.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.499 HD12 ' CD2' ' A' ' 50' ' ' LEU 0.302 0.1 OUTLIER -73.68 -42.93 54.87 Favored 'Isoleucine or valine' 0 C--N 1.347 0.496 0 C-N-CA 129.52 3.128 . . . . 0.0 110.884 178.975 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -103.2 -26.83 12.84 Favored 'General case' 0 C--N 1.38 1.912 0 N-CA-C 117.079 2.251 . . . . 0.0 117.079 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -87.44 -29.14 21.66 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 119.456 -2.028 . . . . 0.0 111.426 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -124.97 44.05 2.88 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 128.392 2.677 . . . . 0.0 107.491 -172.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.651 HD11 ' HE ' ' A' ' 10' ' ' ARG 0.393 0.5 OUTLIER -56.19 134.32 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 C-N-CA 125.986 1.714 . . . . 0.0 112.419 -177.331 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.494 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 24.9 t70 57.54 21.21 6.85 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 130.822 3.649 . . . . 0.0 113.202 -173.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.463 0.7 OUTLIER -73.97 80.52 1.68 Allowed 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.863 2.865 . . . . 0.0 109.626 170.0 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.3 p -82.06 -26.59 33.56 Favored 'General case' 0 N--CA 1.437 -1.089 2 C-N-CA 141.404 7.882 . . . . 0.0 110.92 162.01 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.94 -33.32 71.75 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 128.008 2.523 . . . . 0.0 109.582 172.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.557 ' HA ' HD22 ' A' ' 111' ' ' LEU . 3.2 t -43.18 -57.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.993 1 C-N-CA 132.455 4.302 . . . . 0.0 111.572 165.195 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 47.8 m-85 -62.5 -36.74 83.5 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 131.452 3.901 . . . . 0.0 113.468 172.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -72.98 -45.29 58.82 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 126.259 1.823 . . . . 0.0 111.607 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.576 HD13 HD13 ' A' ' 70' ' ' ILE . 3.2 tm? -63.19 -38.44 91.17 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.559 1.544 . . . . 0.0 113.268 169.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.682 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.974 0.0 OUTLIER -78.27 -17.48 56.6 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 117.742 2.497 . . . . 0.0 117.742 170.739 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.519 ' CE1' ' HB3' ' A' ' 24' ' ' GLN . 25.4 m-70 -84.51 -19.13 33.74 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 129.014 2.926 . . . . 0.0 109.682 171.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.61 ' O ' HG21 ' A' ' 152' ' ' THR . 48.6 mmtm -93.74 -27.34 16.55 Favored 'General case' 0 C--N 1.364 1.223 0 C-N-CA 126.434 1.894 . . . . 0.0 107.895 168.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.682 ' HB ' ' HA ' ' A' ' 67' ' ' PHE 0.356 0.9 OUTLIER -74.98 -12.13 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 C-N-CA 129.787 3.235 . . . . 0.0 112.684 178.327 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HB2' ' CD ' ' A' ' 28' ' ' GLU 0.313 19.2 ptmt -49.49 -35.32 19.45 Favored 'General case' 0 N--CA 1.428 -1.542 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 -169.26 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.276 26.6 m-20 -78.77 -15.05 58.9 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 127.448 2.299 . . . . 0.0 108.565 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.716 ' CD2' ' HA ' ' A' ' 152' ' ' THR 0.373 0.0 OUTLIER -66.8 -7.08 18.82 Favored 'General case' 0 C--N 1.379 1.859 0 C-N-CA 129.173 2.989 . . . . 0.0 109.379 167.62 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.609 HG11 ' CB ' ' A' ' 32' ' ' ALA . 13.0 p -43.57 -38.66 1.18 Allowed 'Isoleucine or valine' 1 C--N 1.428 4.016 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 151.328 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 2.7 tm? -61.74 -36.49 81.13 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 129.941 3.296 . . . . 0.0 115.419 172.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.547 ' HA ' ' HG3' ' A' ' 79' ' ' GLU . 71.1 mm-40 -75.26 -38.82 60.32 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 120.211 -1.555 . . . . 0.0 111.442 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.454 HG22 ' CZ ' ' A' ' 41' ' ' PHE 0.415 0.1 OUTLIER -71.47 -29.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 CA-C-O 124.472 2.082 . . . . 0.0 112.203 171.89 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.502 ' HA ' HD22 ' A' ' 78' ' ' ASN . 0.9 OUTLIER -70.01 -46.79 64.37 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 127.706 2.402 . . . . 0.0 116.782 168.407 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.333 0.8 OUTLIER -66.94 -29.51 69.4 Favored 'General case' 0 C--N 1.371 1.517 0 C-N-CA 127.332 2.253 . . . . 0.0 110.288 176.785 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -60.31 -45.66 92.61 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.02 2.528 . . . . 0.0 112.07 163.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.561 HD13 HG23 ' A' ' 38' ' ' VAL . 3.3 tt -70.84 -35.17 72.33 Favored 'General case' 0 N--CA 1.502 2.152 0 CA-C-N 122.524 2.42 . . . . 0.0 115.546 168.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.6 m -66.09 3.87 0.78 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 129.325 3.05 . . . . 0.0 118.754 -170.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.842 ' CE ' HG23 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -73.54 166.59 42.65 Favored Pre-proline 0 C--N 1.359 1.012 0 C-N-CA 127.524 2.33 . . . . 0.0 113.497 -179.145 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.99 -178.68 0.43 Allowed 'Trans proline' 0 CA--C 1.56 1.799 1 C-N-CA 125.818 4.346 . . . . 0.0 113.407 174.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -59.92 142.2 98.05 Favored 'Trans proline' 0 C--N 1.362 1.246 1 CA-C-N 128.724 4.152 . . . . 0.0 113.477 -177.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.578 ' HE ' ' HA ' ' A' ' 125' ' ' LYS 0.276 22.0 mmt180 -58.48 -59.99 11.73 Favored Pre-proline 0 C--N 1.376 1.742 0 C-N-CA 126.416 1.887 . . . . 0.0 111.042 -176.31 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.4 139.06 37.17 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 N-CA-C 118.19 2.342 . . . . 0.0 118.19 156.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.11 -11.46 8.45 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 111.402 -2.636 . . . . 0.0 110.244 169.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -165.61 176.09 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.755 1 C-N-CA 137.439 6.296 . . . . 0.0 102.995 -168.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -114.23 -14.69 12.27 Favored 'General case' 0 C--N 1.346 0.433 0 C-N-CA 124.89 1.276 . . . . 0.0 109.334 173.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.74 -49.28 18.67 Favored 'General case' 0 C--N 1.363 1.164 0 N-CA-C 116.593 2.071 . . . . 0.0 116.593 -177.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -119.22 -8.77 10.07 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 126.477 1.911 . . . . 0.0 110.897 -175.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.728 1.1 p90 38.7 -73.92 0.0 OUTLIER 'General case' 0 C--N 1.349 0.558 2 C-N-CA 132.936 4.495 . . . . 0.0 122.279 -174.301 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 97' ' ' VAL . 1.8 pt -85.45 86.95 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 CA-C-O 127.747 3.641 . . . . 0.0 113.72 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -96.41 -27.69 14.8 Favored 'General case' 0 C--N 1.312 -1.04 2 CA-C-N 105.41 -5.359 . . . . 0.0 110.174 -177.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.55 -7.84 85.66 Favored Glycine 0 C--N 1.362 1.978 0 C-N-CA 125.786 1.66 . . . . 0.0 112.228 170.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.842 HG23 ' CE ' ' A' ' 83' ' ' MET . 77.9 t -109.68 117.99 55.82 Favored 'Isoleucine or valine' 0 C--N 1.359 1.002 0 CA-C-O 123.862 1.792 . . . . 0.0 107.331 176.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -86.21 36.64 0.69 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 130.269 3.428 . . . . 0.0 113.846 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 8.5 t80 73.19 78.75 0.14 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 130.849 3.659 . . . . 0.0 113.451 -178.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -112.49 156.17 42.68 Favored Pre-proline 0 C--N 1.362 1.112 0 O-C-N 120.214 -1.554 . . . . 0.0 110.492 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -79.48 163.08 24.64 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 124.577 3.518 . . . . 0.0 112.703 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.85 8.21 67.15 Favored Glycine 0 C--N 1.355 1.627 0 C-N-CA 126.056 1.788 . . . . 0.0 117.345 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 ptt85 -140.99 160.04 40.93 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 123.194 1.473 . . . . 0.0 110.163 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.4 131.68 54.84 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 127.375 2.27 . . . . 0.0 104.992 177.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -128.53 116.43 19.65 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 -174.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.687 HD12 ' CE1' ' A' ' 73' ' ' HIS . 28.9 mm -122.33 130.15 74.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.009 1.324 . . . . 0.0 109.5 -172.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.612 HG22 ' H ' ' A' ' 149' ' ' VAL 0.436 10.5 t -139.5 150.84 45.61 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 117.088 -3.508 . . . . 0.0 112.396 178.752 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.618 ' HB2' ' HB2' ' A' ' 151' ' ' LYS . 0.3 OUTLIER 173.76 164.75 0.18 Allowed 'General case' 0 C--N 1.362 1.129 0 N-CA-C 103.459 -2.793 . . . . 0.0 103.459 162.905 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' A' ' 110' ' ' ASN . . . 43.39 45.97 6.75 Favored Glycine 0 CA--C 1.454 -3.751 0 C-N-CA 129.547 3.451 . . . . 0.0 120.097 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 3.4 m-80 88.43 -9.66 0.49 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 130.057 3.343 . . . . 0.0 114.292 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.557 HD22 ' HA ' ' A' ' 63' ' ' VAL . 18.2 tp -102.19 133.52 46.91 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 126.87 2.068 . . . . 0.0 114.819 -177.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -111.78 100.07 8.64 Favored 'General case' 0 C--N 1.366 1.307 0 N-CA-C 101.256 -3.609 . . . . 0.0 101.256 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.486 HD21 HG21 ' A' ' 70' ' ' ILE 0.252 0.0 OUTLIER -115.36 119.85 37.64 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 119.83 -1.793 . . . . 0.0 106.578 -178.765 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -124.49 154.7 18.03 Favored Glycine 0 C--N 1.355 1.602 0 O-C-N 117.299 -3.376 . . . . 0.0 109.226 -174.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -132.44 134.11 44.68 Favored 'General case' 0 C--N 1.368 1.377 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 35.8 m -124.73 135.83 53.34 Favored 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 103.165 -2.902 . . . . 0.0 103.165 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 53.3 t -54.82 159.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 C-N-CA 129.167 2.987 . . . . 0.0 112.158 173.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 130' ' ' GLN 0.335 91.5 m -64.01 98.65 0.22 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 116.918 -1.913 . . . . 0.0 113.183 167.718 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -64.16 -36.67 20.9 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -175.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -85.14 72.71 4.47 Favored 'Trans proline' 0 CA--C 1.56 1.814 0 CA-C-N 126.005 3.18 . . . . 0.0 112.598 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.426 8.7 p30 -163.43 -136.6 0.03 OUTLIER 'General case' 0 C--N 1.377 1.796 0 N-CA-C 116.697 2.11 . . . . 0.0 116.697 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -95.84 -27.2 15.32 Favored 'General case' 0 C--N 1.376 1.732 0 C-N-CA 131.003 3.721 . . . . 0.0 113.919 174.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.452 0.0 OUTLIER 56.72 71.54 0.56 Allowed 'General case' 0 N--CA 1.423 -1.796 1 C-N-CA 134.745 5.218 . . . . 0.0 115.191 -176.243 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -63.52 52.5 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 130.116 3.367 . . . . 0.0 116.098 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.578 ' HA ' ' HE ' ' A' ' 86' ' ' ARG 0.467 4.7 mptt 82.03 -68.38 0.08 Allowed 'General case' 0 N--CA 1.438 -1.045 1 C-N-CA 131.719 4.007 . . . . 0.0 110.498 176.977 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -172.3 82.6 0.45 Allowed Pre-proline 0 C--N 1.353 0.739 0 CA-C-O 115.779 -2.057 . . . . 0.0 111.314 168.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.403 ' HA ' ' HB3' ' A' ' 41' ' ' PHE . 1.6 Cg_endo -123.85 16.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.369 1.612 0 CA-C-N 127.056 3.556 . . . . 0.0 118.848 177.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.319 4.2 p -147.71 159.2 44.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 111.959 -2.382 . . . . 0.0 109.063 162.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.428 HD22 HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -116.3 140.72 49.03 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 103.405 -2.813 . . . . 0.0 103.405 168.094 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.443 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 49.9 tp60 -130.41 72.02 1.48 Allowed 'General case' 0 C--N 1.361 1.082 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' CYS . . . . . 0.537 ' SG ' HD22 ' A' ' 49' ' ' LEU . 49.4 t 128.99 115.73 0.0 OUTLIER 'General case' 0 C--N 1.362 1.13 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 -174.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.553 ' O ' HD21 ' A' ' 49' ' ' LEU . 8.1 mmm180 -115.81 108.98 17.01 Favored 'General case' 0 N--CA 1.446 -0.672 1 N-CA-C 99.707 -4.183 . . . . 0.0 99.707 164.038 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.709 ' HA ' HD11 ' A' ' 49' ' ' LEU . 3.4 ttp -92.69 108.91 20.35 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 128.284 2.634 . . . . 0.0 109.15 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.482 ' O ' HD13 ' A' ' 135' ' ' ILE . . . -116.9 113.98 23.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.482 HD13 ' O ' ' A' ' 134' ' ' ALA . 47.3 mm -145.16 132.61 15.93 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.482 HD12 HD13 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -117.08 -175.83 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-O 125.326 2.488 . . . . 0.0 108.882 -174.379 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.317 0.4 OUTLIER -134.42 132.41 39.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 108.955 -3.748 . . . . 0.0 106.713 160.772 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.672 ' HB2' ' HB2' ' A' ' 141' ' ' LEU 0.286 25.2 m -145.01 -119.85 0.08 Allowed 'General case' 0 N--CA 1.485 1.288 0 O-C-N 118.615 -2.553 . . . . 0.0 116.942 -174.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.741 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.1 OUTLIER -108.57 -75.66 0.63 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 130.879 3.672 . . . . 0.0 110.71 -167.852 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.741 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 14.5 ptp180 -79.66 -9.33 59.62 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 130.704 3.601 . . . . 0.0 111.685 170.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.672 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER -77.9 127.43 81.92 Favored Pre-proline 0 N--CA 1.415 -2.179 0 CA-C-N 112.744 -2.026 . . . . 0.0 116.445 -159.067 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -62.14 -0.93 1.97 Allowed 'Trans proline' 0 C--N 1.322 -0.866 1 C-N-CA 126.784 4.989 . . . . 0.0 121.607 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.607 ' H ' HD23 ' A' ' 141' ' ' LEU . . . 33.34 110.73 0.0 OUTLIER Glycine 0 N--CA 1.477 1.372 2 C-N-CA 132.97 5.081 . . . . 0.0 125.458 170.677 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -104.45 152.63 22.1 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.411 1.885 . . . . 0.0 114.155 176.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -144.89 121.78 11.3 Favored 'General case' 0 C--N 1.367 1.341 0 C-N-CA 124.769 1.227 . . . . 0.0 109.32 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 14.5 m -91.02 -8.74 48.23 Favored 'General case' 0 C--N 1.364 1.226 0 N-CA-C 119.823 3.268 . . . . 0.0 119.823 -170.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.373 50.3 mmtm 110.5 -10.79 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 129.795 3.238 . . . . 0.0 110.353 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.45 . . 92.22 134.4 0.03 OUTLIER 'General case' 0 C--N 1.355 0.807 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 166.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.612 ' H ' HG22 ' A' ' 107' ' ' THR . 34.8 m -136.93 -161.33 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.369 1.424 0 C-N-CA 130.351 3.46 . . . . 0.0 110.224 -172.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.817 HD13 ' O ' ' A' ' 151' ' ' LYS 0.409 0.0 OUTLIER -131.92 144.7 36.46 Favored 'Isoleucine or valine' 0 C--N 1.373 1.607 0 N-CA-C 120.82 3.637 . . . . 0.0 120.82 -179.251 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.817 ' O ' HD13 ' A' ' 150' ' ' ILE 0.515 4.5 tptp -71.13 160.79 32.23 Favored 'General case' 0 CA--C 1.461 -2.463 1 C-N-CA 153.109 12.563 . . . . 0.0 103.913 -175.689 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.716 ' HA ' ' CD2' ' A' ' 73' ' ' HIS 0.398 9.8 t -71.44 97.23 1.6 Allowed 'General case' 0 CA--C 1.571 1.766 1 CA-C-O 130.546 4.974 . . . . 0.0 121.11 -173.12 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.686 2 CA-C-N 100.419 -7.628 . . . . 0.0 112.741 162.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 123.778 1.751 . . . . 0.0 113.963 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.3 p -97.73 138.06 35.67 Favored 'General case' 0 C--N 1.351 0.67 0 C-N-CA 130.112 3.365 . . . . 0.0 111.599 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 mm -76.47 48.81 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.371 1.52 0 O-C-N 118.955 -2.34 . . . . 0.0 114.793 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.451 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 5.5 t-20 -62.12 0.42 0.41 Allowed 'General case' 0 N--CA 1.476 0.834 1 C-N-CA 137.044 6.138 . . . . 0.0 115.314 -179.238 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.61 -62.74 1.27 Allowed 'General case' 0 C--N 1.352 0.698 1 C-N-CA 133.866 4.867 . . . . 0.0 112.395 172.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -72.92 -20.04 61.15 Favored 'General case' 0 C--N 1.374 1.668 0 O-C-N 120.146 -1.596 . . . . 0.0 112.847 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.451 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.3 m -76.27 -34.81 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 129.789 3.235 . . . . 0.0 111.215 173.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -66.99 -41.56 86.55 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 127.769 2.428 . . . . 0.0 108.513 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.7 mt -59.29 -43.91 91.0 Favored 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 124.538 1.135 . . . . 0.0 112.862 167.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.268 77.0 mtp85 -63.45 -49.11 74.94 Favored 'General case' 0 C--N 1.373 1.606 0 O-C-N 120.236 -1.54 . . . . 0.0 115.033 170.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -60.29 -27.31 67.19 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 171.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -76.99 -50.67 12.64 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 127.856 2.462 . . . . 0.0 110.678 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -57.3 -29.08 63.6 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 127.623 2.369 . . . . 0.0 110.856 171.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.485 HD22 ' C ' ' A' ' 58' ' ' ILE . 12.0 tp -68.5 -49.09 62.28 Favored 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 125.637 1.575 . . . . 0.0 112.295 168.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -55.34 -39.21 69.73 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.353 -1.467 . . . . 0.0 112.213 172.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 64.8 mmt-85 -62.4 -48.71 78.52 Favored 'General case' 0 C--N 1.372 1.575 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 163.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.498 ' HB3' HG22 ' A' ' 61' ' ' THR . 48.1 m80 -56.35 -46.49 79.95 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 129.644 3.178 . . . . 0.0 111.577 174.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.524 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.43 -53.05 62.57 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 131.472 3.909 . . . . 0.0 111.011 173.565 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -74.33 -43.98 54.37 Favored 'General case' 0 C--N 1.377 1.79 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 t -66.98 -38.03 85.31 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.515 2.326 . . . . 0.0 112.231 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.583 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.34 41.7 mt-10 -76.91 -29.17 55.58 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 125.369 1.468 . . . . 0.0 112.145 170.525 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -33.97 72.88 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 121.415 1.916 . . . . 0.0 113.037 167.054 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -66.38 -44.69 82.42 Favored 'General case' 0 C--N 1.377 1.797 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.894 164.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -57.69 -40.25 79.04 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.805 2.15 . . . . 0.0 116.805 170.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.462 HD11 ' CD1' ' A' ' 64' ' ' PHE . 1.0 OUTLIER -69.24 -45.64 78.96 Favored 'Isoleucine or valine' 0 C--N 1.366 1.317 0 C-N-CA 125.683 1.593 . . . . 0.0 111.106 178.043 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.758 0.0 OUTLIER -73.54 -23.26 59.96 Favored 'General case' 0 C--N 1.369 1.452 0 O-C-N 121.296 -0.878 . . . . 0.0 112.929 177.129 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.53 -41.15 66.17 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.945 1.698 . . . . 0.0 111.592 168.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.587 0.8 OUTLIER -63.65 -29.32 70.57 Favored 'General case' 0 C--N 1.403 2.908 0 O-C-N 119.507 -1.996 . . . . 0.0 113.426 169.875 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.497 ' HA ' HG21 ' A' ' 74' ' ' VAL . 7.2 mt -68.78 -50.5 54.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.416 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 166.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.1 mtm180 -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 121.152 1.796 . . . . 0.0 114.743 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.21 -45.23 27.23 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 125.228 1.411 . . . . 0.0 111.417 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.446 ' HB3' HG11 ' A' ' 74' ' ' VAL . . . -75.53 -31.91 60.27 Favored 'General case' 0 C--N 1.359 1.019 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -178.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.4 t -78.71 -34.18 46.21 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 127.138 2.175 . . . . 0.0 108.847 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -72.42 -43.25 64.13 Favored 'General case' 0 C--N 1.384 2.076 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 165.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.42 73.14 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 126.399 1.879 . . . . 0.0 114.601 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.28 -16.86 60.92 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 119.082 0.855 . . . . 0.0 112.495 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.83 17.75 40.08 Favored Glycine 0 C--N 1.376 2.764 0 C-N-CA 124.413 1.006 . . . . 0.0 114.12 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.649 HG21 ' HB3' ' A' ' 78' ' ' ASN . 2.3 t -102.16 179.76 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.239 0 C-N-CA 128.113 2.565 . . . . 0.0 111.106 -172.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.592 ' H ' HG12 ' A' ' 38' ' ' VAL 0.397 3.1 t -75.09 -144.93 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.436 2.294 . . . . 0.0 113.834 178.927 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.2 m -150.6 157.66 43.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 119.122 -2.236 . . . . 0.0 107.588 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.491 ' CE1' HD13 ' A' ' 29' ' ' ILE . 19.9 p90 -128.63 154.64 46.04 Favored 'General case' 0 C--N 1.349 0.554 0 C-N-CA 124.559 1.144 . . . . 0.0 109.727 -177.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -100.92 114.62 28.66 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 101.847 -3.39 . . . . 0.0 101.847 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.345 0.0 OUTLIER -115.4 128.75 56.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.256 -1.528 . . . . 0.0 107.572 -170.713 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -130.83 146.04 52.16 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 121.076 -1.015 . . . . 0.0 109.295 -178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.498 ' CE1' HD13 ' A' ' 50' ' ' LEU . 21.0 p90 -99.97 159.3 15.19 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 124.983 1.313 . . . . 0.0 110.588 177.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.1 p -108.72 118.83 37.81 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 124.46 1.104 . . . . 0.0 108.562 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.468 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.439 0.0 OUTLIER -74.8 -10.8 59.85 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 119.458 3.133 . . . . 0.0 119.458 -170.435 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.74 -48.6 24.84 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 122.161 2.255 . . . . 0.0 113.049 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.585 HD13 ' HA ' ' A' ' 133' ' ' MET . 3.7 pp -67.14 -31.46 71.91 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 128.726 2.811 . . . . 0.0 112.93 173.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.53 ' CD2' HD12 ' A' ' 54' ' ' ILE 0.306 6.2 tt -75.56 -42.72 51.52 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 128.593 2.757 . . . . 0.0 109.848 173.408 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.54 -30.32 67.01 Favored 'General case' 0 C--N 1.378 1.831 0 C-N-CA 128.471 2.708 . . . . 0.0 111.246 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -77.96 -41.32 36.53 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 119.87 -1.769 . . . . 0.0 114.508 164.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.44 -34.36 78.11 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.53 HD12 ' CD2' ' A' ' 50' ' ' LEU . 4.0 tt -66.73 -39.02 82.73 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 C-N-CA 130.421 3.489 . . . . 0.0 112.793 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -104.56 -23.79 13.08 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 174.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.77 -22.71 39.9 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 119.023 -2.298 . . . . 0.0 112.894 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.544 ' HB3' ' HB3' ' A' ' 60' ' ' GLU . 3.1 mm-40 -127.91 14.37 6.86 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -177.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.485 ' C ' HD22 ' A' ' 14' ' ' LEU 0.478 0.3 OUTLIER 20.64 -28.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.985 2 C-N-CA 136.678 5.991 . . . . 0.0 126.621 177.628 . . . . . . . . 5 4 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -155.3 64.68 0.62 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.564 ' O ' HG12 ' A' ' 63' ' ' VAL 0.452 6.7 pt-20 -87.44 61.93 6.87 Favored 'General case' 0 CA--C 1.469 -2.143 0 CA-C-O 125.53 2.586 . . . . 0.0 110.71 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.498 HG22 ' HB3' ' A' ' 17' ' ' HIS 0.319 59.6 p -78.96 -11.79 60.02 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 129.154 2.982 . . . . 0.0 112.492 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -65.68 -34.29 77.86 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 130.464 3.506 . . . . 0.0 111.185 164.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.564 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -66.89 -38.04 80.63 Favored 'Isoleucine or valine' 0 C--N 1.359 1.005 0 C-N-CA 126.363 1.865 . . . . 0.0 110.582 -174.505 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 37.6 m-85 -66.52 -46.66 75.45 Favored 'General case' 0 CA--C 1.47 -2.125 1 C-N-CA 133.224 4.61 . . . . 0.0 111.396 169.677 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -60.46 -38.28 83.7 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.815 1.643 . . . . 0.0 114.875 176.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 1.015 HD12 HD12 ' A' ' 111' ' ' LEU . 2.1 tm? -75.24 -47.98 25.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.97 3.308 . . . . 0.0 114.414 173.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.429 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.623 0.0 OUTLIER -77.31 -17.68 58.11 Favored 'General case' 0 C--N 1.377 1.763 0 O-C-N 118.304 -2.748 . . . . 0.0 112.001 174.278 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.459 ' NE2' HG12 ' A' ' 25' ' ' ILE . 27.6 m170 -67.91 -38.11 82.52 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 127.288 2.235 . . . . 0.0 109.516 162.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.493 8.9 mttt -77.22 -16.7 58.94 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 122.135 2.243 . . . . 0.0 112.968 168.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.771 HD12 ' HE2' ' A' ' 151' ' ' LYS 0.331 0.8 OUTLIER -71.75 -40.03 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 C-N-CA 126.044 1.738 . . . . 0.0 113.47 172.914 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.517 ' O ' HG23 ' A' ' 74' ' ' VAL 0.866 11.5 mptt -67.44 -2.4 6.29 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 131.013 3.725 . . . . 0.0 118.683 176.06 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -87.43 -16.52 34.63 Favored 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 167.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.768 ' CD2' ' HG3' ' A' ' 151' ' ' LYS 0.288 3.0 m-70 -90.65 10.25 26.49 Favored 'General case' 0 C--N 1.379 1.873 0 C-N-CA 129.768 3.227 . . . . 0.0 111.103 174.268 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 71' ' ' LYS 0.29 24.4 t -41.14 -40.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.414 3.396 0 C-N-CA 130.334 3.454 . . . . 0.0 111.096 160.969 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.64 -37.95 74.19 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.633 3.173 . . . . 0.0 115.565 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -75.58 -38.24 59.27 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 128.47 2.708 . . . . 0.0 109.904 172.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.385 1.9 m -69.99 -30.42 44.03 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 CA-C-O 124.188 1.946 . . . . 0.0 113.856 173.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.649 ' HB3' HG21 ' A' ' 38' ' ' VAL . 3.7 m120 -73.81 -34.11 64.47 Favored 'General case' 0 C--N 1.345 0.382 1 C-N-CA 132.45 4.3 . . . . 0.0 111.865 172.397 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -67.41 -30.46 70.23 Favored 'General case' 0 C--N 1.367 1.327 0 C-N-CA 125.957 1.703 . . . . 0.0 111.067 165.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.566 13.4 p90 -75.11 -29.92 60.71 Favored 'General case' 0 C--N 1.379 1.864 0 N-CA-C 116.264 1.95 . . . . 0.0 116.264 162.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.442 ' O ' HD12 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -67.32 -38.15 84.47 Favored 'General case' 0 C--N 1.368 1.4 0 C-N-CA 128.05 2.54 . . . . 0.0 114.531 174.95 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.9 p -93.33 3.03 56.29 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 117.406 2.373 . . . . 0.0 117.406 -171.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.7 ptm -84.3 166.01 35.35 Favored Pre-proline 0 C--N 1.365 1.242 0 CA-C-O 117.168 -1.396 . . . . 0.0 110.427 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -57.2 161.04 11.84 Favored 'Trans proline' 0 CA--C 1.553 1.438 1 C-N-CA 125.723 4.282 . . . . 0.0 114.645 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.518 ' HA ' ' CD ' ' A' ' 125' ' ' LYS . 5.6 Cg_endo -50.44 143.62 26.86 Favored 'Trans proline' 0 C--N 1.364 1.375 1 C-N-CA 126.357 4.704 . . . . 0.0 119.89 -160.667 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -109.34 61.12 0.29 Allowed Pre-proline 0 N--CA 1.491 1.623 0 N-CA-C 119.033 2.975 . . . . 0.0 119.033 175.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 93' ' ' PHE . 23.8 Cg_exo -90.6 161.56 4.31 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 124.879 3.719 . . . . 0.0 113.565 -177.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.53 -17.43 8.38 Favored 'General case' 0 C--N 1.364 1.239 1 C-N-CA 132.21 4.204 . . . . 0.0 117.813 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.426 HD12 ' HB2' ' A' ' 92' ' ' ASP . 0.0 OUTLIER -66.15 -175.35 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.351 0.655 0 C-N-CA 129.441 3.097 . . . . 0.0 115.611 177.041 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -132.55 -10.25 3.19 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.518 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -94.8 -39.03 10.48 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 116.482 2.03 . . . . 0.0 116.482 -177.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.426 ' HB2' HD12 ' A' ' 89' ' ' ILE . 27.8 m-20 -123.62 12.8 9.3 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 128.614 2.765 . . . . 0.0 111.711 -173.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.436 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 0.0 OUTLIER -70.37 -139.84 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 120.205 3.409 . . . . 0.0 120.205 -175.788 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 1.9 pt -79.68 87.01 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.269 0 CA-C-O 128.107 3.813 . . . . 0.0 111.643 175.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -115.96 -26.1 7.45 Favored 'General case' 0 N--CA 1.433 -1.297 2 CA-C-N 104.699 -5.682 . . . . 0.0 109.692 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -103.32 14.8 54.65 Favored Glycine 0 C--N 1.361 1.947 0 C-N-CA 125.06 1.314 . . . . 0.0 111.488 176.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . 0.294 10.2 p -72.96 90.57 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.136 0 CA-C-O 125.357 2.503 . . . . 0.0 115.756 178.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -107.71 9.9 29.03 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 128.259 2.624 . . . . 0.0 111.81 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -132.03 -179.75 5.6 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 128.166 2.586 . . . . 0.0 105.009 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -89.44 163.06 34.9 Favored Pre-proline 0 C--N 1.36 1.058 0 O-C-N 119.986 -1.696 . . . . 0.0 112.676 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -69.06 156.12 66.16 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 124.363 3.375 . . . . 0.0 115.677 -177.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.4 ' HA3' HG22 ' A' ' 117' ' ' VAL . . . -54.94 27.45 0.01 OUTLIER Glycine 0 C--N 1.357 1.743 2 N-CA-C 124.371 4.508 . . . . 0.0 124.371 -174.84 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -129.97 138.53 50.89 Favored 'General case' 0 N--CA 1.431 -1.423 1 N-CA-C 98.2 -4.741 . . . . 0.0 98.2 167.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.41 144.61 49.96 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -129.46 130.29 45.7 Favored 'General case' 0 C--N 1.361 1.108 0 N-CA-C 105.596 -2.001 . . . . 0.0 105.596 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.807 HG23 HD12 ' A' ' 150' ' ' ILE . 1.0 OUTLIER -126.01 137.11 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 175.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.668 HG22 HG11 ' A' ' 149' ' ' VAL . 1.0 OUTLIER -136.49 107.35 6.64 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 172.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.615 ' N ' HE21 ' A' ' 153' ' ' GLN . 0.4 OUTLIER -162.98 -117.76 0.01 OUTLIER 'General case' 0 CA--C 1.448 -2.97 0 N-CA-C 103.131 -2.914 . . . . 0.0 103.131 -178.429 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.569 ' H ' ' HG3' ' A' ' 153' ' ' GLN . . . -52.04 75.4 0.01 OUTLIER Glycine 0 C--N 1.384 3.231 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -160.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.623 ' O ' HG22 ' A' ' 136' ' ' ILE . 1.1 m-80 63.13 7.35 2.72 Favored 'General case' 0 C--N 1.369 1.437 1 C-N-CA 132.358 4.263 . . . . 0.0 113.192 179.063 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 1.015 HD12 HD12 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -117.32 133.12 56.35 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 129.987 3.315 . . . . 0.0 112.683 -160.132 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -111.4 98.54 7.55 Favored 'General case' 0 C--N 1.363 1.163 1 N-CA-C 98.979 -4.452 . . . . 0.0 98.979 174.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.638 HD23 HD13 ' A' ' 111' ' ' LEU 0.287 0.8 OUTLIER -115.91 121.11 41.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.453 1.501 . . . . 0.0 107.205 -167.623 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.25 132.1 7.22 Favored Glycine 0 C--N 1.364 2.117 0 O-C-N 119.938 -1.726 . . . . 0.0 109.605 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 152.85 50.56 Favored 'General case' 0 C--N 1.372 1.548 0 CA-C-N 120.848 2.324 . . . . 0.0 107.744 174.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 m -130.1 142.17 50.63 Favored 'General case' 0 C--N 1.371 1.506 0 C-N-CA 125.797 1.639 . . . . 0.0 106.709 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.4 HG22 ' HA3' ' A' ' 102' ' ' GLY . 12.5 m -77.47 179.18 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.999 0 C-N-CA 125.566 1.546 . . . . 0.0 110.289 169.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.526 ' HA ' ' HG3' ' A' ' 130' ' ' GLN 0.267 0.5 OUTLIER -56.66 92.56 0.01 OUTLIER 'General case' 0 C--N 1.359 1.014 0 CA-C-O 124.194 1.949 . . . . 0.0 115.698 168.029 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.354 9.1 pttp -71.6 -40.21 8.32 Favored Pre-proline 0 C--N 1.345 0.383 1 C-N-CA 133.09 4.556 . . . . 0.0 114.028 -178.711 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -75.74 60.3 5.92 Favored 'Trans proline' 0 CA--C 1.568 2.176 0 C-N-CA 124.29 3.327 . . . . 0.0 108.205 160.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.561 0.6 OUTLIER 2.3 -3.24 0.0 OUTLIER 'General case' 0 C--N 1.354 0.764 2 N-CA-C 129.217 6.747 . . . . 0.0 129.217 -168.178 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 56.38 -16.21 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.984 1 N-CA-C 123.224 4.528 . . . . 0.0 123.224 167.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.371 10.0 mptt 72.19 18.66 4.7 Favored 'General case' 0 N--CA 1.421 -1.877 1 C-N-CA 134.821 5.248 . . . . 0.0 114.03 177.58 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -145.71 177.78 8.64 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 128.373 2.669 . . . . 0.0 107.36 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.518 ' CD ' ' HA ' ' A' ' 85' ' ' PRO . 0.0 OUTLIER -63.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.354 0.771 1 C-N-CA 132.14 4.176 . . . . 0.0 118.838 -170.466 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -109.8 -4.4 0.11 Allowed Pre-proline 0 N--CA 1.446 -0.636 1 CA-C-O 111.538 -4.077 . . . . 0.0 115.874 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.258 31.1 Cg_exo -69.0 23.61 0.15 Allowed 'Trans proline' 0 C--N 1.371 1.719 2 CA-C-N 133.963 6.022 . . . . 0.0 124.665 -166.898 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.292 19.3 m -145.41 149.55 34.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 C-N-CA 124.514 1.125 . . . . 0.0 108.916 158.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.25 130.42 55.94 Favored 'General case' 0 C--N 1.36 1.026 1 N-CA-C 98.903 -4.48 . . . . 0.0 98.903 159.675 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.526 ' HG3' ' HA ' ' A' ' 118' ' ' CYS . 9.8 mm100 -125.08 71.99 1.22 Allowed 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -164.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.262 64.0 m 98.15 106.57 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 125.059 1.475 . . . . 0.0 110.405 178.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -115.32 140.78 48.82 Favored 'General case' 0 C--N 1.359 1.002 0 CA-C-N 113.983 -1.462 . . . . 0.0 110.423 171.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.585 ' HA ' HD13 ' A' ' 49' ' ' LEU . 10.1 ttt -107.38 123.51 48.47 Favored 'General case' 0 N--CA 1.436 -1.144 1 C-N-CA 133.815 4.846 . . . . 0.0 110.002 178.566 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.66 114.76 17.06 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 169.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.7 mm -136.7 135.16 48.82 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.623 HG22 ' O ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -112.35 176.46 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.662 0 CA-C-O 124.423 2.058 . . . . 0.0 107.759 -177.389 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -72.19 103.87 3.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 130.242 3.417 . . . . 0.0 106.024 161.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.42 87.3 p -74.73 77.46 2.06 Favored 'General case' 0 C--N 1.357 0.892 0 N-CA-C 116.155 1.909 . . . . 0.0 116.155 -171.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -79.97 -57.67 3.53 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.31 167.796 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 139' ' ' ARG 0.293 32.7 mtt180 109.56 66.16 0.0 OUTLIER 'General case' 0 C--N 1.365 1.272 1 C-N-CA 143.299 8.64 . . . . 0.0 102.788 -173.741 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.469 HD21 HG21 ' A' ' 136' ' ' ILE . 0.2 OUTLIER -84.35 154.39 62.86 Favored Pre-proline 0 C--N 1.355 0.836 1 N-CA-C 126.158 5.614 . . . . 0.0 126.158 -145.13 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 141' ' ' LEU . 50.0 Cg_exo -75.93 -58.65 0.04 OUTLIER 'Trans proline' 0 C--N 1.372 1.813 1 C-N-CA 125.704 4.269 . . . . 0.0 118.358 -177.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -161.6 178.69 37.39 Favored Glycine 0 N--CA 1.436 -1.315 0 C-N-CA 129.204 3.288 . . . . 0.0 110.886 -169.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 8.6 pttp -84.31 174.57 10.03 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 131.096 3.758 . . . . 0.0 120.595 -171.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -170.52 161.34 7.74 Favored 'General case' 0 C--N 1.372 1.545 0 C-N-CA 127.613 2.365 . . . . 0.0 107.755 173.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . 0.415 85.6 p 78.72 148.55 0.1 Allowed 'General case' 0 C--N 1.367 1.333 0 N-CA-C 118.78 2.882 . . . . 0.0 118.78 178.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -175.28 132.9 0.3 Allowed 'General case' 0 C--N 1.357 0.911 0 C-N-CA 129.091 2.956 . . . . 0.0 103.466 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 170.36 -42.33 0.0 OUTLIER 'General case' 0 C--N 1.357 0.905 0 CA-C-O 124.01 1.862 . . . . 0.0 109.617 -172.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.845 HG22 ' HB ' ' A' ' 150' ' ' ILE 0.256 0.2 OUTLIER -71.7 -74.06 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.654 1 C-N-CA 134.72 5.208 . . . . 0.0 111.946 179.138 . . . . . . . . 5 4 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 1.05 HD13 ' HB3' ' A' ' 151' ' ' LYS 0.442 0.3 OUTLIER -129.43 158.67 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.077 1 C-N-CA 147.432 10.293 . . . . 0.0 111.156 -160.742 . . . . . . . . 5 4 . 1 . 002 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 1.05 ' HB3' HD13 ' A' ' 150' ' ' ILE 0.564 0.0 OUTLIER -71.48 147.18 48.06 Favored 'General case' 0 CA--C 1.502 -0.899 1 C-N-CA 140.219 7.408 . . . . 0.0 105.498 -177.464 . . . . . . . . 5 4 . 1 . 002 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.627 ' O ' HG23 ' A' ' 152' ' ' THR 0.473 12.4 t -78.31 93.03 4.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 128.318 3.913 . . . . 0.0 117.882 -163.198 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.615 HE21 ' N ' ' A' ' 108' ' ' ASP 0.251 5.4 pt20 . . . . . 0 N--CA 1.418 -2.026 0 N-CA-C 102.122 -3.288 . . . . 0.0 102.122 177.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 116.264 1.95 . . . . 0.0 116.264 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -123.42 -164.74 1.24 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 127.323 2.249 . . . . 0.0 108.028 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 mm -78.6 72.97 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.174 0 CA-C-O 126.629 3.109 . . . . 0.0 112.455 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.45 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 0.9 OUTLIER -108.19 12.46 26.62 Favored 'General case' 0 N--CA 1.442 -0.851 2 C-N-CA 132.959 4.503 . . . . 0.0 107.193 174.082 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -61.17 2.23 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 130.151 3.381 . . . . 0.0 114.764 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -75.6 -19.58 59.15 Favored 'General case' 0 C--N 1.376 1.734 0 CA-C-O 122.192 0.996 . . . . 0.0 112.227 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.45 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -74.32 -37.25 44.92 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 C-N-CA 129.912 3.285 . . . . 0.0 111.578 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.61 -44.26 82.57 Favored 'General case' 0 C--N 1.373 1.615 0 C-N-CA 128.731 2.812 . . . . 0.0 108.576 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.43 -43.52 77.91 Favored 'Isoleucine or valine' 0 C--N 1.368 1.381 0 C-N-CA 125.1 1.36 . . . . 0.0 112.847 167.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HB3' HD13 ' A' ' 58' ' ' ILE 0.27 0.9 OUTLIER -62.73 -50.86 69.41 Favored 'General case' 0 CA--C 1.564 1.507 0 C-N-CA 126.39 1.876 . . . . 0.0 115.123 173.184 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.41 ' HE ' HE22 ' A' ' 55' ' ' GLN . 32.6 mtp180 -59.29 -27.63 66.02 Favored 'General case' 0 C--N 1.372 1.546 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 163.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -77.08 -47.76 19.64 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 128.676 2.79 . . . . 0.0 110.563 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.54 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 9.5 mmpt? -58.77 -29.63 66.94 Favored 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.161 2.184 . . . . 0.0 109.571 169.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.683 HD13 HG13 ' A' ' 54' ' ' ILE . 0.4 OUTLIER -67.07 -44.49 79.96 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 163.145 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 -60.87 -32.6 72.03 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 122.726 2.512 . . . . 0.0 113.837 171.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.54 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.29 0.5 OUTLIER -72.07 -38.46 69.44 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.498 -1.376 . . . . 0.0 112.289 171.728 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -65.23 -46.14 81.8 Favored 'General case' 0 C--N 1.386 2.154 0 C-N-CA 128.316 2.646 . . . . 0.0 111.06 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.607 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -63.2 -51.1 67.67 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 129.964 3.306 . . . . 0.0 112.201 -177.891 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -74.31 -42.96 58.64 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 126.983 2.113 . . . . 0.0 115.905 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.7 m -64.93 -42.88 94.28 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 124.428 2.061 . . . . 0.0 112.068 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.563 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.279 41.2 mt-10 -76.41 -29.79 57.2 Favored 'General case' 0 N--CA 1.439 -1.023 0 O-C-N 120.135 -1.603 . . . . 0.0 112.495 172.879 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -59.55 -31.39 69.38 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 122.348 2.34 . . . . 0.0 112.471 166.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -63.0 -46.26 88.5 Favored 'General case' 0 C--N 1.385 2.116 0 C-N-CA 124.585 1.154 . . . . 0.0 111.126 163.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 43.8 tt0 -56.08 -43.24 77.8 Favored 'General case' 0 C--N 1.371 1.53 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 169.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.7 mt -68.57 -45.79 81.12 Favored 'Isoleucine or valine' 0 C--N 1.357 0.93 0 C-N-CA 125.519 1.528 . . . . 0.0 113.888 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.726 0.1 OUTLIER -73.45 -22.93 60.06 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 174.46 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -67.73 -47.19 70.03 Favored 'General case' 0 C--N 1.377 1.78 0 CA-C-O 116.989 -1.482 . . . . 0.0 112.457 168.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG2' ' CD ' ' A' ' 71' ' ' LYS 0.774 0.2 OUTLIER -69.77 -30.54 68.14 Favored 'General case' 0 C--N 1.406 3.028 0 CA-C-N 124.259 3.209 . . . . 0.0 113.92 171.739 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.47 -37.15 79.35 Favored 'Isoleucine or valine' 0 C--N 1.372 1.578 0 CA-C-N 121.85 2.114 . . . . 0.0 115.274 170.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 ttt-85 -70.59 -38.08 73.98 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 118.745 -2.472 . . . . 0.0 114.241 175.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -76.3 -41.2 49.43 Favored 'General case' 0 CA--C 1.485 -1.53 0 C-N-CA 126.493 1.917 . . . . 0.0 111.732 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.0 -32.09 45.01 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.369 11.3 p -78.51 -27.98 46.2 Favored 'General case' 0 C--N 1.359 0.987 0 O-C-N 120.823 -1.173 . . . . 0.0 110.125 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -71.36 -52.1 20.55 Favored 'General case' 0 C--N 1.371 1.522 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 158.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.03 -30.16 71.25 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.88 -11.97 60.01 Favored 'General case' 0 C--N 1.375 1.685 0 O-C-N 120.901 -1.124 . . . . 0.0 111.591 170.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.85 17.18 62.0 Favored Glycine 0 C--N 1.383 3.189 0 O-C-N 121.016 -1.052 . . . . 0.0 115.056 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.67 HG22 ' H ' ' A' ' 39' ' ' SER . 7.9 p -96.58 178.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.36 0 CA-C-O 125.035 2.35 . . . . 0.0 112.754 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.67 ' H ' HG22 ' A' ' 38' ' ' VAL . 41.9 t -23.88 -69.11 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 1 C-N-CA 136.859 6.064 . . . . 0.0 117.522 178.188 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.256 90.9 p 102.57 142.39 0.01 OUTLIER 'General case' 0 C--N 1.357 0.903 0 C-N-CA 131.007 3.723 . . . . 0.0 104.238 -166.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . 0.266 50.4 p90 -141.53 161.9 36.8 Favored 'General case' 0 C--N 1.345 0.399 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -111.12 149.58 30.65 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.847 1.659 . . . . 0.0 112.863 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.353 1.7 pp -126.84 158.38 36.82 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 119.44 -2.038 . . . . 0.0 112.861 167.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -140.41 150.25 43.63 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.347 3.059 . . . . 0.0 103.196 172.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.467 ' CD1' HD13 ' A' ' 50' ' ' LEU . 4.0 p90 -125.2 134.08 52.5 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 105.72 -1.956 . . . . 0.0 105.72 170.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.3 m -105.18 128.16 53.27 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 120.99 -1.069 . . . . 0.0 108.516 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.597 0.7 OUTLIER -73.68 -10.54 59.8 Favored 'General case' 0 C--N 1.363 1.187 1 N-CA-C 122.541 4.274 . . . . 0.0 122.541 -169.921 . . . . . . . . 5 4 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.27 -45.3 60.7 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 122.966 2.621 . . . . 0.0 111.762 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.0 tp -53.78 -48.61 69.62 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 131.138 3.775 . . . . 0.0 111.977 166.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.607 HD11 ' CE1' ' A' ' 18' ' ' PHE . 8.3 tt -74.83 -28.65 60.78 Favored 'General case' 0 CA--C 1.487 -1.444 0 C-N-CA 125.837 1.655 . . . . 0.0 112.708 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.515 ' HA ' HG22 ' A' ' 54' ' ' ILE . 16.3 t70 -66.72 -30.64 70.92 Favored 'General case' 0 C--N 1.365 1.239 0 CA-C-N 120.177 1.353 . . . . 0.0 108.729 169.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -73.82 -28.69 61.75 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 167.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.82 -50.18 25.74 Favored 'General case' 0 C--O 1.207 -1.179 0 O-C-N 119.979 -1.7 . . . . 0.0 113.373 165.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.683 HG13 HD13 ' A' ' 14' ' ' LEU 0.282 0.3 OUTLIER -50.95 -43.35 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 1 C-N-CA 132.939 4.496 . . . . 0.0 113.884 -177.297 . . . . . . . . 5 4 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.41 HE22 ' HE ' ' A' ' 11' ' ' ARG 0.26 16.5 mm-40 -84.18 -31.67 25.01 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 171.828 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -99.53 39.1 1.34 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 124.201 1.953 . . . . 0.0 109.456 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . 0.295 2.7 pt-20 -160.71 -52.07 0.05 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 127.946 2.498 . . . . 0.0 110.395 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.605 ' HA ' HD12 ' A' ' 14' ' ' LEU 0.64 0.1 OUTLIER 19.83 108.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.524 3.241 0 C-N-CA 131.518 3.927 . . . . 0.0 113.249 -169.171 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.422 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 69.1 m-20 53.23 44.3 30.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 131.59 3.956 . . . . 0.0 112.089 -173.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.663 ' O ' HG12 ' A' ' 63' ' ' VAL 0.652 3.8 tp10 -78.29 79.64 4.72 Favored 'General case' 0 C--N 1.372 1.577 0 CA-C-O 127.22 3.391 . . . . 0.0 110.666 175.024 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.313 62.2 p -78.23 -15.87 58.38 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 127.616 2.366 . . . . 0.0 112.569 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -67.59 -33.29 74.7 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 129.859 3.264 . . . . 0.0 109.33 165.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -58.57 -44.33 89.15 Favored 'Isoleucine or valine' 0 C--N 1.372 1.551 0 C-N-CA 128.978 2.911 . . . . 0.0 110.332 179.892 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.563 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 41.1 m-85 -64.98 -45.46 85.54 Favored 'General case' 0 CA--C 1.488 -1.434 1 C-N-CA 133.332 4.653 . . . . 0.0 111.229 170.612 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.39 -34.17 77.15 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-N 122.408 2.367 . . . . 0.0 114.187 178.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.961 HD12 HD23 ' A' ' 111' ' ' LEU . 2.9 tm? -76.35 -45.39 32.3 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 127.43 2.292 . . . . 0.0 116.522 168.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.47 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.87 0.1 OUTLIER -75.49 -16.36 60.31 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 122.334 2.333 . . . . 0.0 113.514 176.526 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.415 ' CE1' ' HB3' ' A' ' 24' ' ' GLN 0.253 24.9 m-70 -76.81 -36.34 56.99 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 128.669 2.788 . . . . 0.0 110.296 161.637 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -73.88 -18.17 60.95 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 122.335 2.334 . . . . 0.0 114.569 169.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.482 HG21 HH22 ' A' ' 132' ' ' ARG . 26.4 mm -57.8 -70.26 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.379 1.876 0 C-N-CA 129.067 2.947 . . . . 0.0 113.013 173.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.435 ' CD ' ' HG2' ' A' ' 28' ' ' GLU 0.846 0.0 OUTLIER -52.13 -2.1 0.02 OUTLIER 'General case' 0 CA--C 1.48 -1.726 1 C-N-CA 133.015 4.526 . . . . 0.0 120.996 179.163 . . . . . . . . 5 4 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -84.26 -18.77 35.34 Favored 'General case' 0 CA--C 1.564 1.483 0 O-C-N 119.944 -1.722 . . . . 0.0 107.409 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -99.16 21.23 12.13 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 130.118 3.367 . . . . 0.0 113.993 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.3 t -38.62 -43.73 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.397 2.652 0 C-N-CA 129.588 3.155 . . . . 0.0 112.99 163.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.93 -39.69 74.97 Favored 'General case' 0 C--O 1.214 -0.8 1 C-N-CA 132.546 4.339 . . . . 0.0 114.096 177.099 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.488 ' HA ' ' HG3' ' A' ' 79' ' ' GLU 0.254 30.8 mt-10 -75.93 -32.11 59.42 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 126.315 1.846 . . . . 0.0 112.594 169.02 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.417 ' HB ' ' CE2' ' A' ' 80' ' ' PHE 0.422 1.8 m -66.98 -31.12 52.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.505 0 CA-C-O 127.805 3.669 . . . . 0.0 112.379 168.15 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.521 ' HB2' HG21 ' A' ' 38' ' ' VAL 0.451 0.0 OUTLIER -71.93 -29.56 64.42 Favored 'General case' 0 C--N 1.351 0.67 1 C-N-CA 132.593 4.357 . . . . 0.0 112.067 168.718 . . . . . . . . 5 4 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.298 17.7 mt-10 -69.94 -30.11 67.41 Favored 'General case' 0 C--N 1.373 1.602 0 C-N-CA 129.248 3.019 . . . . 0.0 109.574 166.684 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.417 ' CE2' ' HB ' ' A' ' 77' ' ' VAL . 2.8 m-85 -61.58 -47.26 86.31 Favored 'General case' 0 C--N 1.386 2.157 0 CA-C-N 119.295 0.952 . . . . 0.0 110.553 165.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 125' ' ' LYS 0.53 1.1 tm? -65.55 -10.85 38.62 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 119.612 3.19 . . . . 0.0 119.612 173.122 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 86.2 p -65.39 2.31 0.91 Allowed 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 121.414 3.857 . . . . 0.0 121.414 -169.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.719 ' HE2' HG21 ' A' ' 94' ' ' ILE . 6.6 ttp -124.18 154.0 68.42 Favored Pre-proline 0 N--CA 1.444 -0.731 0 C-N-CA 126.129 1.771 . . . . 0.0 107.259 177.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -62.27 162.31 23.94 Favored 'Trans proline' 0 C--N 1.376 1.975 1 C-N-CA 125.462 4.108 . . . . 0.0 114.14 176.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -57.71 144.98 91.91 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 124.782 3.655 . . . . 0.0 121.571 -161.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.452 ' N ' ' HD2' ' A' ' 87' ' ' PRO 0.42 2.4 mtp85 -79.2 -10.77 0.16 Allowed Pre-proline 0 CA--C 1.557 1.235 0 N-CA-C 121.427 3.862 . . . . 0.0 121.427 179.727 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 86' ' ' ARG . 25.5 Cg_exo -12.69 160.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.37 1.675 2 C-N-CA 129.458 6.772 . . . . 0.0 125.889 158.312 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.01 -22.14 65.46 Favored 'General case' 0 C--N 1.359 0.997 1 C-N-CA 132.589 4.356 . . . . 0.0 119.024 -173.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -98.47 111.04 27.18 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.171 0 CA-C-O 125.849 2.738 . . . . 0.0 109.278 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.44 -11.15 59.72 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 130.736 3.614 . . . . 0.0 111.603 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -97.03 -27.66 14.51 Favored 'General case' 0 CA--C 1.507 -0.683 0 C-N-CA 126.779 2.032 . . . . 0.0 115.021 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.23 -11.1 10.13 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 124.736 1.214 . . . . 0.0 112.256 -176.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -146.01 179.89 7.17 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 122.84 1.305 . . . . 0.0 110.502 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.719 HG21 ' HE2' ' A' ' 83' ' ' MET 0.263 4.3 mt -84.9 131.12 34.84 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.117 1 C-N-CA 135.788 5.635 . . . . 0.0 107.189 175.496 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -147.24 -47.77 0.18 Allowed 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -167.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.33 8.79 58.97 Favored Glycine 0 C--N 1.349 1.282 0 N-CA-C 108.564 -1.814 . . . . 0.0 108.564 175.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.519 ' CG1' HG12 ' A' ' 94' ' ' ILE 0.361 4.5 p -114.96 136.4 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.621 0 C-N-CA 127.048 2.139 . . . . 0.0 112.097 176.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . 0.25 28.2 tt0 73.76 21.2 2.8 Favored 'General case' 0 N--CA 1.436 -1.139 1 C-N-CA 135.758 5.623 . . . . 0.0 108.419 -172.282 . . . . . . . . 3 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -48.52 50.73 0.0 OUTLIER 'General case' 0 C--N 1.371 1.533 0 N-CA-C 121.763 3.986 . . . . 0.0 121.763 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 68.5 mtt85 -112.48 154.11 44.69 Favored Pre-proline 0 C--N 1.351 0.659 0 C-N-CA 127.83 2.452 . . . . 0.0 108.877 177.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -81.4 144.25 14.27 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.71 2.94 . . . . 0.0 111.719 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.55 45.53 0.65 Allowed Glycine 0 C--N 1.364 2.108 0 C-N-CA 126.952 2.215 . . . . 0.0 118.112 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -124.83 139.41 53.87 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 103.822 -2.659 . . . . 0.0 103.822 176.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.51 139.1 45.2 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -174.263 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -128.26 130.82 48.49 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 102.564 -3.124 . . . . 0.0 102.564 178.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.407 ' CG2' ' HB3' ' A' ' 151' ' ' LYS . 0.0 OUTLIER -134.33 138.71 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 124.477 1.111 . . . . 0.0 108.115 -171.761 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -137.6 114.4 10.55 Favored 'General case' 0 C--N 1.38 1.928 0 N-CA-C 116.412 2.005 . . . . 0.0 116.412 -167.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.803 ' HB3' ' H ' ' A' ' 151' ' ' LYS 0.329 0.9 OUTLIER -132.32 -157.99 0.86 Allowed 'General case' 0 C--N 1.386 2.16 0 CA-C-N 122.576 2.444 . . . . 0.0 108.064 177.853 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -47.2 67.06 0.0 OUTLIER Glycine 0 CA--C 1.453 -3.84 1 C-N-CA 134.494 5.807 . . . . 0.0 118.771 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 93.41 5.01 0.05 OUTLIER 'General case' 0 CA--C 1.492 -1.277 1 C-N-CA 134.568 5.147 . . . . 0.0 111.825 169.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.961 HD23 HD12 ' A' ' 66' ' ' LEU . 16.0 tp -106.96 133.99 50.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.727 1.211 . . . . 0.0 111.383 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -110.59 99.63 8.57 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 102.13 -3.285 . . . . 0.0 102.13 171.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.402 ' HB2' ' HZ1' ' A' ' 151' ' ' LYS . 0.7 OUTLIER -106.76 131.68 53.6 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 124.625 1.17 . . . . 0.0 108.12 -177.607 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -135.27 138.43 9.98 Favored Glycine 0 C--N 1.348 1.25 0 O-C-N 118.938 -2.351 . . . . 0.0 108.133 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.89 152.81 50.8 Favored 'General case' 0 C--N 1.364 1.203 0 CA-C-N 120.876 2.338 . . . . 0.0 107.182 174.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 p -127.32 140.79 51.96 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 106.33 -1.729 . . . . 0.0 106.33 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.5 t -85.84 134.86 26.24 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 102.411 -3.181 . . . . 0.0 102.411 169.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.418 14.2 p -14.64 64.41 0.0 OUTLIER 'General case' 0 C--N 1.375 1.705 0 C-N-CA 131.674 3.99 . . . . 0.0 120.29 -171.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.436 2.0 ptmt -15.77 -56.75 0.04 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 137.796 6.439 . . . . 0.0 117.215 -172.201 . . . . . . . . 3 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -68.94 48.18 0.48 Allowed 'Trans proline' 0 CA--C 1.574 2.508 0 C-N-CA 123.143 2.562 . . . . 0.0 115.174 166.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.402 0.0 OUTLIER 156.45 -171.89 0.0 OUTLIER 'General case' 0 C--N 1.376 1.75 0 C-N-CA 131.356 3.863 . . . . 0.0 110.576 176.159 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -152.35 -77.41 0.12 Allowed 'General case' 0 N--CA 1.423 -1.779 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 157.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.502 0.0 OUTLIER 19.35 59.53 0.02 OUTLIER 'General case' 0 C--N 1.356 0.855 1 C-N-CA 135.417 5.487 . . . . 0.0 119.176 -170.496 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 171.14 -168.7 0.02 OUTLIER 'General case' 0 CA--C 1.507 -0.698 1 C-N-CA 132.322 4.249 . . . . 0.0 104.299 -172.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 81' ' ' LEU 0.489 0.0 OUTLIER -125.22 -71.41 0.71 Allowed 'General case' 0 C--N 1.358 0.944 0 CA-C-N 119.457 1.026 . . . . 0.0 113.631 -179.763 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.517 ' H ' HD23 ' A' ' 81' ' ' LEU . 9.3 p-10 -43.71 -59.57 3.37 Favored Pre-proline 0 C--N 1.355 0.831 0 N-CA-C 121.78 3.993 . . . . 0.0 121.78 172.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.619 0.0 OUTLIER 55.49 -178.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.392 2.82 1 N-CA-C 123.061 4.216 . . . . 0.0 123.061 163.648 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 24.6 t -105.26 140.61 38.15 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 102.053 -3.314 . . . . 0.0 102.053 171.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mp -100.29 130.15 46.37 Favored 'General case' 0 C--N 1.347 0.486 1 N-CA-C 99.157 -4.386 . . . . 0.0 99.157 -177.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -123.3 74.29 1.23 Allowed 'General case' 0 CA--C 1.479 -1.756 0 N-CA-C 105.655 -1.979 . . . . 0.0 105.655 -161.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.365 0.5 OUTLIER 95.35 115.65 0.02 OUTLIER 'General case' 0 C--N 1.368 1.389 0 CA-C-O 123.482 1.611 . . . . 0.0 110.598 -176.487 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.482 HH22 HG21 ' A' ' 70' ' ' ILE . 14.3 ptm180 -114.75 129.93 56.76 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 171.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.9 ttt -93.73 122.02 35.76 Favored 'General case' 0 N--CA 1.439 -0.986 1 C-N-CA 132.998 4.519 . . . . 0.0 107.729 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.274 . . -127.91 114.44 17.17 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -144.4 122.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 O-C-N 119.849 -1.782 . . . . 0.0 108.634 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.546 HD12 HG23 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -118.14 -179.67 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 C-N-CA 127.67 2.388 . . . . 0.0 112.72 -166.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.326 0.2 OUTLIER -140.23 153.13 46.46 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 111.314 -2.676 . . . . 0.0 109.169 162.671 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.56 ' HB2' ' HD2' ' A' ' 139' ' ' ARG . 68.0 m -162.5 -122.35 0.02 OUTLIER 'General case' 0 C--N 1.354 0.789 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -169.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.581 ' CG ' ' H ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -84.76 -81.52 0.19 Allowed 'General case' 0 C--N 1.362 1.138 1 C-N-CA 136.118 5.767 . . . . 0.0 114.661 -171.677 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.581 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 0.5 OUTLIER -87.71 -1.16 57.78 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 129.521 3.128 . . . . 0.0 110.428 171.413 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.7 OUTLIER -76.62 177.66 2.46 Favored Pre-proline 0 N--CA 1.42 -1.94 0 C-N-CA 125.951 1.7 . . . . 0.0 111.004 -170.814 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.14 -84.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.727 0 CA-C-N 127.246 3.624 . . . . 0.0 116.472 174.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 133.06 134.9 3.55 Favored Glycine 0 N--CA 1.467 0.762 0 C-N-CA 126.334 1.921 . . . . 0.0 113.461 -171.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' A' ' 145' ' ' ALA . 17.3 tptm -140.89 -173.43 3.71 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.571 2.348 . . . . 0.0 109.136 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.437 ' H ' ' HG3' ' A' ' 144' ' ' LYS . . . -85.88 -162.86 0.78 Allowed 'General case' 0 C--N 1.363 1.155 0 C-N-CA 129.053 2.941 . . . . 0.0 113.904 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 75.5 m -162.99 130.9 3.72 Favored 'General case' 0 C--N 1.353 0.759 0 O-C-N 119.997 -1.69 . . . . 0.0 107.973 175.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.302 8.3 ptpp? -159.14 39.77 0.21 Allowed 'General case' 0 CA--C 1.483 -1.61 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 176.54 148.63 0.12 Allowed 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 103.86 -2.645 . . . . 0.0 103.86 -176.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 4.6 m -145.22 39.66 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.199 0 C-N-CA 125.249 1.42 . . . . 0.0 113.294 -177.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.733 ' CD1' ' H ' ' A' ' 152' ' ' THR . 5.0 tp -130.36 103.04 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 C-N-CA 125.189 1.396 . . . . 0.0 114.492 170.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.827 ' HE3' HD11 ' A' ' 66' ' ' LEU 0.292 0.0 OUTLIER -127.92 111.24 13.36 Favored 'General case' 0 CA--C 1.459 -2.536 1 O-C-N 115.916 -4.24 . . . . 0.0 115.568 118.886 . . . . . . . . 5 4 . 1 . 003 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.733 ' H ' ' CD1' ' A' ' 150' ' ' ILE 0.28 74.5 p -118.71 99.11 6.57 Favored 'General case' 0 N--CA 1.435 -1.196 1 N-CA-C 97.58 -4.97 . . . . 0.0 97.58 130.755 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.681 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -175.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 117.262 2.319 . . . . 0.0 117.262 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.9 p -104.08 48.87 0.83 Allowed 'General case' 0 C--N 1.353 0.733 0 C-N-CA 129.69 3.196 . . . . 0.0 108.68 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.92 63.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.912 0 C-N-CA 129.401 3.081 . . . . 0.0 117.956 -173.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.631 ' HA ' HG13 ' A' ' 7' ' ' VAL . 15.3 m-80 -71.34 0.62 7.68 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 130.956 3.702 . . . . 0.0 115.964 178.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.5 m -61.22 -55.47 31.72 Favored 'General case' 0 C--N 1.349 0.581 0 C-N-CA 130.458 3.503 . . . . 0.0 112.104 174.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -72.74 -21.16 61.07 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 128.222 2.609 . . . . 0.0 112.656 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.631 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.267 0.7 OUTLIER -82.41 -38.13 15.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.074 0 C-N-CA 126.798 2.039 . . . . 0.0 111.049 178.156 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.82 -44.47 85.53 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 129.857 3.263 . . . . 0.0 108.885 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.88 -43.84 89.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 C-N-CA 126.048 1.739 . . . . 0.0 110.765 168.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.266 2.7 tpt85 -62.33 -50.29 72.22 Favored 'General case' 0 C--N 1.371 1.511 0 N-CA-C 116.153 1.909 . . . . 0.0 116.153 170.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -59.11 -29.18 67.18 Favored 'General case' 0 C--N 1.373 1.596 0 N-CA-C 118.486 2.773 . . . . 0.0 118.486 170.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -77.21 -51.45 10.93 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.13 3.372 . . . . 0.0 110.719 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -57.44 -29.21 64.0 Favored 'General case' 0 C--N 1.382 1.993 0 C-N-CA 128.271 2.628 . . . . 0.0 111.042 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.747 HD23 ' HA ' ' A' ' 54' ' ' ILE . 7.9 tp -71.22 -46.68 60.63 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 114.878 -1.056 . . . . 0.0 112.569 167.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.582 ' HA ' HD11 ' A' ' 54' ' ' ILE . 3.3 tmm_? -55.32 -43.43 74.89 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 120.18 1.354 . . . . 0.0 112.722 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -57.91 -47.75 81.91 Favored 'General case' 0 C--N 1.371 1.543 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 165.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -50.15 74.53 Favored 'General case' 0 C--N 1.38 1.912 0 C-N-CA 128.28 2.632 . . . . 0.0 115.113 175.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.544 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -65.33 -51.44 60.55 Favored 'General case' 0 C--N 1.357 0.91 1 C-N-CA 131.942 4.097 . . . . 0.0 110.226 177.46 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -72.95 -44.84 60.68 Favored 'General case' 0 C--N 1.381 1.952 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 176.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.4 m -63.71 -42.93 97.87 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.352 1.861 . . . . 0.0 112.792 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.491 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.453 4.9 mp0 -76.75 -28.41 55.74 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 120.073 -1.642 . . . . 0.0 111.029 174.163 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.45 -32.53 71.47 Favored 'General case' 0 C--N 1.386 2.156 0 CA-C-N 122.467 2.394 . . . . 0.0 113.023 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -65.12 -45.33 85.54 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 124.347 1.059 . . . . 0.0 111.761 163.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -56.63 -47.04 80.56 Favored 'General case' 0 C--N 1.378 1.806 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 171.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.448 ' CD1' ' CD1' ' A' ' 67' ' ' PHE . 1.2 mt -68.57 -43.85 83.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 124.929 1.291 . . . . 0.0 112.767 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.58 1.4 p30 -73.41 -23.95 60.21 Favored 'General case' 0 C--N 1.376 1.75 0 CA-C-N 121.631 2.014 . . . . 0.0 114.001 173.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -70.61 -41.32 72.41 Favored 'General case' 0 C--N 1.382 1.979 0 C-N-CA 125.059 1.343 . . . . 0.0 111.086 169.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -66.01 -37.68 86.54 Favored 'General case' 0 C--N 1.373 1.614 0 O-C-N 119.439 -2.038 . . . . 0.0 112.429 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -40.15 87.79 Favored 'Isoleucine or valine' 0 C--N 1.363 1.17 0 C-N-CA 124.619 1.168 . . . . 0.0 113.807 174.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -67.21 -39.96 86.39 Favored 'General case' 0 C--N 1.37 1.469 0 O-C-N 120.604 -1.31 . . . . 0.0 113.265 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -75.7 -38.57 58.51 Favored 'General case' 0 CA--C 1.484 -1.575 0 C-N-CA 126.37 1.868 . . . . 0.0 111.642 -176.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.35 -44.96 67.07 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 124.055 0.942 . . . . 0.0 113.175 174.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.527 ' HA ' HD22 ' A' ' 78' ' ' ASN 0.362 96.5 p -71.41 -31.38 67.18 Favored 'General case' 0 C--N 1.355 0.824 0 O-C-N 121.214 -0.929 . . . . 0.0 113.159 177.1 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -69.69 -48.49 59.47 Favored 'General case' 0 C--N 1.367 1.355 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 164.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.1 67.69 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 126.48 1.912 . . . . 0.0 114.612 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.9 -13.67 62.36 Favored 'General case' 0 C--N 1.378 1.805 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 164.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.22 18.05 30.03 Favored Glycine 0 C--N 1.375 2.731 0 O-C-N 120.823 -1.173 . . . . 0.0 113.576 171.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.674 HG23 HD23 ' A' ' 81' ' ' LEU 0.256 0.8 OUTLIER -113.25 169.08 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -174.603 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.5 t -30.37 -78.3 0.02 OUTLIER 'General case' 0 C--N 1.357 0.919 1 C-N-CA 132.825 4.45 . . . . 0.0 117.242 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.5 m 122.73 146.86 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 131.483 3.913 . . . . 0.0 102.521 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.415 ' CE1' HG23 ' A' ' 74' ' ' VAL . 30.5 p90 -122.98 154.6 38.21 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 124.713 1.205 . . . . 0.0 109.012 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -101.3 144.66 29.87 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.289 2.5 pp -125.86 159.6 32.07 Favored 'General case' 0 CA--C 1.49 -1.349 0 O-C-N 119.207 -2.183 . . . . 0.0 111.066 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -133.79 165.98 23.72 Favored 'General case' 0 CA--C 1.485 -1.537 0 N-CA-C 102.059 -3.311 . . . . 0.0 102.059 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 131' ' ' CYS . 0.1 OUTLIER -152.98 147.2 25.66 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -179.453 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -95.24 124.94 39.54 Favored 'General case' 0 C--N 1.359 0.994 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 176.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.464 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.325 0.4 OUTLIER -79.51 -11.03 59.9 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 117.975 -1.012 . . . . 0.0 113.342 -179.439 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.73 -37.98 48.11 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 127.639 2.375 . . . . 0.0 112.34 176.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.3 tp -62.79 -41.02 99.09 Favored 'General case' 0 C--N 1.359 1.007 0 CA-C-O 126.536 3.065 . . . . 0.0 111.544 168.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.544 HD11 ' CD1' ' A' ' 18' ' ' PHE 0.401 6.8 tt -76.62 -41.43 45.98 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 110.299 -3.137 . . . . 0.0 109.231 -172.92 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.412 ' HA ' HG22 ' A' ' 54' ' ' ILE . 29.9 t70 -54.65 -38.24 66.66 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 129.147 2.979 . . . . 0.0 111.746 165.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -66.23 -42.29 88.85 Favored 'General case' 0 C--N 1.376 1.724 0 O-C-N 119.735 -1.853 . . . . 0.0 112.136 169.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.69 67.05 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 118.693 -2.504 . . . . 0.0 116.959 170.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.747 ' HA ' HD23 ' A' ' 14' ' ' LEU 0.401 0.2 OUTLIER -69.29 -41.81 81.15 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 C-N-CA 131.582 3.953 . . . . 0.0 111.972 179.61 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.05 -28.86 10.79 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 171.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -83.54 -27.31 29.41 Favored 'General case' 0 C--N 1.371 1.517 0 CA-C-N 122.277 2.308 . . . . 0.0 111.422 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -103.55 -70.11 0.77 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.931 1.693 . . . . 0.0 111.384 173.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.566 0.0 OUTLIER 83.78 155.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 127.082 2.153 . . . . 0.0 111.568 -179.419 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.514 ' N ' HD22 ' A' ' 14' ' ' LEU 0.257 47.0 p30 31.83 47.43 0.07 Allowed 'General case' 0 N--CA 1.519 3.011 1 C-N-CA 132.483 4.313 . . . . 0.0 116.675 -177.296 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.404 11.3 pt-20 -82.03 69.88 8.83 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-O 125.005 2.336 . . . . 0.0 113.358 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 64' ' ' PHE 0.414 1.2 p -81.67 -19.09 42.35 Favored 'General case' 0 N--CA 1.426 -1.637 0 C-N-CA 131.687 3.995 . . . . 0.0 113.819 164.828 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.601 ' CD2' HD13 ' A' ' 141' ' ' LEU . 0.0 OUTLIER -65.42 -35.53 81.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 130.322 3.449 . . . . 0.0 109.157 171.915 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.654 ' HA ' HD11 ' A' ' 111' ' ' LEU . 3.0 t -58.71 -46.1 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.845 0 C-N-CA 129.668 3.187 . . . . 0.0 110.442 176.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.254 60.3 m-85 -60.55 -45.18 94.86 Favored 'General case' 0 C--O 1.212 -0.875 1 C-N-CA 131.812 4.045 . . . . 0.0 114.065 166.91 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -68.32 -37.98 81.1 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 121.507 1.958 . . . . 0.0 114.049 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.597 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.3 tm? -65.1 -52.4 55.69 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 125.116 1.366 . . . . 0.0 112.087 168.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.457 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.677 0.0 OUTLIER -78.44 -17.76 55.89 Favored 'General case' 0 C--N 1.38 1.896 0 CA-C-N 121.967 2.167 . . . . 0.0 116.158 -177.299 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -78.08 -22.97 48.22 Favored 'General case' 0 C--N 1.355 0.826 0 C-N-CA 128.0 2.52 . . . . 0.0 109.576 165.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -76.91 -36.93 56.28 Favored 'General case' 0 C--N 1.381 1.96 0 O-C-N 120.379 -1.451 . . . . 0.0 110.46 170.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 66' ' ' LEU 0.356 0.0 OUTLIER -92.92 -7.55 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.295 0 N-CA-C 120.74 3.608 . . . . 0.0 120.74 -178.777 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -47.69 -1.45 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 1 C-N-CA 133.725 4.81 . . . . 0.0 116.998 -175.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -83.67 -43.23 15.79 Favored 'General case' 0 C--N 1.362 1.116 1 C-N-CA 139.079 6.952 . . . . 0.0 110.353 172.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.632 ' CG ' ' HA ' ' A' ' 153' ' ' GLN . 0.2 OUTLIER -62.57 -9.76 9.87 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 131.343 3.857 . . . . 0.0 115.895 -174.001 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.415 HG23 ' CE1' ' A' ' 41' ' ' PHE . 10.6 p -60.49 -20.73 21.47 Favored 'Isoleucine or valine' 0 C--N 1.375 1.702 0 C-N-CA 127.937 2.495 . . . . 0.0 110.959 166.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.418 ' HA ' HD21 ' A' ' 78' ' ' ASN . 4.5 mp -72.99 -35.15 66.8 Favored 'General case' 0 C--N 1.378 1.812 0 C-N-CA 130.339 3.456 . . . . 0.0 111.362 171.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.334 36.2 mt-10 -76.85 -32.61 57.66 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.229 -1.544 . . . . 0.0 113.118 170.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.452 HG13 ' O ' ' A' ' 73' ' ' HIS 0.383 0.8 OUTLIER -68.95 -29.94 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 CA-C-O 126.66 3.124 . . . . 0.0 110.12 167.867 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.55 ' HB3' HG11 ' A' ' 38' ' ' VAL . 82.6 m-20 -68.04 -32.5 72.91 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 117.921 -2.987 . . . . 0.0 113.583 165.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.56 -30.03 71.2 Favored 'General case' 0 C--N 1.378 1.82 0 C-N-CA 125.882 1.673 . . . . 0.0 111.534 165.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.458 ' CE2' HG21 ' A' ' 117' ' ' VAL 0.389 6.6 t80 -65.35 -32.05 73.5 Favored 'General case' 0 CA--C 1.583 2.226 0 C-N-CA 126.864 2.066 . . . . 0.0 112.733 164.082 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.674 HD23 HG23 ' A' ' 38' ' ' VAL . 10.9 tp -63.14 -39.53 94.94 Favored 'General case' 0 N--CA 1.523 3.214 0 CA-C-O 125.09 2.376 . . . . 0.0 114.071 162.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.8 t -65.48 4.19 0.59 Allowed 'General case' 0 CA--C 1.546 0.819 1 N-CA-C 122.208 4.151 . . . . 0.0 122.208 -168.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.4 ' HB3' ' HA ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -70.51 166.75 32.49 Favored Pre-proline 0 CA--C 1.573 1.859 0 C-N-CA 126.086 1.754 . . . . 0.0 111.386 175.748 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.03 161.14 27.12 Favored 'Trans proline' 0 CA--C 1.56 1.785 1 C-N-CA 125.43 4.087 . . . . 0.0 113.89 175.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -69.22 150.79 71.94 Favored 'Trans proline' 0 CA--C 1.555 1.568 1 CA-C-N 129.952 4.59 . . . . 0.0 117.151 -170.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . 0.479 1.6 mmm180 -66.28 -2.43 0.05 OUTLIER Pre-proline 0 CA--C 1.576 1.974 1 N-CA-C 123.745 4.721 . . . . 0.0 123.745 176.641 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -21.99 161.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.371 1.763 2 C-N-CA 129.498 6.799 . . . . 0.0 127.16 161.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -66.77 -23.66 66.1 Favored 'General case' 0 C--N 1.364 1.198 0 C-N-CA 131.505 3.922 . . . . 0.0 116.381 174.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 121.34 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.601 0 C-N-CA 130.622 3.569 . . . . 0.0 112.136 174.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.76 -17.42 64.61 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 129.755 3.222 . . . . 0.0 115.442 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.17 -30.75 60.79 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 127.135 2.174 . . . . 0.0 112.122 172.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -97.49 -65.11 0.98 Allowed 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 125.48 1.512 . . . . 0.0 113.355 176.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.77 80.5 t80 26.68 -47.93 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.565 2 N-CA-C 127.369 6.063 . . . . 0.0 127.369 -173.643 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . 0.254 4.7 pt -119.93 136.13 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.102 0 N-CA-C 117.296 2.332 . . . . 0.0 117.296 -175.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' ' 83' ' ' MET . 0.4 OUTLIER -155.37 161.79 40.96 Favored 'General case' 0 CA--C 1.508 -0.655 1 C-N-CA 138.025 6.53 . . . . 0.0 102.593 176.241 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 41.61 23.83 0.13 Allowed Glycine 0 C--N 1.359 1.822 0 C-N-CA 129.528 3.442 . . . . 0.0 119.671 172.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.6 p -68.09 142.3 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.903 0 C-N-CA 130.248 3.419 . . . . 0.0 117.942 -160.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -94.42 16.92 14.0 Favored 'General case' 0 N--CA 1.44 -0.972 1 C-N-CA 132.106 4.162 . . . . 0.0 115.022 -174.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -96.85 -20.89 17.84 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 127.865 2.466 . . . . 0.0 107.835 173.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -112.82 152.39 44.78 Favored Pre-proline 0 C--N 1.353 0.734 0 N-CA-C 102.783 -3.044 . . . . 0.0 102.783 169.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -75.32 138.12 21.88 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.809 3.006 . . . . 0.0 110.229 176.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.47 48.88 3.51 Favored Glycine 0 C--N 1.359 1.835 0 C-N-CA 126.142 1.83 . . . . 0.0 115.155 -172.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -141.06 151.7 44.23 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.286 -1.714 . . . . 0.0 107.902 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.0 mt -109.61 114.11 27.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -128.81 109.42 11.26 Favored 'General case' 0 CA--C 1.496 -1.107 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 -173.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.762 HD12 HD23 ' A' ' 113' ' ' LEU . 1.3 pp -136.63 141.01 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.075 0 C-N-CA 125.752 1.621 . . . . 0.0 111.837 -171.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.5 m -117.9 118.47 32.09 Favored 'General case' 0 C--N 1.351 0.641 0 O-C-N 119.652 -1.905 . . . . 0.0 111.873 177.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.263 0.4 OUTLIER -176.6 170.36 2.45 Favored 'General case' 0 CA--C 1.479 -1.762 0 N-CA-C 102.724 -3.065 . . . . 0.0 102.724 172.727 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.597 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 94.0 -34.15 4.83 Favored Glycine 1 CA--C 1.417 -6.074 0 CA-C-O 115.044 -3.087 . . . . 0.0 110.753 -160.863 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 29.9 m-80 100.76 0.71 0.02 OUTLIER 'General case' 0 C--N 1.375 1.684 2 C-N-CA 132.232 4.213 . . . . 0.0 106.381 -157.448 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.654 HD11 ' HA ' ' A' ' 63' ' ' VAL 0.308 1.0 OUTLIER -86.72 137.03 32.79 Favored 'General case' 0 C--N 1.354 0.787 1 C-N-CA 138.103 6.561 . . . . 0.0 114.216 -178.681 . . . . . . . . 5 4 . 1 . 004 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.71 100.64 13.32 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 164.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.762 HD23 HD12 ' A' ' 106' ' ' ILE . 0.3 OUTLIER -96.22 126.82 41.7 Favored 'General case' 0 C--N 1.382 1.981 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 175.453 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.66 123.71 5.32 Favored Glycine 0 C--N 1.351 1.391 0 N-CA-C 105.899 -2.881 . . . . 0.0 105.899 174.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -122.97 127.3 48.66 Favored 'General case' 0 C--N 1.369 1.446 1 N-CA-C 99.648 -4.204 . . . . 0.0 99.648 174.713 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.1 m -121.18 127.88 51.93 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 -171.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.459 HG13 ' HB3' ' A' ' 127' ' ' PRO . 13.4 t -80.24 138.73 19.31 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.425 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.558 10.9 p -54.41 67.7 0.0 OUTLIER 'General case' 0 C--N 1.378 1.84 0 N-CA-C 120.845 3.646 . . . . 0.0 120.845 -162.06 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.465 11.8 ttmm -22.48 -45.81 0.05 OUTLIER Pre-proline 0 C--N 1.359 0.997 1 C-N-CA 133.999 4.92 . . . . 0.0 121.795 -170.251 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -70.63 60.18 2.12 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 CA-C-N 125.647 3.053 . . . . 0.0 113.595 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 17.0 p30 170.07 161.99 0.07 Allowed 'General case' 0 C--N 1.367 1.335 0 C-N-CA 128.038 2.535 . . . . 0.0 113.521 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.542 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 2.5 tt0 -85.28 -69.63 0.64 Allowed 'General case' 0 C--N 1.376 1.744 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 152.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 44.37 -10.76 0.0 OUTLIER 'General case' 0 C--N 1.363 1.173 1 C-N-CA 139.648 7.179 . . . . 0.0 118.018 -170.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.542 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 56.4 m-85 -138.9 -163.01 1.4 Allowed 'General case' 0 N--CA 1.414 -2.245 0 N-CA-C 121.212 3.782 . . . . 0.0 121.212 -161.138 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HB2' HD12 ' A' ' 81' ' ' LEU 0.364 0.0 OUTLIER -167.84 -56.4 0.02 OUTLIER 'General case' 0 C--N 1.359 1.019 2 C-N-CA 139.725 7.21 . . . . 0.0 105.484 179.051 . . . . . . . . 5 4 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.581 ' HB3' HD22 ' A' ' 81' ' ' LEU . 1.4 p30 -89.31 85.26 0.13 Allowed Pre-proline 0 C--N 1.357 0.894 1 C-N-CA 131.999 4.119 . . . . 0.0 111.912 171.969 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.459 ' HB3' HG13 ' A' ' 117' ' ' VAL . 2.8 Cg_exo -90.72 -176.08 0.94 Allowed 'Trans proline' 0 CA--C 1.488 -1.782 0 C-N-CA 124.136 3.224 . . . . 0.0 117.297 -161.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 16.6 m -112.41 136.07 52.34 Favored 'General case' 0 N--CA 1.439 -1.006 1 N-CA-C 100.192 -4.003 . . . . 0.0 100.192 162.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.5 mp -100.73 140.83 34.46 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 102.415 -3.18 . . . . 0.0 102.415 -175.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -100.28 -0.58 38.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.889 -1.132 . . . . 0.0 110.412 -166.592 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 45' ' ' TYR . 8.4 t 174.21 128.92 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -170.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -115.59 109.79 18.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 101.309 -3.589 . . . . 0.0 101.309 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 10.3 ttt -104.28 122.66 45.87 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.191 2.196 . . . . 0.0 107.423 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.301 . . -129.07 113.74 15.51 Favored 'General case' 0 N--CA 1.435 -1.213 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 173.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -144.24 159.98 15.37 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 C-N-CA 125.378 1.471 . . . . 0.0 111.836 -176.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.945 HD13 HD11 ' A' ' 141' ' ' LEU . 0.2 OUTLIER -140.11 -179.08 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 128.236 2.614 . . . . 0.0 108.989 -175.917 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.409 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -138.12 122.98 18.88 Favored 'General case' 0 CA--C 1.56 1.331 0 N-CA-C 117.938 2.57 . . . . 0.0 117.938 179.168 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.326 46.5 m 172.72 -76.01 0.0 OUTLIER 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.989 2.915 . . . . 0.0 105.486 177.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.459 ' HG2' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER 168.45 -123.78 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.156 1 N-CA-C 95.722 -5.659 . . . . 0.0 95.722 -172.363 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.459 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 -58.94 -24.72 62.82 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 130.979 3.711 . . . . 0.0 119.682 173.473 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.945 HD11 HD13 ' A' ' 136' ' ' ILE 0.359 0.0 OUTLIER 63.42 157.98 0.12 Allowed Pre-proline 0 N--CA 1.436 -1.125 2 C-N-CA 135.802 5.641 . . . . 0.0 124.276 178.991 . . . . . . . . 5 4 . 1 . 004 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -72.4 -20.33 24.19 Favored 'Trans proline' 0 C--N 1.366 1.46 1 C-N-CA 126.228 4.619 . . . . 0.0 116.85 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 32.62 55.14 0.48 Allowed Glycine 0 N--CA 1.472 1.058 1 C-N-CA 135.323 6.201 . . . . 0.0 122.583 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -141.57 137.96 32.31 Favored 'General case' 0 C--N 1.355 0.817 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 75.8 157.36 0.19 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 128.372 2.669 . . . . 0.0 116.288 -177.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 36.4 t -135.54 130.82 35.16 Favored 'General case' 0 C--N 1.363 1.189 0 O-C-N 119.351 -2.093 . . . . 0.0 105.834 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp 164.05 117.17 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.528 0 C-N-CA 128.726 2.81 . . . . 0.0 107.566 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -158.24 -82.35 0.05 Allowed 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 105.893 -1.891 . . . . 0.0 105.893 -172.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.8 -77.39 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.206 0 C-N-CA 125.88 1.672 . . . . 0.0 111.694 172.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.411 HG21 HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -103.3 134.78 43.51 Favored 'Isoleucine or valine' 0 CA--C 1.466 -2.251 0 C-N-CA 127.273 2.229 . . . . 0.0 107.637 -161.542 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -77.82 115.24 17.41 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 105.433 -2.062 . . . . 0.0 105.433 176.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 11.0 t -75.38 143.84 42.57 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -124.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.632 ' HA ' ' CG ' ' A' ' 73' ' ' HIS . 3.1 tp60 . . . . . 0 C--O 1.263 1.764 0 C-N-CA 129.235 3.014 . . . . 0.0 109.841 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.0 mtp . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . 0.311 17.8 p 50.1 92.76 0.02 OUTLIER 'General case' 0 C--N 1.361 1.067 0 N-CA-C 121.097 3.74 . . . . 0.0 121.097 176.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.409 ' O ' ' HB ' ' A' ' 7' ' ' VAL . 0.0 OUTLIER -79.86 79.05 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.374 1.652 0 C-N-CA 126.58 1.952 . . . . 0.0 108.808 173.836 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.462 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.452 2.5 m120 -114.8 10.01 16.42 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 128.661 2.784 . . . . 0.0 114.441 -178.857 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 -58.21 1.92 Allowed 'General case' 0 C--O 1.246 0.906 1 C-N-CA 132.504 4.321 . . . . 0.0 105.465 160.136 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.436 6.7 mt-10 -63.99 -8.74 12.47 Favored 'General case' 0 C--O 1.205 -1.243 0 O-C-N 119.49 -2.006 . . . . 0.0 115.358 177.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.5 p -67.93 -35.65 72.82 Favored 'Isoleucine or valine' 0 C--N 1.365 1.262 0 C-N-CA 131.488 3.915 . . . . 0.0 113.339 171.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -78.64 -43.81 25.32 Favored 'General case' 0 CA--C 1.497 -1.095 1 C-N-CA 133.062 4.545 . . . . 0.0 107.721 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.7 mt -64.39 -44.1 97.11 Favored 'Isoleucine or valine' 0 C--N 1.374 1.658 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.423 166.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.267 26.5 mmm-85 -54.8 -50.34 68.76 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 130.576 3.55 . . . . 0.0 111.536 174.259 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -57.89 -36.72 72.8 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 118.596 2.813 . . . . 0.0 118.596 163.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -76.64 -44.43 34.09 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 118.17 -2.831 . . . . 0.0 113.259 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 30.6 mmmt -63.67 -30.43 71.54 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 131.075 3.75 . . . . 0.0 106.95 172.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.533 HD22 ' CD2' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -67.87 -41.02 83.47 Favored 'General case' 0 C--N 1.373 1.619 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 162.334 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.4 mtp180 -60.15 -38.06 82.01 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.404 2.82 . . . . 0.0 112.425 171.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.8 mmt-85 -63.23 -53.25 55.97 Favored 'General case' 0 C--N 1.374 1.641 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB2' HD23 ' A' ' 14' ' ' LEU . 8.4 m-70 -59.07 -50.37 74.33 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 130.226 3.41 . . . . 0.0 112.343 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.546 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.62 -54.1 49.39 Favored 'General case' 0 C--N 1.378 1.819 0 C-N-CA 130.176 3.391 . . . . 0.0 111.165 176.69 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -73.57 -38.75 65.08 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -65.59 -43.73 88.8 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 125.438 1.495 . . . . 0.0 112.826 177.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.626 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.257 44.2 mt-10 -75.26 -28.99 60.03 Favored 'General case' 0 C--N 1.361 1.096 0 O-C-N 121.08 -1.012 . . . . 0.0 111.732 171.525 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.409 ' CE2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -67.89 -28.65 67.69 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 117.883 -3.011 . . . . 0.0 114.827 171.103 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -69.16 -37.04 78.02 Favored 'General case' 0 C--N 1.372 1.567 0 C-N-CA 125.629 1.572 . . . . 0.0 109.393 165.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -58.9 -43.15 90.97 Favored 'General case' 0 C--N 1.369 1.451 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 169.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -72.42 -46.23 57.01 Favored 'Isoleucine or valine' 0 C--N 1.366 1.32 0 O-C-N 121.267 -0.896 . . . . 0.0 111.626 176.288 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.448 ' HA ' ' CG1' ' A' ' 29' ' ' ILE 0.634 17.7 p30 -71.98 -22.62 61.41 Favored 'General case' 0 C--N 1.372 1.586 0 O-C-N 119.733 -1.855 . . . . 0.0 115.447 175.837 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -74.37 -43.11 57.92 Favored 'General case' 0 C--N 1.373 1.591 0 O-C-N 119.754 -1.841 . . . . 0.0 110.508 166.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.5 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.312 0.3 OUTLIER -64.86 -32.73 74.57 Favored 'General case' 0 C--N 1.395 2.576 0 O-C-N 118.756 -2.465 . . . . 0.0 113.526 173.196 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.549 HG21 HD23 ' A' ' 43' ' ' LEU 0.262 1.5 pp -67.84 -43.45 86.11 Favored 'Isoleucine or valine' 0 C--N 1.375 1.681 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 174.03 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.0 ttm105 -62.84 -37.67 87.72 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 119.748 -1.845 . . . . 0.0 115.853 174.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -76.59 -48.66 18.48 Favored 'General case' 0 CA--C 1.478 -1.793 0 C-N-CA 127.756 2.423 . . . . 0.0 111.27 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.473 ' CB ' HG11 ' A' ' 74' ' ' VAL . . . -68.52 -34.74 76.41 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 t -73.45 -43.33 60.53 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.281 1.432 . . . . 0.0 110.73 175.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -70.74 -35.72 72.82 Favored 'General case' 0 C--N 1.375 1.711 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.75 -32.7 62.17 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 126.194 1.798 . . . . 0.0 113.748 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -16.54 60.54 Favored 'General case' 0 C--N 1.385 2.125 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.56 18.38 28.25 Favored Glycine 0 C--N 1.37 2.426 0 O-C-N 121.123 -0.985 . . . . 0.0 115.289 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.52 HG21 ' CB ' ' A' ' 78' ' ' ASN . 0.6 OUTLIER -104.1 166.93 2.85 Favored 'Isoleucine or valine' 0 C--N 1.357 0.917 0 N-CA-C 101.722 -3.436 . . . . 0.0 101.722 176.03 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.442 ' N ' ' CG2' ' A' ' 38' ' ' VAL 0.298 0.0 OUTLIER -39.18 160.87 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.115 1 C-N-CA 134.417 5.087 . . . . 0.0 118.011 159.925 . . . . . . . . 5 4 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.9 p -103.89 117.76 35.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 118.808 -2.433 . . . . 0.0 110.034 -173.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -118.28 153.24 34.28 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-O 122.034 0.921 . . . . 0.0 110.372 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -113.83 105.8 13.7 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 129' ' ' LEU 0.356 0.1 OUTLIER -94.58 120.71 35.24 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 118.845 -2.409 . . . . 0.0 111.671 -169.347 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -132.55 145.23 50.97 Favored 'General case' 0 C--N 1.4 2.801 0 CA-C-N 120.64 1.564 . . . . 0.0 109.426 -170.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.547 ' HA ' ' H ' ' A' ' 132' ' ' ARG . 0.0 OUTLIER -92.65 147.32 22.97 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.582 3.153 . . . . 0.0 114.897 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.4 p -108.45 96.81 6.6 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 128.625 2.77 . . . . 0.0 105.543 175.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.429 ' HG2' ' H ' ' A' ' 47' ' ' GLN . 29.7 mm-40 -48.03 -8.43 0.02 OUTLIER 'General case' 0 C--O 1.2 -1.508 1 C-N-CA 132.056 4.142 . . . . 0.0 119.773 -174.871 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.34 81.43 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 125.383 3.72 . . . . 0.0 116.695 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.657 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.2 -38.96 92.93 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 129.726 3.21 . . . . 0.0 112.997 171.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.657 ' H ' HD22 ' A' ' 49' ' ' LEU . 5.9 tt -72.01 -36.59 69.76 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 127.456 2.303 . . . . 0.0 111.062 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.58 -30.41 71.13 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 129.642 3.177 . . . . 0.0 108.82 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -69.4 -45.68 68.67 Favored 'General case' 0 C--N 1.37 1.499 0 CA-C-O 124.306 2.003 . . . . 0.0 115.315 164.325 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.518 ' HB1' ' CD ' ' A' ' 60' ' ' GLU . . . -75.52 -27.83 58.89 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 117.574 2.435 . . . . 0.0 117.574 -172.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.496 HD12 ' CD2' ' A' ' 50' ' ' LEU . 5.2 tt -74.35 -37.61 45.48 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.845 1 C-N-CA 132.941 4.496 . . . . 0.0 110.587 176.831 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -107.94 -29.17 9.18 Favored 'General case' 0 C--N 1.38 1.904 0 N-CA-C 117.862 2.541 . . . . 0.0 117.862 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.81 -45.32 17.12 Favored 'General case' 0 C--N 1.357 0.933 0 CA-C-N 121.663 2.029 . . . . 0.0 114.35 -172.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.642 ' CG ' HD23 ' A' ' 141' ' ' LEU 0.276 0.0 OUTLIER -103.35 -44.05 5.26 Favored 'General case' 0 CA--C 1.48 -1.749 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 171.423 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.474 HG22 ' O ' ' A' ' 54' ' ' ILE 0.488 0.0 OUTLIER 74.82 -168.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.854 1 C-N-CA 131.984 4.114 . . . . 0.0 112.638 179.132 . . . . . . . . 5 4 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.434 ' HA ' ' HG ' ' A' ' 14' ' ' LEU 0.252 50.2 p30 21.94 49.54 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 1 C-N-CA 131.909 4.083 . . . . 0.0 117.786 179.002 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.518 ' CD ' ' HB1' ' A' ' 53' ' ' ALA 0.5 11.4 pt-20 -80.76 62.99 5.0 Favored 'General case' 0 C--N 1.362 1.12 0 CA-C-O 127.308 3.432 . . . . 0.0 112.227 -172.28 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.448 ' HA ' ' HB2' ' A' ' 64' ' ' PHE 0.561 1.4 p -80.64 -15.67 56.0 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.223 2.609 . . . . 0.0 116.994 176.884 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -71.44 -33.28 69.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.823 2.449 . . . . 0.0 107.871 167.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 136' ' ' ILE . 94.0 t -69.61 -36.21 69.66 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 128.059 2.544 . . . . 0.0 108.945 175.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 31.5 m-85 -66.92 -34.91 78.82 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.498 1.919 . . . . 0.0 115.826 164.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -83.01 -36.72 24.79 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-N 122.032 2.196 . . . . 0.0 112.086 -176.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.836 HD13 HD13 ' A' ' 111' ' ' LEU . 2.8 tt -65.41 -42.61 92.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.648 1.579 . . . . 0.0 110.934 167.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.926 0.0 OUTLIER -77.84 -15.15 59.27 Favored 'General case' 0 C--N 1.368 1.387 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 173.596 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . 0.283 21.2 m80 -83.77 -15.83 47.03 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 127.221 2.209 . . . . 0.0 112.042 166.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.489 0.0 OUTLIER -82.91 -27.49 30.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 119.973 -1.705 . . . . 0.0 109.107 155.052 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.453 HG13 ' HG ' ' A' ' 113' ' ' LEU . 18.7 mm -67.57 -9.55 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 C-N-CA 127.502 2.321 . . . . 0.0 113.537 170.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.5 ' HB2' ' CD ' ' A' ' 28' ' ' GLU . 62.2 pttt -49.98 -33.84 19.1 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 120.609 3.559 . . . . 0.0 120.609 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.497 ' HA ' HG12 ' A' ' 74' ' ' VAL . 31.4 t70 -101.62 8.41 41.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.517 -1.364 . . . . 0.0 107.454 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.444 ' NE2' HD12 ' A' ' 70' ' ' ILE . 1.3 m80 -66.87 -8.88 32.32 Favored 'General case' 0 C--N 1.395 2.569 0 C-N-CA 129.125 2.97 . . . . 0.0 110.988 171.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.497 HG12 ' HA ' ' A' ' 72' ' ' ASP . 9.9 p -41.38 -46.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 128.968 2.907 . . . . 0.0 112.02 157.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 71.5 mt -68.46 -23.88 64.65 Favored 'General case' 0 C--N 1.36 1.045 0 N-CA-C 117.563 2.431 . . . . 0.0 117.563 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -75.47 -46.63 31.34 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.541 1.536 . . . . 0.0 111.686 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.39 14.7 p -66.3 -29.0 45.25 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.4 0 C-N-CA 127.474 2.31 . . . . 0.0 110.206 172.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 75' ' ' LEU . 5.2 m120 -74.19 -38.69 63.55 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 128.285 2.634 . . . . 0.0 116.67 169.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -30.42 71.16 Favored 'General case' 0 C--N 1.372 1.555 0 C-N-CA 126.156 1.782 . . . . 0.0 110.896 172.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.22 -38.96 82.42 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 128.577 2.751 . . . . 0.0 112.283 166.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.513 HD11 ' HD2' ' A' ' 127' ' ' PRO . 2.5 tp -73.24 -15.66 61.42 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 128.551 2.74 . . . . 0.0 118.134 171.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.5 t -90.53 2.57 55.63 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 131.143 3.777 . . . . 0.0 115.222 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.437 ' CE ' HG23 ' A' ' 97' ' ' VAL . 3.0 ppp? -110.51 163.79 16.39 Favored Pre-proline 0 C--N 1.356 0.861 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 178.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -69.77 177.66 5.37 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 124.483 3.456 . . . . 0.0 113.258 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -72.8 135.03 22.88 Favored 'Trans proline' 0 C--N 1.358 1.037 0 CA-C-N 125.412 2.969 . . . . 0.0 110.021 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 11.2 mtt180 -45.86 106.69 0.58 Allowed Pre-proline 0 CA--C 1.564 1.507 0 N-CA-C 119.729 3.233 . . . . 0.0 119.729 -174.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 51.1 Cg_exo -61.55 162.62 20.48 Favored 'Trans proline' 0 C--N 1.361 1.22 1 C-N-CA 127.131 5.221 . . . . 0.0 119.809 -174.589 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.23 -10.34 19.66 Favored 'General case' 0 C--N 1.375 1.685 0 CA-C-O 123.277 1.513 . . . . 0.0 114.678 -173.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -89.0 -173.36 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 C-N-CA 130.636 3.574 . . . . 0.0 113.975 -176.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -130.94 -12.12 3.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 113.048 -1.887 . . . . 0.0 111.297 177.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -87.02 -48.33 8.19 Favored 'General case' 0 C--N 1.356 0.87 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -177.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -120.57 26.36 9.2 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.171 2.188 . . . . 0.0 110.969 -176.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.357 0.0 OUTLIER -69.86 -135.69 0.0 OUTLIER 'General case' 0 C--N 1.363 1.182 1 N-CA-C 122.398 4.221 . . . . 0.0 122.398 -171.719 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.463 HG23 ' CG2' ' A' ' 97' ' ' VAL . 8.2 mt -80.74 128.82 38.39 Favored 'Isoleucine or valine' 0 C--N 1.358 0.954 0 C-N-CA 128.893 2.877 . . . . 0.0 115.462 -177.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -144.18 -47.08 0.26 Allowed 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 113.228 -1.806 . . . . 0.0 111.392 -172.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -87.41 25.84 7.72 Favored Glycine 0 C--N 1.36 1.875 0 O-C-N 120.381 -1.449 . . . . 0.0 113.238 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.463 ' CG2' HG23 ' A' ' 94' ' ' ILE . 70.5 t -111.02 111.0 34.27 Favored 'Isoleucine or valine' 0 C--N 1.351 0.646 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -106.9 7.91 30.32 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 126.181 1.792 . . . . 0.0 112.948 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.418 ' HB3' ' H ' ' A' ' 100' ' ' ARG . 43.9 m-85 -132.46 -137.18 0.19 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.425 1.89 . . . . 0.0 113.917 -173.132 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.418 ' H ' ' HB3' ' A' ' 99' ' ' TYR . 30.9 mmm180 -113.04 167.67 8.89 Favored Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 127.74 2.416 . . . . 0.0 113.078 -172.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -59.15 70.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 1 C-N-CA 127.051 5.167 . . . . 0.0 122.453 -176.987 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 95.77 -4.16 65.76 Favored Glycine 0 N--CA 1.467 0.729 0 C-N-CA 127.306 2.384 . . . . 0.0 110.919 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.54 147.63 34.97 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 127.193 2.197 . . . . 0.0 113.975 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.7 tt -135.38 123.74 23.27 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -129.54 130.25 45.52 Favored 'General case' 0 C--N 1.365 1.279 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.41 HG22 HG12 ' A' ' 150' ' ' ILE 0.493 0.0 OUTLIER -135.27 140.72 44.4 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.294 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.9 t -124.71 143.6 50.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 119.223 -2.173 . . . . 0.0 113.213 -173.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.588 ' HB3' HD21 ' A' ' 66' ' ' LEU . 27.0 t70 -124.64 82.77 2.08 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 120.018 -1.677 . . . . 0.0 108.322 174.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.52 -47.0 0.05 OUTLIER Glycine 0 C--N 1.368 2.339 0 C-N-CA 129.78 3.562 . . . . 0.0 119.419 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -119.24 -49.17 2.4 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 128.219 2.608 . . . . 0.0 107.421 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.836 HD13 HD13 ' A' ' 66' ' ' LEU 0.318 5.6 mp -80.05 134.45 36.21 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 122.382 2.355 . . . . 0.0 117.062 179.234 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -104.81 101.64 11.23 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 104.987 -2.227 . . . . 0.0 104.987 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.453 ' HG ' HG13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -102.87 122.01 43.67 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 177.616 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.79 135.38 12.49 Favored Glycine 0 C--N 1.356 1.671 0 N-CA-C 106.76 -2.536 . . . . 0.0 106.76 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.9 135.58 48.52 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 48.5 m -135.5 134.62 39.69 Favored 'General case' 0 C--N 1.371 1.523 0 O-C-N 119.049 -2.282 . . . . 0.0 105.248 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.485 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 14.9 m -66.48 166.46 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.572 0 C-N-CA 125.385 1.474 . . . . 0.0 111.936 177.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.371 24.4 p -67.45 63.19 0.07 Allowed 'General case' 0 C--N 1.35 0.63 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -24.43 -47.0 0.09 OUTLIER Pre-proline 0 C--N 1.353 0.756 1 C-N-CA 137.356 6.262 . . . . 0.0 118.988 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -73.72 53.06 2.66 Favored 'Trans proline' 0 CA--C 1.566 2.109 0 C-N-CA 123.718 2.945 . . . . 0.0 113.364 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -159.23 152.34 22.22 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.914 2.086 . . . . 0.0 110.706 -175.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -126.09 11.25 7.61 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 120.472 1.487 . . . . 0.0 112.465 170.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.314 0.0 OUTLIER -95.34 2.83 54.81 Favored 'General case' 0 C--N 1.364 1.215 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 -176.361 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.536 ' HB2' ' HD3' ' A' ' 125' ' ' LYS 0.53 0.0 OUTLIER -45.66 149.75 0.57 Allowed 'General case' 0 C--N 1.353 0.741 1 N-CA-C 122.074 4.101 . . . . 0.0 122.074 178.427 . . . . . . . . 5 4 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.708 ' H ' ' HD3' ' A' ' 127' ' ' PRO 0.816 10.8 mmtt 125.01 92.79 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.594 1 C-N-CA 134.606 5.162 . . . . 0.0 103.787 169.766 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.414 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.8 t70 112.51 13.48 0.0 OUTLIER Pre-proline 0 CA--C 1.592 2.572 1 C-N-CA 131.706 4.002 . . . . 0.0 113.49 -156.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.708 ' HD3' ' H ' ' A' ' 125' ' ' LYS . 85.0 Cg_endo -63.88 -175.44 0.29 Allowed 'Trans proline' 0 C--N 1.387 2.556 2 C-N-CA 127.987 5.791 . . . . 0.0 119.364 175.23 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 38.4 m -101.99 164.52 11.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 109.905 -3.316 . . . . 0.0 104.467 170.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 43' ' ' LEU . 5.8 mp -102.48 143.5 32.11 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 102.406 -3.183 . . . . 0.0 102.406 171.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.02 53.99 1.97 Allowed 'General case' 0 CA--C 1.484 -1.583 0 N-CA-C 104.243 -2.503 . . . . 0.0 104.243 -170.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 1.8 m 147.28 104.2 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 104.587 -2.375 . . . . 0.0 104.587 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.547 ' H ' ' HA ' ' A' ' 45' ' ' TYR . 7.9 tpt180 -117.39 112.76 21.12 Favored 'General case' 0 N--CA 1.439 -0.992 1 N-CA-C 99.667 -4.198 . . . . 0.0 99.667 166.953 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.0 ttt -109.07 126.83 53.58 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.28 114.91 17.51 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 171.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.481 HD11 ' CB ' ' A' ' 49' ' ' LEU . 0.5 OUTLIER -137.57 157.58 33.83 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.205 1.802 . . . . 0.0 108.092 178.845 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.662 HD11 HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -142.08 175.08 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 N-CA-C 100.546 -3.872 . . . . 0.0 100.546 173.177 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -115.08 137.86 51.53 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.592 3.157 . . . . 0.0 106.194 168.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.468 ' HB3' ' HG3' ' A' ' 139' ' ' ARG . 17.5 m -140.63 -127.09 0.1 Allowed 'General case' 0 CA--C 1.502 -0.875 0 CA-C-N 121.009 1.731 . . . . 0.0 112.872 -178.001 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.599 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -92.82 -85.11 0.27 Allowed 'General case' 0 N--CA 1.428 -1.55 1 C-N-CA 134.184 4.994 . . . . 0.0 105.671 179.97 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.599 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 5.5 ptp180 -94.23 -9.06 37.43 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 128.376 2.67 . . . . 0.0 112.907 174.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.642 HD23 ' CG ' ' A' ' 57' ' ' GLU 0.508 0.4 OUTLIER -69.65 115.52 33.95 Favored Pre-proline 0 C--N 1.382 1.984 0 C-N-CA 129.407 3.083 . . . . 0.0 110.315 -177.688 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -88.1 109.3 0.61 Allowed 'Trans proline' 0 C--N 1.297 -2.173 0 CA-C-N 122.244 1.837 . . . . 0.0 113.479 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -176.86 66.88 0.09 OUTLIER Glycine 0 N--CA 1.477 1.432 0 N-CA-C 117.803 1.881 . . . . 0.0 117.803 163.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.09 114.03 7.0 Favored 'General case' 0 C--N 1.367 1.357 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -175.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 175.1 -173.81 0.08 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 131.437 3.895 . . . . 0.0 101.739 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . 0.314 74.1 m 149.92 134.35 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 129.245 3.018 . . . . 0.0 112.984 174.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 81.7 tttt 177.91 178.83 0.33 Allowed 'General case' 0 C--N 1.368 1.399 1 N-CA-C 99.714 -4.18 . . . . 0.0 99.714 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 59.81 118.42 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.969 1 N-CA-C 124.405 4.965 . . . . 0.0 124.405 156.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 38.2 t -112.62 110.62 32.86 Favored 'Isoleucine or valine' 0 C--N 1.37 1.466 0 O-C-N 118.712 -2.493 . . . . 0.0 115.784 -174.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.41 HG12 HG22 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -129.55 117.48 42.49 Favored 'Isoleucine or valine' 0 C--N 1.359 1.006 0 C-N-CA 127.803 2.441 . . . . 0.0 106.483 173.431 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.406 ' HD3' HG22 ' A' ' 152' ' ' THR 0.5 0.0 OUTLIER -122.69 153.88 38.82 Favored 'General case' 0 CA--C 1.478 -1.818 1 C-N-CA 132.527 4.331 . . . . 0.0 104.652 167.956 . . . . . . . . 5 4 . 1 . 005 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.406 HG22 ' HD3' ' A' ' 151' ' ' LYS 0.339 9.2 t -70.65 97.9 1.42 Allowed 'General case' 0 N--CA 1.431 -1.375 1 CA-C-O 131.763 5.554 . . . . 0.0 117.932 -150.787 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 . . . . . 0 N--CA 1.42 -1.958 3 C-N-CA 148.359 10.663 . . . . 0.0 121.009 166.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ptt? . . . . . 0 C--O 1.233 0.21 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.3 m -156.82 133.29 9.97 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 175.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.3 mm -90.34 50.41 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.382 0 O-C-N 119.4 -2.062 . . . . 0.0 111.504 -175.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.408 ' HA ' HG13 ' A' ' 7' ' ' VAL . 5.1 t-20 -49.41 -3.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.969 1 C-N-CA 135.435 5.494 . . . . 0.0 118.252 -175.169 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -60.81 2.05 Favored 'General case' 0 C--N 1.353 0.72 1 C-N-CA 133.602 4.761 . . . . 0.0 110.253 171.967 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -73.17 -17.28 61.39 Favored 'General case' 0 C--N 1.373 1.588 0 C-N-CA 126.815 2.046 . . . . 0.0 112.571 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.408 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.253 0.6 OUTLIER -80.7 -36.61 15.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 127.133 2.173 . . . . 0.0 110.598 175.153 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -64.63 -46.25 83.39 Favored 'General case' 0 C--N 1.375 1.674 0 C-N-CA 128.344 2.657 . . . . 0.0 108.657 175.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.8 mt -54.59 -43.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.362 1.118 0 C-N-CA 126.279 1.831 . . . . 0.0 112.968 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.38 11.0 ttt180 -67.48 -42.91 82.2 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 171.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -60.27 -27.52 67.32 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 165.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -76.91 -50.72 12.66 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 130.315 3.446 . . . . 0.0 109.99 173.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -57.25 -29.22 63.63 Favored 'General case' 0 C--N 1.378 1.814 0 C-N-CA 128.234 2.614 . . . . 0.0 110.666 170.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' A' ' 54' ' ' ILE . 4.0 tp -72.08 -44.14 63.72 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 124.319 1.048 . . . . 0.0 113.664 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -54.9 -43.66 73.46 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.319 -1.488 . . . . 0.0 110.607 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.2 mtp85 -63.39 -46.1 87.99 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 166.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.38 -47.84 82.55 Favored 'General case' 0 C--N 1.384 2.077 0 C-N-CA 130.111 3.364 . . . . 0.0 113.268 175.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.613 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.91 -46.71 83.6 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 130.407 3.483 . . . . 0.0 110.732 176.212 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.93 -42.66 57.29 Favored 'General case' 0 C--N 1.377 1.765 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.7 m -68.31 -43.09 78.4 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 127.023 2.129 . . . . 0.0 112.281 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.63 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.409 43.8 mt-10 -74.55 -28.72 61.07 Favored 'General case' 0 C--N 1.364 1.208 0 O-C-N 120.442 -1.411 . . . . 0.0 112.223 169.334 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.256 0.6 OUTLIER -60.71 -34.07 73.83 Favored 'General case' 0 C--N 1.38 1.924 0 O-C-N 119.035 -2.291 . . . . 0.0 112.978 165.384 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.7 mtt85 -66.23 -35.81 81.38 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 120.648 -1.283 . . . . 0.0 112.101 166.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -60.8 -46.74 89.32 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 116.879 2.178 . . . . 0.0 116.879 166.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.2 mt -70.98 -45.07 74.81 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 O-C-N 120.657 -1.277 . . . . 0.0 111.756 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.646 0.5 OUTLIER -71.28 -23.68 62.01 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 119.346 -2.097 . . . . 0.0 114.929 175.203 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -73.11 -35.2 66.53 Favored 'General case' 0 C--N 1.384 2.085 0 O-C-N 121.244 -0.91 . . . . 0.0 110.822 169.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -66.51 -39.74 88.84 Favored 'General case' 0 C--N 1.391 2.408 0 O-C-N 119.127 -2.233 . . . . 0.0 112.002 169.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.469 HG13 HG22 ' A' ' 74' ' ' VAL . 1.4 mp -61.99 -46.32 96.75 Favored 'Isoleucine or valine' 0 C--N 1.37 1.457 0 CA-C-N 119.52 1.055 . . . . 0.0 113.567 172.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 -59.46 -39.96 85.33 Favored 'General case' 0 C--N 1.357 0.92 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 173.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -76.49 -44.71 34.19 Favored 'General case' 0 CA--C 1.487 -1.45 0 O-C-N 119.428 -2.045 . . . . 0.0 111.183 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.88 -44.84 60.83 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 124.764 1.226 . . . . 0.0 114.031 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.2 t -69.38 -28.8 66.49 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 120.106 -1.621 . . . . 0.0 110.899 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -75.75 -41.0 54.45 Favored 'General case' 0 C--N 1.389 2.309 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 165.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.22 -31.93 64.45 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 127.059 2.144 . . . . 0.0 114.809 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.67 -12.34 59.99 Favored 'General case' 0 C--N 1.382 1.99 0 O-C-N 121.107 -0.996 . . . . 0.0 111.691 166.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.66 18.16 60.58 Favored Glycine 0 C--N 1.381 3.065 0 O-C-N 120.813 -1.179 . . . . 0.0 114.813 168.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.523 ' HB ' HD12 ' A' ' 81' ' ' LEU 0.394 0.7 OUTLIER -99.2 178.88 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.168 0 C-N-CA 126.917 2.087 . . . . 0.0 110.344 -172.871 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 t -29.23 -55.11 0.14 Allowed 'General case' 0 N--CA 1.488 1.439 1 C-N-CA 132.127 4.171 . . . . 0.0 116.984 -174.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.29 3.2 t 82.46 111.65 0.06 Allowed 'General case' 0 C--N 1.359 1.009 0 C-N-CA 131.652 3.981 . . . . 0.0 108.638 -174.279 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 77' ' ' VAL . 3.9 p90 -113.24 158.42 20.51 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 122.347 1.07 . . . . 0.0 111.065 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -100.72 155.66 17.77 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 127.536 2.334 . . . . 0.0 105.371 175.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -119.34 126.02 50.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 O-C-N 120.442 -1.411 . . . . 0.0 108.596 -174.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -115.27 169.92 8.77 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-O 124.298 1.999 . . . . 0.0 108.038 174.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.636 ' CD2' HD13 ' A' ' 50' ' ' LEU 0.293 14.1 m-30 -107.99 172.13 7.01 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.3 2.24 . . . . 0.0 108.623 176.209 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.34 91.36 3.49 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 101.963 -3.347 . . . . 0.0 101.963 153.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.488 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.321 0.0 OUTLIER -56.25 -10.46 0.88 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 127.631 2.373 . . . . 0.0 115.654 179.858 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.67 -38.74 28.47 Favored 'General case' 0 C--N 1.374 1.652 0 C-N-CA 129.031 2.932 . . . . 0.0 111.222 171.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.599 HD13 ' N ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -62.55 -46.07 90.04 Favored 'General case' 0 C--N 1.372 1.552 0 CA-C-O 125.297 2.475 . . . . 0.0 108.377 167.502 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.673 HD23 ' CG1' ' A' ' 54' ' ' ILE 0.298 0.1 OUTLIER -62.9 -37.54 87.35 Favored 'General case' 0 C--O 1.21 -1.017 0 C-N-CA 127.474 2.31 . . . . 0.0 110.192 172.534 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -54.91 -32.74 61.42 Favored 'General case' 0 C--N 1.37 1.472 0 O-C-N 117.603 -3.186 . . . . 0.0 111.876 168.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -74.94 -58.01 3.55 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 158.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.4 -27.47 66.02 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 119.096 2.999 . . . . 0.0 119.096 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.673 ' CG1' HD23 ' A' ' 50' ' ' LEU . 29.8 mt -75.15 -48.62 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.761 0 C-N-CA 129.977 3.311 . . . . 0.0 110.709 172.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.594 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -106.62 -12.12 15.66 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -176.443 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -78.44 -3.5 43.66 Favored 'General case' 0 C--N 1.365 1.261 0 CA-C-N 122.347 2.339 . . . . 0.0 114.305 -174.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -157.86 -48.99 0.06 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.766 1.626 . . . . 0.0 111.346 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.594 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.542 0.2 OUTLIER 83.59 160.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.372 1.587 1 C-N-CA 131.97 4.108 . . . . 0.0 112.036 178.142 . . . . . . . . 5 4 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.537 ' N ' HD22 ' A' ' 14' ' ' LEU . 13.5 t70 38.14 54.29 1.7 Allowed 'General case' 0 N--CA 1.513 2.685 0 C-N-CA 131.465 3.906 . . . . 0.0 114.642 -176.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.625 ' HA ' HH22 ' A' ' 139' ' ' ARG 0.484 10.4 pt-20 -75.92 66.03 2.09 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 125.499 2.571 . . . . 0.0 113.822 178.643 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.374 18.2 p -79.26 -16.85 55.82 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.925 2.89 . . . . 0.0 114.108 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -65.55 -33.95 77.12 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 129.652 3.181 . . . . 0.0 110.188 166.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -65.77 -46.68 88.24 Favored 'Isoleucine or valine' 0 C--N 1.362 1.116 0 C-N-CA 127.567 2.347 . . . . 0.0 109.888 -174.403 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.63 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 48.7 m-85 -62.41 -39.54 93.6 Favored 'General case' 0 C--O 1.21 -0.996 1 C-N-CA 132.572 4.349 . . . . 0.0 112.473 168.031 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -66.53 -45.41 79.54 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.724 2.056 . . . . 0.0 112.787 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.662 HD12 HD21 ' A' ' 111' ' ' LEU . 1.9 tm? -64.79 -49.3 71.22 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.974 1.309 . . . . 0.0 113.104 168.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.455 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.883 0.0 OUTLIER -76.38 -16.55 59.69 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 118.818 -2.426 . . . . 0.0 114.996 -176.908 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.3 m80 -78.69 -27.57 45.1 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.729 2.412 . . . . 0.0 110.249 162.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -79.92 -18.98 49.15 Favored 'General case' 0 C--N 1.366 1.317 0 O-C-N 119.578 -1.951 . . . . 0.0 111.972 166.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.282 0.0 OUTLIER -97.62 -16.23 7.17 Favored 'Isoleucine or valine' 0 C--N 1.369 1.444 0 C-N-CA 127.168 2.187 . . . . 0.0 114.052 -177.348 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -52.15 -4.12 0.03 OUTLIER 'General case' 0 C--N 1.363 1.161 1 C-N-CA 133.973 4.909 . . . . 0.0 119.536 -175.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.262 29.7 t70 -95.77 -3.92 44.89 Favored 'General case' 0 N--CA 1.416 -2.146 1 C-N-CA 133.261 4.624 . . . . 0.0 108.373 178.783 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.41 ' CE1' ' HB2' ' A' ' 153' ' ' GLN . 0.1 OUTLIER -57.56 -8.24 0.81 Allowed 'General case' 0 C--N 1.385 2.113 0 C-N-CA 130.282 3.433 . . . . 0.0 114.149 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.469 HG22 HG13 ' A' ' 29' ' ' ILE . 40.3 t -42.05 -32.04 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 128.654 2.782 . . . . 0.0 115.225 157.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.52 -37.46 50.89 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.856 2.462 . . . . 0.0 113.326 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.08 -35.81 72.0 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 119.471 -2.018 . . . . 0.0 111.21 172.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.463 HG11 ' CZ ' ' A' ' 41' ' ' PHE 0.541 16.4 t -72.33 -28.55 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.16 0 C-N-CA 129.933 3.293 . . . . 0.0 112.199 173.254 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.406 ' ND2' HG11 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -67.01 -43.89 81.72 Favored 'General case' 0 C--N 1.379 1.876 0 C-N-CA 129.914 3.286 . . . . 0.0 111.278 168.301 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -63.45 -35.77 81.54 Favored 'General case' 0 C--N 1.381 1.973 0 C-N-CA 126.273 1.829 . . . . 0.0 112.182 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.32 -39.14 89.41 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 127.023 2.129 . . . . 0.0 114.539 169.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.523 HD12 ' HB ' ' A' ' 38' ' ' VAL . 2.4 tm? -75.15 -13.91 60.51 Favored 'General case' 0 C--N 1.373 1.591 0 C-N-CA 130.464 3.506 . . . . 0.0 113.559 173.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . 0.307 22.6 p -75.45 -1.48 24.24 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 118.617 2.821 . . . . 0.0 118.617 -171.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.78 144.93 29.27 Favored Pre-proline 0 C--N 1.359 0.988 0 O-C-N 121.049 -1.032 . . . . 0.0 109.887 175.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -64.86 157.17 58.0 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 124.981 3.787 . . . . 0.0 110.291 166.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . 0.281 1.1 Cg_endo -48.83 144.72 14.48 Favored 'Trans proline' 0 C--N 1.36 1.154 1 C-N-CA 125.528 4.152 . . . . 0.0 122.446 -152.469 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 91.4 mtm-85 -114.69 80.94 6.73 Favored Pre-proline 0 C--N 1.361 1.083 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 177.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -71.9 163.52 38.57 Favored 'Trans proline' 0 C--N 1.36 1.175 1 C-N-CA 128.25 5.967 . . . . 0.0 111.545 168.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -47.57 -22.46 0.49 Allowed 'General case' 0 C--N 1.357 0.914 1 C-N-CA 133.477 4.711 . . . . 0.0 116.491 177.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.2 pt -94.39 87.49 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.905 0 C-N-CA 131.4 3.88 . . . . 0.0 108.543 170.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.42 -8.08 48.12 Favored 'General case' 0 C--N 1.315 -0.901 2 CA-C-N 106.505 -4.861 . . . . 0.0 109.687 170.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -98.24 -31.94 11.81 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 126.268 1.827 . . . . 0.0 115.204 177.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -98.05 -10.94 23.52 Favored 'General case' 0 C--N 1.35 0.603 0 O-C-N 121.342 -0.849 . . . . 0.0 113.048 -177.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -125.38 -51.47 1.63 Allowed 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -176.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.786 HG23 ' CG1' ' A' ' 97' ' ' VAL 0.299 87.3 mt -78.81 94.3 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 CA-C-O 127.208 3.385 . . . . 0.0 114.355 -172.766 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -139.24 -38.0 0.5 Allowed 'General case' 0 CA--C 1.491 -1.308 1 CA-C-N 107.332 -4.485 . . . . 0.0 110.038 -173.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.51 7.05 65.75 Favored Glycine 0 C--N 1.359 1.845 0 C-N-CA 124.142 0.877 . . . . 0.0 110.943 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.786 ' CG1' HG23 ' A' ' 94' ' ' ILE 0.396 11.3 p -113.41 90.73 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.359 1.006 0 CA-C-O 125.724 2.678 . . . . 0.0 111.248 178.258 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -135.07 16.98 3.47 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 110.643 -2.98 . . . . 0.0 106.221 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -123.29 -51.74 1.86 Allowed 'General case' 0 C--N 1.346 0.44 0 C-N-CA 126.524 1.93 . . . . 0.0 113.19 -173.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 14.4 mtt-85 -99.5 115.84 65.37 Favored Pre-proline 0 C--N 1.358 0.975 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -170.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -76.2 156.01 37.61 Favored 'Trans proline' 0 C--N 1.363 1.33 1 C-N-CA 125.314 4.009 . . . . 0.0 111.987 171.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.53 -9.94 82.3 Favored Glycine 0 C--N 1.365 2.173 0 C-N-CA 127.062 2.268 . . . . 0.0 117.518 -173.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -141.31 155.14 46.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 126.363 1.865 . . . . 0.0 107.483 173.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.0 mt -110.66 140.46 44.99 Favored 'General case' 0 C--N 1.348 0.505 0 C-N-CA 127.011 2.125 . . . . 0.0 110.034 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -129.29 110.85 12.29 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 103.877 -2.638 . . . . 0.0 103.877 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.418 ' HB ' HD11 ' A' ' 150' ' ' ILE . 13.9 pt -134.9 139.68 46.91 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 -177.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.4 m -126.69 111.16 13.95 Favored 'General case' 0 C--N 1.367 1.339 0 N-CA-C 104.234 -2.506 . . . . 0.0 104.234 -176.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 150' ' ' ILE . 4.0 t0 -136.78 161.18 36.68 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 103.618 -2.734 . . . . 0.0 103.618 -171.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.502 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 82.65 -58.01 5.02 Favored Glycine 0 N--CA 1.484 1.846 0 O-C-N 120.072 -1.642 . . . . 0.0 116.837 169.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 162.11 -29.77 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.276 1 C-N-CA 136.344 5.858 . . . . 0.0 106.691 -167.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.693 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.588 0.9 OUTLIER -79.67 137.42 37.07 Favored 'General case' 0 C--N 1.375 1.714 2 C-N-CA 132.33 4.252 . . . . 0.0 122.131 -176.858 . . . . . . . . 5 4 . 1 . 006 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -89.74 101.21 13.91 Favored 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 103.668 -2.716 . . . . 0.0 103.668 171.396 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.343 22.8 mt -94.23 137.49 33.34 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.1 2.16 . . . . 0.0 106.404 -178.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.82 132.69 8.51 Favored Glycine 0 C--N 1.349 1.268 0 O-C-N 119.761 -1.837 . . . . 0.0 110.372 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . 0.266 1.7 m-30 -120.47 140.13 51.86 Favored 'General case' 0 C--N 1.368 1.408 0 N-CA-C 101.407 -3.553 . . . . 0.0 101.407 172.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 92.5 m -124.82 151.84 44.7 Favored 'General case' 0 CA--C 1.49 -1.347 1 N-CA-C 99.833 -4.136 . . . . 0.0 99.833 171.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 118' ' ' CYS . 45.4 t -74.33 156.61 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 126.47 1.908 . . . . 0.0 107.931 169.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.545 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.29 72.2 m -68.54 95.49 0.64 Allowed 'General case' 0 C--N 1.362 1.133 0 CA-C-O 123.849 1.785 . . . . 0.0 109.097 164.76 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -71.94 -40.09 7.58 Favored Pre-proline 0 N--CA 1.432 -1.374 0 C-N-CA 130.795 3.638 . . . . 0.0 112.875 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -74.29 59.74 4.69 Favored 'Trans proline' 0 CA--C 1.559 1.73 0 CA-C-N 127.028 3.546 . . . . 0.0 114.122 174.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.361 4.3 p30 -162.54 -80.55 0.04 OUTLIER 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.405 2.282 . . . . 0.0 110.502 173.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . 0.403 23.9 tt0 19.52 88.29 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.7 2 C-N-CA 137.796 6.438 . . . . 0.0 122.498 -174.741 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -118.66 0.51 11.51 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 129.821 3.248 . . . . 0.0 107.661 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -114.88 -144.46 0.39 Allowed 'General case' 0 C--N 1.349 0.567 0 C-N-CA 128.298 2.639 . . . . 0.0 112.791 -165.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.264 7.9 mptt -116.84 -73.72 0.63 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 -178.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -152.98 92.03 3.36 Favored Pre-proline 0 C--N 1.353 0.752 0 CA-C-O 112.797 -3.478 . . . . 0.0 109.427 171.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -125.59 17.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.243 1 CA-C-N 130.678 4.849 . . . . 0.0 120.615 -174.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.6 t -147.56 148.21 30.91 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 156.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.2 mt -103.32 133.11 48.94 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 170.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.545 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 20.8 tt0 -91.29 44.04 1.17 Allowed 'General case' 0 C--N 1.369 1.427 0 CA-C-N 122.247 2.294 . . . . 0.0 112.355 -173.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 30.7 p 129.13 140.39 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 129.087 2.955 . . . . 0.0 106.748 -175.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -116.02 109.54 17.67 Favored 'General case' 0 N--CA 1.441 -0.914 1 N-CA-C 97.407 -5.034 . . . . 0.0 97.407 157.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.17 132.07 40.52 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 127.501 2.321 . . . . 0.0 107.662 -176.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.16 115.03 17.07 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.8 mt -141.58 129.78 22.35 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 CA-C-O 123.868 1.794 . . . . 0.0 106.397 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.693 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -118.88 179.39 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 124.829 2.252 . . . . 0.0 114.27 -170.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.65 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.7 OUTLIER -143.5 136.07 27.27 Favored 'General case' 0 N--CA 1.442 -0.846 2 C-N-CA 134.994 5.318 . . . . 0.0 98.251 171.068 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.592 ' HB2' ' HG ' ' A' ' 141' ' ' LEU . 1.0 OUTLIER -158.71 -110.45 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -169.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.625 HH22 ' HA ' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -113.04 -83.68 0.59 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.184 2.593 . . . . 0.0 111.041 -166.403 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.617 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 1.0 OUTLIER -86.16 7.84 23.37 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 131.556 3.942 . . . . 0.0 109.695 169.161 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER -76.56 163.65 64.59 Favored Pre-proline 0 CA--C 1.572 1.827 0 CA-C-O 115.82 -2.038 . . . . 0.0 106.741 -169.364 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.57 ' HD2' HD13 ' A' ' 141' ' ' LEU . 19.9 Cg_exo -51.57 -33.84 49.88 Favored 'Trans proline' 0 N--CA 1.477 0.534 3 C-N-CA 125.736 4.291 . . . . 0.0 122.686 179.221 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -174.55 -163.05 27.18 Favored Glycine 0 N--CA 1.432 -1.61 0 C-N-CA 126.198 1.856 . . . . 0.0 109.898 -177.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -120.79 149.42 42.58 Favored 'General case' 0 N--CA 1.433 -1.322 1 C-N-CA 134.209 5.004 . . . . 0.0 111.555 -176.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -126.68 -154.96 0.66 Allowed 'General case' 0 C--N 1.357 0.894 0 C-N-CA 128.446 2.698 . . . . 0.0 110.208 -179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 83.5 p -98.69 -138.38 0.3 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 126.608 1.963 . . . . 0.0 112.668 -177.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -165.35 109.47 0.86 Allowed 'General case' 0 C--N 1.359 0.998 0 O-C-N 119.59 -1.944 . . . . 0.0 108.504 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.331 . . -135.5 32.4 3.07 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 29.3 m -66.69 116.31 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.072 1 C-N-CA 133.95 4.9 . . . . 0.0 118.199 -169.262 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 108' ' ' ASP . 1.4 pt -94.37 143.32 11.94 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 C-N-CA 130.411 3.484 . . . . 0.0 106.455 170.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.412 46.4 mtpt -120.56 148.67 43.56 Favored 'General case' 0 CA--C 1.496 -1.115 1 N-CA-C 96.977 -5.194 . . . . 0.0 96.977 162.804 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 6.4 t -74.61 144.06 44.08 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 121.035 3.717 . . . . 0.0 121.035 -131.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.41 ' HB2' ' CE1' ' A' ' 73' ' ' HIS . 66.1 mt-30 . . . . . 0 C--O 1.264 1.852 2 CA-C-N 105.926 -5.125 . . . . 0.0 110.655 -172.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.8 mtt . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.0 m -69.5 117.74 11.5 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 126.842 2.057 . . . . 0.0 113.755 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.8 mm -81.27 66.61 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.31 0 CA-C-O 125.054 2.359 . . . . 0.0 113.006 -177.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.447 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 6.2 t-20 -97.47 9.37 42.56 Favored 'General case' 0 C--O 1.222 -0.363 1 C-N-CA 133.533 4.733 . . . . 0.0 109.442 178.154 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -64.7 0.84 Allowed 'General case' 0 C--N 1.355 0.826 0 C-N-CA 130.583 3.553 . . . . 0.0 112.058 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -71.45 -12.02 61.18 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 125.554 1.541 . . . . 0.0 113.241 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.447 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.6 OUTLIER -81.2 -39.31 17.32 Favored 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 127.829 2.452 . . . . 0.0 110.22 174.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -66.1 -42.81 88.76 Favored 'General case' 0 C--N 1.371 1.505 0 C-N-CA 129.047 2.939 . . . . 0.0 109.114 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.2 -43.36 89.45 Favored 'Isoleucine or valine' 0 C--N 1.377 1.766 0 C-N-CA 125.348 1.459 . . . . 0.0 111.297 165.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.25 0.0 OUTLIER -58.52 -50.61 73.15 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 169.52 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -56.34 -26.14 51.54 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 117.915 -2.991 . . . . 0.0 115.404 166.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -77.12 -38.23 52.57 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 118.928 -2.358 . . . . 0.0 113.731 165.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.609 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 8.4 mmmt -65.07 -27.78 69.01 Favored 'General case' 0 C--N 1.372 1.557 1 CA-C-O 129.078 4.275 . . . . 0.0 107.376 170.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.594 HD12 HG13 ' A' ' 54' ' ' ILE . 0.3 OUTLIER -71.55 -46.38 59.65 Favored 'General case' 0 C--O 1.206 -1.219 0 O-C-N 116.634 -3.791 . . . . 0.0 112.479 166.936 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -55.76 -27.6 51.67 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.632 2.086 . . . . 0.0 116.632 167.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.609 ' HG3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -69.88 -49.79 48.82 Favored 'General case' 0 C--N 1.397 2.647 0 CA-C-N 121.842 2.11 . . . . 0.0 112.896 168.928 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.419 ' CD2' ' HB ' ' A' ' 61' ' ' THR . 0.1 OUTLIER -82.55 -28.67 30.83 Favored 'General case' 0 C--N 1.364 1.218 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -177.827 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -67.67 -53.92 23.81 Favored 'General case' 0 C--O 1.204 -1.339 0 C-N-CA 127.746 2.418 . . . . 0.0 106.547 172.45 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -74.14 -39.77 63.06 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 119.969 3.322 . . . . 0.0 119.969 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 t -73.21 -41.94 63.21 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.531 -1.356 . . . . 0.0 113.858 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . 0.522 3.4 tt0 -77.86 -28.51 50.07 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 120.109 -1.62 . . . . 0.0 112.803 176.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.688 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -72.6 -27.81 62.4 Favored 'General case' 0 C--N 1.381 1.955 0 O-C-N 118.772 -2.455 . . . . 0.0 112.828 170.152 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.8 mtt85 -66.93 -36.84 83.14 Favored 'General case' 0 C--N 1.378 1.807 0 C-N-CA 125.612 1.565 . . . . 0.0 110.156 164.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -63.02 -43.02 99.89 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.444 HG22 HD12 ' A' ' 29' ' ' ILE . 8.0 mt -69.83 -45.34 77.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.396 0 CA-C-N 120.009 1.277 . . . . 0.0 111.859 173.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.526 13.2 p30 -69.12 -24.22 64.09 Favored 'General case' 0 C--N 1.379 1.883 0 O-C-N 119.842 -1.786 . . . . 0.0 115.335 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -73.84 -47.21 40.01 Favored 'General case' 0 C--N 1.378 1.839 0 C-N-CA 126.926 2.09 . . . . 0.0 110.044 169.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -30.9 70.94 Favored 'General case' 0 C--N 1.398 2.716 0 O-C-N 117.697 -3.127 . . . . 0.0 112.95 174.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.444 HD12 HG22 ' A' ' 25' ' ' ILE . 3.2 mt -63.3 -48.63 86.51 Favored 'Isoleucine or valine' 0 C--N 1.378 1.835 0 C-N-CA 124.675 1.19 . . . . 0.0 112.508 171.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.4 ttt85 -64.37 -37.87 89.03 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 122.34 2.336 . . . . 0.0 115.465 176.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -76.5 -38.16 55.66 Favored 'General case' 0 CA--C 1.473 -1.984 0 C-N-CA 127.157 2.183 . . . . 0.0 112.344 -177.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.56 -43.51 14.43 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.605 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.391 1.5 p -66.79 -30.73 71.01 Favored 'General case' 0 C--N 1.359 1.01 0 O-C-N 120.583 -1.323 . . . . 0.0 112.85 -179.377 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -72.04 -46.58 56.47 Favored 'General case' 0 C--N 1.375 1.68 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 162.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.72 -26.16 66.02 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 116.058 1.873 . . . . 0.0 116.058 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.57 -14.49 62.87 Favored 'General case' 0 C--N 1.376 1.738 0 C-N-CA 127.031 2.132 . . . . 0.0 112.489 166.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.41 17.63 30.81 Favored Glycine 0 C--N 1.377 2.826 0 O-C-N 121.317 -0.864 . . . . 0.0 113.291 169.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.673 HG23 HD22 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -115.82 164.1 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 -176.479 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.703 ' HB2' HD11 ' A' ' 81' ' ' LEU 0.308 0.3 OUTLIER -26.4 -57.52 0.08 Allowed 'General case' 0 C--N 1.361 1.105 1 C-N-CA 133.764 4.826 . . . . 0.0 119.429 -175.441 . . . . . . . . 5 4 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.8 t 103.47 122.19 0.01 OUTLIER 'General case' 0 C--N 1.352 0.686 1 C-N-CA 132.103 4.161 . . . . 0.0 107.263 -172.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -113.65 160.53 18.5 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-O 123.037 1.399 . . . . 0.0 112.558 -173.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -110.79 145.76 37.57 Favored 'General case' 0 C--N 1.352 0.681 0 C-N-CA 127.319 2.248 . . . . 0.0 109.481 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' ' 129' ' ' LEU . 15.8 tp -126.35 154.89 42.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 118.897 -2.377 . . . . 0.0 106.665 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -132.37 172.66 12.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 O-C-N 120.202 -1.561 . . . . 0.0 111.016 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.659 ' CD2' HD13 ' A' ' 50' ' ' LEU 0.269 4.3 m-30 -93.49 172.02 8.53 Favored 'General case' 0 CA--C 1.558 1.262 0 CA-C-O 123.125 1.44 . . . . 0.0 109.197 168.17 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.3 t -127.03 98.62 5.39 Favored 'General case' 0 C--N 1.349 0.551 0 N-CA-C 101.562 -3.495 . . . . 0.0 101.562 157.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.486 0.0 OUTLIER -61.58 -10.54 8.37 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 -177.217 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.05 -46.6 13.69 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.851 2.46 . . . . 0.0 111.001 171.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.634 HD13 ' N ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -60.36 -48.49 81.53 Favored 'General case' 0 C--N 1.373 1.625 0 C-N-CA 127.401 2.28 . . . . 0.0 110.153 170.601 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.659 HD13 ' CD2' ' A' ' 45' ' ' TYR 0.252 6.2 tt -64.25 -33.4 75.72 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 112.54 -2.118 . . . . 0.0 112.553 172.56 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -56.82 -30.09 63.4 Favored 'General case' 0 C--N 1.368 1.395 0 CA-C-N 121.033 1.742 . . . . 0.0 112.109 166.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -84.29 -45.14 13.14 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 162.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.24 75.18 Favored 'General case' 0 C--N 1.371 1.501 0 CA-C-N 123.05 2.659 . . . . 0.0 114.005 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.594 HG13 HD12 ' A' ' 14' ' ' LEU . 1.2 tt -48.51 -34.45 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 131.075 3.75 . . . . 0.0 116.658 177.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HA ' HG22 ' A' ' 58' ' ' ILE . 9.8 mt-30 -92.16 -9.44 42.41 Favored 'General case' 0 C--N 1.362 1.127 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 173.176 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -94.28 -47.22 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 127.213 2.205 . . . . 0.0 108.733 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.652 ' HG2' HD11 ' A' ' 136' ' ' ILE . 28.2 mt-10 -85.86 -3.27 58.87 Favored 'General case' 0 CA--C 1.492 -1.287 1 C-N-CA 132.003 4.121 . . . . 0.0 117.997 -176.822 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.447 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -17.82 -3.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.063 2 N-CA-C 125.71 5.448 . . . . 0.0 125.71 -177.738 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.446 ' N ' HD13 ' A' ' 58' ' ' ILE . 44.6 t0 142.86 37.91 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.5 1 C-N-CA 134.798 5.239 . . . . 0.0 105.15 -166.235 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.323 54.7 mm-40 -89.67 85.36 6.43 Favored 'General case' 0 CA--C 1.472 -2.032 0 C-N-CA 131.142 3.777 . . . . 0.0 105.933 175.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.419 ' HB ' ' CD2' ' A' ' 17' ' ' HIS 0.475 0.1 OUTLIER -79.7 -11.32 59.86 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 127.908 2.483 . . . . 0.0 114.086 176.021 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.655 ' HE2' HG21 ' A' ' 136' ' ' ILE 0.281 0.7 OUTLIER -61.83 -34.76 76.53 Favored 'General case' 0 N--CA 1.479 1.021 1 C-N-CA 133.896 4.878 . . . . 0.0 111.347 169.233 . . . . . . . . 5 4 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 111' ' ' LEU 0.303 0.5 OUTLIER -73.42 -49.76 34.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 C-N-CA 131.373 3.869 . . . . 0.0 106.993 -167.313 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.556 ' HA ' ' CD2' ' A' ' 67' ' ' PHE 0.257 30.7 m-85 -71.23 -29.82 65.59 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 130.928 3.691 . . . . 0.0 112.899 168.5 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.1 -41.74 94.65 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 122.018 2.19 . . . . 0.0 112.185 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.688 HD11 ' HD3' ' A' ' 151' ' ' LYS . 1.9 tm? -64.17 -40.31 95.85 Favored 'General case' 0 CA--C 1.578 2.024 0 C-N-CA 126.246 1.818 . . . . 0.0 112.113 167.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.556 ' CD2' ' HA ' ' A' ' 64' ' ' PHE . 2.2 m-85 -74.36 -17.53 60.81 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 117.925 -2.984 . . . . 0.0 113.351 174.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CD2' ' O ' ' A' ' 64' ' ' PHE 0.355 57.8 m-70 -85.83 -17.04 36.8 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 128.211 2.604 . . . . 0.0 109.671 172.952 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -75.25 -40.27 59.05 Favored 'General case' 0 C--N 1.371 1.513 0 CA-C-O 118.07 -0.967 . . . . 0.0 111.652 156.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 151' ' ' LYS . 1.6 mm -52.68 -46.24 49.69 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.787 0 C-N-CA 129.251 3.02 . . . . 0.0 114.617 172.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.6 pttp -50.66 -7.95 0.04 OUTLIER 'General case' 0 CA--C 1.491 -1.296 1 C-N-CA 132.591 4.356 . . . . 0.0 121.232 -160.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -106.62 -16.74 14.43 Favored 'General case' 0 N--CA 1.44 -0.975 0 O-C-N 119.932 -1.73 . . . . 0.0 107.854 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.842 ' CD2' ' HB ' ' A' ' 152' ' ' THR 0.286 1.0 OUTLIER -80.57 16.85 1.24 Allowed 'General case' 0 C--N 1.383 2.062 0 C-N-CA 128.229 2.611 . . . . 0.0 113.484 -178.497 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 78.6 t -40.2 -42.64 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.97 0 C-N-CA 129.658 3.183 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.64 -31.39 70.6 Favored 'General case' 0 C--N 1.364 1.217 0 C-N-CA 127.354 2.262 . . . . 0.0 116.205 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -76.25 -45.64 31.81 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 129.037 2.935 . . . . 0.0 113.139 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.363 4.9 p -66.3 -29.63 47.26 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.321 0 CA-C-O 126.562 3.077 . . . . 0.0 111.221 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.605 HD21 ' HB2' ' A' ' 33' ' ' SER . 5.5 m120 -73.77 -31.37 63.27 Favored 'General case' 0 C--N 1.354 0.762 0 O-C-N 118.622 -2.548 . . . . 0.0 115.353 169.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -67.08 -30.51 70.57 Favored 'General case' 0 C--N 1.37 1.469 0 CA-C-N 120.734 1.606 . . . . 0.0 110.697 168.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.28 -36.33 83.76 Favored 'General case' 0 CA--C 1.572 1.812 0 C-N-CA 125.029 1.332 . . . . 0.0 113.205 167.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.713 HD12 ' HA ' ' A' ' 126' ' ' ASP . 10.1 tt -75.37 -44.58 44.19 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 168.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.8 m -64.9 3.43 0.56 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 120.623 3.564 . . . . 0.0 120.623 -162.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.416 ' CE ' ' H ' ' A' ' 96' ' ' GLY . 5.8 ptm -68.33 166.77 22.32 Favored Pre-proline 0 CA--C 1.563 1.48 0 C-N-CA 127.586 2.355 . . . . 0.0 114.498 174.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -64.25 -178.35 0.62 Allowed 'Trans proline' 0 CA--C 1.564 1.977 1 C-N-CA 126.483 4.789 . . . . 0.0 111.933 167.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -60.1 134.26 55.1 Favored 'Trans proline' 0 C--N 1.382 2.309 1 CA-C-N 134.504 6.216 . . . . 0.0 113.868 -171.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.5 tpt180 -26.8 -55.37 0.21 Allowed Pre-proline 0 C--N 1.367 1.34 1 C-N-CA 131.877 4.071 . . . . 0.0 116.168 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 66.6 Cg_endo -72.76 162.61 40.73 Favored 'Trans proline' 0 N--CA 1.447 -1.216 1 C-N-CA 125.578 4.185 . . . . 0.0 122.322 172.595 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.269 0.5 OUTLIER -107.95 -45.51 3.96 Favored 'General case' 0 N--CA 1.47 0.53 1 CA-C-N 106.404 -4.907 . . . . 0.0 106.259 134.288 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.405 ' H ' ' HB2' ' A' ' 93' ' ' PHE . 2.3 mt -119.73 -22.33 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.0 1 C-N-CA 132.798 4.439 . . . . 0.0 114.126 -178.21 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.7 t70 75.44 -39.67 0.4 Allowed 'General case' 0 C--N 1.317 -0.822 1 C-N-CA 133.433 4.693 . . . . 0.0 112.657 -170.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -87.18 -22.48 25.27 Favored 'General case' 0 C--N 1.36 1.024 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -175.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -123.17 -4.14 8.46 Favored 'General case' 0 N--CA 1.436 -1.161 0 C-N-CA 125.066 1.346 . . . . 0.0 110.74 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.411 ' O ' ' HA ' ' A' ' 87' ' ' PRO . 14.4 m-85 -147.91 110.4 4.67 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 124.122 0.969 . . . . 0.0 113.497 -174.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.563 HG22 ' HB ' ' A' ' 97' ' ' VAL 0.385 31.5 mt -116.31 89.45 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.113 0 C-N-CA 130.018 3.327 . . . . 0.0 103.218 170.757 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -45.32 -56.15 5.22 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 121.101 3.741 . . . . 0.0 121.101 -167.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.416 ' H ' ' CE ' ' A' ' 83' ' ' MET . . . -102.42 33.77 6.28 Favored Glycine 0 C--N 1.347 1.175 0 C-N-CA 125.84 1.685 . . . . 0.0 110.463 172.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.563 ' HB ' HG22 ' A' ' 94' ' ' ILE 0.26 0.4 OUTLIER -113.69 142.27 26.81 Favored 'Isoleucine or valine' 0 C--N 1.365 1.246 0 CA-C-O 123.909 1.814 . . . . 0.0 109.788 174.928 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -64.44 22.95 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.687 1 C-N-CA 133.036 4.534 . . . . 0.0 116.906 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.419 13.8 p90 50.31 31.3 5.14 Favored 'General case' 0 C--N 1.356 0.887 1 C-N-CA 132.299 4.24 . . . . 0.0 118.742 175.621 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -112.06 168.04 8.24 Favored Pre-proline 0 N--CA 1.442 -0.864 0 C-N-CA 129.631 3.172 . . . . 0.0 106.252 176.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.71 152.13 47.28 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.063 3.175 . . . . 0.0 111.444 169.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.92 45.3 0.55 Allowed Glycine 0 C--N 1.358 1.778 0 C-N-CA 127.22 2.343 . . . . 0.0 118.15 -172.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -131.36 140.31 49.68 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 126.544 1.938 . . . . 0.0 108.877 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mp -122.56 150.63 42.34 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 127.7 2.4 . . . . 0.0 113.451 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -129.52 113.08 14.42 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 127.432 2.293 . . . . 0.0 105.397 -174.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.655 HG21 ' HG2' ' A' ' 153' ' ' GLN 0.283 1.2 pt -134.85 132.83 53.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -175.045 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . 0.255 0.4 OUTLIER -139.73 127.59 22.05 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 119.973 -1.704 . . . . 0.0 111.416 -175.211 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 171.41 169.62 0.09 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 101.431 -3.544 . . . . 0.0 101.431 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.581 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.97 -33.97 4.62 Favored Glycine 0 N--CA 1.491 2.328 0 O-C-N 120.038 -1.663 . . . . 0.0 112.855 -173.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 121.05 -13.47 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.17 1 C-N-CA 137.659 6.384 . . . . 0.0 108.004 -168.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.774 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.788 0.0 OUTLIER -83.12 135.19 34.91 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 119.752 3.241 . . . . 0.0 119.752 -179.036 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -91.87 100.78 13.39 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 104.872 -2.269 . . . . 0.0 104.872 171.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.546 HD11 ' CE1' ' A' ' 67' ' ' PHE 0.269 3.5 mm? -95.98 132.89 40.83 Favored 'General case' 0 CA--C 1.558 1.268 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 174.28 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -118.36 128.78 7.88 Favored Glycine 0 C--N 1.351 1.392 0 N-CA-C 105.131 -3.188 . . . . 0.0 105.131 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.554 ' CE1' HD11 ' A' ' 106' ' ' ILE 0.258 6.0 m-30 -125.92 151.33 47.1 Favored 'General case' 0 C--N 1.366 1.289 0 CA-C-N 122.465 3.133 . . . . 0.0 102.797 -179.437 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.8 m -151.02 131.67 13.96 Favored 'General case' 0 CA--C 1.481 -1.697 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 13.6 t -69.05 142.85 15.63 Favored 'Isoleucine or valine' 0 C--N 1.371 1.511 0 C-N-CA 128.871 2.869 . . . . 0.0 107.494 172.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.481 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.362 87.4 m -51.05 110.91 0.48 Allowed 'General case' 0 C--N 1.375 1.692 0 CA-C-O 125.317 2.484 . . . . 0.0 116.99 -177.443 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.04 -39.12 7.89 Favored Pre-proline 0 N--CA 1.442 -0.863 0 CA-C-O 115.45 -2.214 . . . . 0.0 114.072 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.95 52.37 4.23 Favored 'Trans proline' 0 CA--C 1.556 1.601 0 CA-C-N 127.049 3.553 . . . . 0.0 114.786 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.97 177.22 3.8 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -173.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.5 -67.25 0.84 Allowed 'General case' 0 C--N 1.371 1.526 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 156.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.43 ' HB3' ' HG3' ' A' ' 127' ' ' PRO 0.441 5.3 mptp? 50.39 -19.28 0.0 OUTLIER 'General case' 0 N--CA 1.424 -1.732 1 C-N-CA 138.666 6.786 . . . . 0.0 118.421 -178.668 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 107.34 -143.13 0.0 OUTLIER 'General case' 0 C--N 1.369 1.423 1 C-N-CA 132.754 4.422 . . . . 0.0 109.734 175.718 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.477 ' HB2' ' HG ' ' A' ' 81' ' ' LEU 0.495 0.0 OUTLIER -102.82 -54.37 2.65 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.58 1.552 . . . . 0.0 110.481 -177.057 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.713 ' HA ' HD12 ' A' ' 81' ' ' LEU 0.333 0.0 OUTLIER -26.73 -74.96 0.03 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 133.786 4.834 . . . . 0.0 117.858 166.145 . . . . . . . . 5 4 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.43 ' HG3' ' HB3' ' A' ' 123' ' ' LYS 0.659 0.0 OUTLIER 52.45 -177.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.384 2.406 1 N-CA-C 122.97 4.181 . . . . 0.0 122.97 145.328 . . . . . . . . 5 4 . 1 . 007 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 2.1 p -124.88 152.7 43.69 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.538 ' HB2' HD12 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -102.03 128.69 48.36 Favored 'General case' 0 C--N 1.359 1.021 1 N-CA-C 97.105 -5.146 . . . . 0.0 97.105 172.641 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 30.9 tt0 -80.6 1.81 28.25 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 128.048 2.539 . . . . 0.0 113.11 -154.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 21.8 p 163.49 146.08 0.01 OUTLIER 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 32.8 ttt85 -115.05 122.04 44.93 Favored 'General case' 0 N--CA 1.429 -1.484 1 N-CA-C 99.892 -4.114 . . . . 0.0 99.892 162.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 3.6 ttt -93.14 125.28 37.66 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 102.192 -3.262 . . . . 0.0 102.192 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.18 112.84 14.98 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.77 144.48 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.131 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.858 HD13 HD12 ' A' ' 141' ' ' LEU . 0.1 OUTLIER -140.89 175.84 5.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 115.629 1.715 . . . . 0.0 115.629 -170.482 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.726 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -158.94 71.76 0.54 Allowed 'General case' 0 C--N 1.367 1.354 1 C-N-CA 136.694 5.998 . . . . 0.0 108.105 172.546 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 7.5 t -67.7 -50.0 59.8 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-O 124.038 1.875 . . . . 0.0 110.085 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.445 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -168.27 -56.63 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 110.648 -2.978 . . . . 0.0 109.267 -175.059 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.493 ' HG3' HD22 ' A' ' 141' ' ' LEU . 8.6 ptp180 -109.21 14.98 23.53 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.183 2.593 . . . . 0.0 115.603 -173.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.858 HD12 HD13 ' A' ' 136' ' ' ILE . 0.1 OUTLIER -103.95 102.6 32.54 Favored Pre-proline 0 C--N 1.369 1.437 0 C-N-CA 128.01 2.524 . . . . 0.0 107.163 -163.593 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 141' ' ' LEU . 0.3 OUTLIER -68.3 49.71 0.48 Allowed 'Trans proline' 0 CA--C 1.541 0.872 1 C-N-CA 126.578 4.852 . . . . 0.0 121.181 -166.997 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -93.62 -121.07 3.16 Favored Glycine 0 C--N 1.313 -0.747 1 C-N-CA 131.619 4.438 . . . . 0.0 117.425 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -109.18 -178.27 3.52 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 127.039 2.136 . . . . 0.0 112.744 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -138.31 97.75 3.45 Favored 'General case' 0 C--N 1.357 0.921 0 O-C-N 120.275 -1.515 . . . . 0.0 106.966 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 22.5 t -179.85 -166.63 0.08 Allowed 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 -175.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 54.0 tttp 173.02 133.62 0.03 OUTLIER 'General case' 0 C--N 1.349 0.576 1 C-N-CA 132.8 4.44 . . . . 0.0 103.583 178.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -150.53 -80.3 0.12 Allowed 'General case' 0 C--N 1.359 0.984 0 N-CA-C 117.87 2.544 . . . . 0.0 117.87 -169.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . 0.311 29.1 m -90.32 -142.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.334 0 N-CA-C 118.833 2.901 . . . . 0.0 118.833 -172.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.74 HD13 ' H ' ' A' ' 152' ' ' THR . 0.0 OUTLIER -131.16 127.14 60.26 Favored 'Isoleucine or valine' 0 C--N 1.376 1.722 0 N-CA-C 121.25 3.796 . . . . 0.0 121.25 -178.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.688 ' HD3' HD11 ' A' ' 66' ' ' LEU 0.458 0.0 OUTLIER -123.15 101.51 7.44 Favored 'General case' 0 C--N 1.401 2.813 2 N-CA-C 126.64 5.792 . . . . 0.0 126.64 153.488 . . . . . . . . 5 4 . 1 . 007 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.842 ' HB ' ' CD2' ' A' ' 73' ' ' HIS 0.451 68.2 p -121.8 100.57 7.07 Favored 'General case' 0 CA--C 1.457 -2.621 2 O-C-N 115.382 -4.574 . . . . 0.0 105.764 152.316 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.655 ' HG2' HG21 ' A' ' 106' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.389 -3.5 0 N-CA-C 103.759 -2.682 . . . . 0.0 103.759 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.5 mtt . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 106.44 -1.689 . . . . 0.0 106.44 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.9 p -85.95 81.49 8.5 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.506 2.323 . . . . 0.0 113.757 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.4 mm -84.77 -57.03 4.73 Favored 'Isoleucine or valine' 0 C--N 1.367 1.337 0 N-CA-C 117.084 2.253 . . . . 0.0 117.084 -171.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.564 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 13.2 m-80 24.28 16.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 2 C-N-CA 137.666 6.386 . . . . 0.0 122.228 -178.047 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.2 p -91.25 -68.17 0.81 Allowed 'General case' 0 N--CA 1.466 0.34 1 C-N-CA 133.071 4.548 . . . . 0.0 112.702 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.64 -13.51 62.11 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 127.261 2.225 . . . . 0.0 111.858 176.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.564 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -82.19 -36.26 13.74 Favored 'Isoleucine or valine' 0 C--N 1.359 1.006 0 C-N-CA 129.814 3.246 . . . . 0.0 108.965 175.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -68.07 -42.67 80.1 Favored 'General case' 0 C--N 1.373 1.627 0 C-N-CA 128.553 2.741 . . . . 0.0 109.144 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.3 mt -61.64 -43.1 96.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.386 0 C-N-CA 126.945 2.098 . . . . 0.0 110.722 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.315 0.7 OUTLIER -62.88 -44.66 95.52 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 171.279 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -62.97 -30.38 71.54 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 166.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -76.65 -50.97 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 128.316 2.646 . . . . 0.0 111.794 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.659 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmtt -62.32 -29.71 70.64 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.518 2.727 . . . . 0.0 109.92 174.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.764 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.7 OUTLIER -66.64 -51.79 52.32 Favored 'General case' 0 C--N 1.369 1.442 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.789 164.475 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -54.62 -37.77 66.01 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 120.173 1.351 . . . . 0.0 112.63 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.659 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.28 0.9 OUTLIER -71.88 -41.64 67.75 Favored 'General case' 0 C--N 1.392 2.44 0 O-C-N 120.407 -1.433 . . . . 0.0 112.508 171.48 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -57.92 -44.64 86.99 Favored 'General case' 0 C--N 1.388 2.242 0 C-N-CA 129.116 2.966 . . . . 0.0 111.775 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.556 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -66.54 -55.28 16.25 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 128.773 2.829 . . . . 0.0 111.513 -178.793 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 22' ' ' PHE . 51.5 mt-10 -75.12 -32.98 61.53 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -73.68 -40.81 63.39 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 126.047 1.739 . . . . 0.0 113.513 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.504 ' HB3' ' CD2' ' A' ' 64' ' ' PHE . 0.8 OUTLIER -73.42 -28.78 62.17 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 125.666 1.586 . . . . 0.0 108.626 170.372 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.486 ' HB2' ' HA ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -57.24 -42.27 81.16 Favored 'General case' 0 C--N 1.377 1.774 0 C-N-CA 124.789 1.236 . . . . 0.0 113.901 165.545 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -59.56 -37.92 79.72 Favored 'General case' 0 C--N 1.377 1.803 0 C-N-CA 124.613 1.165 . . . . 0.0 111.612 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -58.3 -49.27 77.75 Favored 'General case' 0 C--N 1.372 1.581 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 21' ' ' GLU . 2.0 mt -66.32 -42.52 90.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 O-C-N 120.53 -1.356 . . . . 0.0 111.709 176.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -73.97 -27.08 60.81 Favored 'General case' 0 C--N 1.372 1.561 0 O-C-N 121.459 -0.776 . . . . 0.0 111.652 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -70.82 -35.98 72.73 Favored 'General case' 0 C--N 1.375 1.703 0 C-N-CA 126.084 1.754 . . . . 0.0 110.687 172.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.475 ' HG2' ' HG3' ' A' ' 71' ' ' LYS . 17.7 tp10 -69.83 -37.29 76.17 Favored 'General case' 0 C--N 1.383 2.058 0 O-C-N 120.722 -1.236 . . . . 0.0 113.538 170.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.468 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 5.2 mt -65.11 -50.29 75.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 C-N-CA 124.707 1.203 . . . . 0.0 113.322 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -63.01 -32.79 74.23 Favored 'General case' 0 C--N 1.361 1.101 0 CA-C-N 121.778 2.081 . . . . 0.0 114.429 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 21.5 pt-20 -77.33 -43.64 32.33 Favored 'General case' 0 C--N 1.376 1.748 0 O-C-N 118.521 -2.612 . . . . 0.0 111.699 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.12 -41.05 64.42 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 124.316 1.046 . . . . 0.0 113.643 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -71.42 -28.84 64.27 Favored 'General case' 0 C--N 1.352 0.705 0 C-N-CA 125.484 1.513 . . . . 0.0 111.448 175.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -77.92 -38.29 45.85 Favored 'General case' 0 C--N 1.387 2.234 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 166.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.86 62.48 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 126.838 2.055 . . . . 0.0 114.592 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.8 -10.04 59.1 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 124.531 1.133 . . . . 0.0 111.753 166.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.11 17.96 56.67 Favored Glycine 0 C--N 1.379 2.93 0 O-C-N 121.122 -0.986 . . . . 0.0 114.675 167.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.425 HG21 ' OD1' ' A' ' 78' ' ' ASN 0.504 0.6 OUTLIER -94.37 -179.46 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.74 0 C-N-CA 125.814 1.646 . . . . 0.0 114.169 -173.346 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -43.87 -50.43 7.98 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 130.645 3.578 . . . . 0.0 115.658 -177.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.313 1.5 t 90.51 125.82 0.03 OUTLIER 'General case' 0 C--N 1.36 1.039 1 C-N-CA 133.492 4.717 . . . . 0.0 110.489 -177.548 . . . . . . . . 3 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.468 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 3.5 p90 -112.6 154.0 26.69 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 124.701 1.2 . . . . 0.0 109.308 -174.003 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.79 162.93 23.23 Favored 'General case' 0 CA--C 1.494 -1.19 0 CA-C-O 122.868 1.318 . . . . 0.0 111.133 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.66 138.17 52.8 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 120.983 -1.073 . . . . 0.0 109.373 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -132.04 141.85 49.36 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 165.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.73 ' CE1' HD12 ' A' ' 50' ' ' LEU . 1.8 m-85 -101.11 153.8 19.27 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 123.395 1.569 . . . . 0.0 109.563 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 72.6 m -131.8 90.03 2.78 Favored 'General case' 0 CA--C 1.499 -0.993 1 N-CA-C 99.495 -4.261 . . . . 0.0 99.495 168.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -47.79 -9.59 0.02 OUTLIER 'General case' 0 C--O 1.191 -2.025 0 CA-C-O 112.764 -3.493 . . . . 0.0 119.781 -168.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.05 61.45 Favored 'General case' 0 N--CA 1.5 2.032 1 CA-C-N 129.487 5.585 . . . . 0.0 119.933 -176.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.741 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.12 -42.77 96.71 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 130.646 3.578 . . . . 0.0 111.622 172.402 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.912 HD23 HD11 ' A' ' 54' ' ' ILE . 1.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 129.381 3.072 . . . . 0.0 109.099 171.287 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 47' ' ' GLN . 98.7 m-20 -58.89 -33.96 71.1 Favored 'General case' 0 C--N 1.365 1.268 0 C-N-CA 130.856 3.663 . . . . 0.0 110.699 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -74.71 -33.11 62.34 Favored 'General case' 0 C--N 1.364 1.225 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 164.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.41 -33.21 58.83 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 119.096 -2.252 . . . . 0.0 116.504 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.912 HD11 HD23 ' A' ' 50' ' ' LEU . 54.2 mt -63.34 -44.4 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.626 1 C-N-CA 133.746 4.818 . . . . 0.0 111.38 175.506 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.427 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -108.2 -24.91 11.32 Favored 'General case' 0 C--N 1.366 1.288 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 173.385 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -83.58 -17.09 42.88 Favored 'General case' 0 C--N 1.363 1.179 0 CA-C-N 123.528 2.876 . . . . 0.0 114.292 -173.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 15.0 pm0 -131.98 -50.62 0.96 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.223 1.409 . . . . 0.0 110.788 175.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 54' ' ' ILE 0.456 0.1 OUTLIER 73.8 156.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 C-N-CA 125.62 1.568 . . . . 0.0 111.033 177.55 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.488 ' HA ' HD23 ' A' ' 14' ' ' LEU . 14.4 t70 30.69 50.11 0.09 Allowed 'General case' 0 N--CA 1.52 3.049 0 C-N-CA 131.123 3.769 . . . . 0.0 115.458 -178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' A' ' 57' ' ' GLU 0.446 60.7 mm-40 -86.26 79.61 9.01 Favored 'General case' 0 CA--C 1.485 -1.529 0 CA-C-O 126.949 3.262 . . . . 0.0 109.742 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.309 33.2 p -78.44 -15.56 58.52 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 128.742 2.817 . . . . 0.0 112.769 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.65 ' HE2' HG21 ' A' ' 136' ' ' ILE . 1.1 t80 -68.95 -34.25 75.03 Favored 'General case' 0 C--N 1.358 0.961 1 C-N-CA 131.82 4.048 . . . . 0.0 110.45 169.002 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.521 HG13 ' CZ ' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -64.86 -45.94 93.39 Favored 'Isoleucine or valine' 0 C--N 1.358 0.953 0 C-N-CA 130.901 3.68 . . . . 0.0 106.789 -178.698 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.504 ' CD2' ' HB3' ' A' ' 21' ' ' GLU 0.316 57.5 m-85 -62.57 -41.54 98.98 Favored 'General case' 0 C--O 1.21 -1.006 0 C-N-CA 130.322 3.449 . . . . 0.0 114.778 165.539 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -64.28 -43.04 96.02 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 123.898 3.044 . . . . 0.0 113.575 177.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.734 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.2 tm? -68.14 -41.62 81.33 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 125.064 1.346 . . . . 0.0 114.468 171.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.521 ' CZ ' HG13 ' A' ' 63' ' ' VAL 0.886 0.1 OUTLIER -77.76 -17.06 57.94 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 118.394 -2.691 . . . . 0.0 115.512 172.878 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -78.3 -18.98 54.52 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 127.845 2.458 . . . . 0.0 108.349 163.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -78.13 -33.17 50.57 Favored 'General case' 0 CA--C 1.567 1.611 0 O-C-N 119.978 -1.702 . . . . 0.0 112.085 159.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.0 -46.08 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.914 0 C-N-CA 128.155 2.582 . . . . 0.0 113.342 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.475 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 14.0 pttm -52.46 -16.92 1.0 Allowed 'General case' 0 CA--C 1.502 -0.898 0 C-N-CA 130.512 3.525 . . . . 0.0 118.272 -176.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.277 60.7 m-20 -101.24 -14.14 17.8 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.974 2.109 . . . . 0.0 109.718 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.97 11.93 16.85 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 129.823 3.249 . . . . 0.0 113.059 -171.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.544 ' HA ' HG13 ' A' ' 77' ' ' VAL . 99.5 t -37.89 -31.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.384 2.067 0 C-N-CA 129.103 2.961 . . . . 0.0 115.996 166.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.46 ' H ' HD22 ' A' ' 75' ' ' LEU . 0.4 OUTLIER -69.5 -38.09 77.47 Favored 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 130.388 3.475 . . . . 0.0 114.404 175.311 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -76.43 -33.04 58.8 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.581 1.952 . . . . 0.0 112.101 172.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.544 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.744 0.1 OUTLIER -71.51 -26.77 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.787 0 CA-C-O 126.786 3.184 . . . . 0.0 112.517 169.83 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.425 ' OD1' HG21 ' A' ' 38' ' ' VAL . 72.1 m-20 -70.44 -32.57 70.21 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 128.821 2.848 . . . . 0.0 111.997 163.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -63.72 -30.26 71.38 Favored 'General case' 0 C--N 1.377 1.784 0 C-N-CA 125.336 1.454 . . . . 0.0 112.372 161.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -41.29 98.03 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 124.944 1.298 . . . . 0.0 112.611 163.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 125' ' ' LYS . 0.9 OUTLIER -75.4 -13.68 60.41 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 127.628 2.371 . . . . 0.0 115.575 173.458 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 49.1 m -78.81 2.51 19.65 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 128.765 2.826 . . . . 0.0 114.43 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.831 ' CE ' HG23 ' A' ' 97' ' ' VAL . 14.1 tpt -73.62 131.48 82.2 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 131.279 3.832 . . . . 0.0 111.023 176.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.68 151.84 77.85 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 125.241 3.961 . . . . 0.0 112.557 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -47.34 139.5 16.55 Favored 'Trans proline' 0 C--N 1.361 1.215 1 C-N-CA 126.918 5.079 . . . . 0.0 118.845 -162.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.448 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 11.8 mmm180 -83.96 95.32 0.31 Allowed Pre-proline 0 CA--C 1.568 1.668 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 9.8 Cg_endo -113.3 165.76 0.04 OUTLIER 'Trans proline' 0 C--N 1.367 1.531 1 C-N-CA 127.659 5.573 . . . . 0.0 112.702 -164.916 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.89 -25.61 68.23 Favored 'General case' 0 C--N 1.368 1.392 0 C-N-CA 128.196 2.598 . . . . 0.0 114.323 170.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.496 HD12 ' HB2' ' A' ' 92' ' ' ASP 0.262 0.0 OUTLIER -89.67 157.43 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 1 C-N-CA 132.294 4.237 . . . . 0.0 111.498 171.839 . . . . . . . . 5 4 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -113.5 -41.7 3.6 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-N 110.156 -3.202 . . . . 0.0 110.127 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -82.61 -18.64 40.52 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 120.521 3.526 . . . . 0.0 120.521 -171.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.496 ' HB2' HD12 ' A' ' 89' ' ' ILE . 17.8 m-20 -104.04 -3.38 24.66 Favored 'General case' 0 CA--C 1.494 -1.189 0 O-C-N 121.572 -0.705 . . . . 0.0 111.875 -173.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -145.7 -58.51 0.32 Allowed 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -175.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.451 ' HB ' ' HB ' ' A' ' 97' ' ' VAL 0.318 2.5 pt -87.4 87.58 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 CA-C-O 127.784 3.659 . . . . 0.0 115.868 -170.387 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -97.03 -22.84 16.57 Favored 'General case' 0 N--CA 1.436 -1.154 2 CA-C-N 104.745 -5.661 . . . . 0.0 109.032 175.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -90.64 -6.84 67.4 Favored Glycine 0 C--N 1.367 2.259 0 C-N-CA 124.424 1.012 . . . . 0.0 111.509 174.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.831 HG23 ' CE ' ' A' ' 83' ' ' MET . 89.6 t -113.01 94.84 3.37 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 176.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -117.02 24.26 11.31 Favored 'General case' 0 N--CA 1.436 -1.147 0 C-N-CA 130.685 3.594 . . . . 0.0 108.816 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.6 t80 82.87 57.35 0.01 OUTLIER 'General case' 0 C--N 1.36 1.028 0 C-N-CA 130.03 3.332 . . . . 0.0 110.576 -175.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -111.08 109.54 57.01 Favored Pre-proline 0 C--N 1.357 0.921 0 C-N-CA 125.597 1.559 . . . . 0.0 109.297 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -63.63 152.8 78.69 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 125.3 4.0 . . . . 0.0 116.421 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.37 43.65 2.93 Favored Glycine 0 C--N 1.359 1.834 0 C-N-CA 126.163 1.84 . . . . 0.0 114.854 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -131.71 145.82 51.84 Favored 'General case' 0 CA--C 1.506 -0.719 0 O-C-N 119.35 -2.264 . . . . 0.0 110.141 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.8 tp -115.82 135.79 53.67 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.865 2.066 . . . . 0.0 109.886 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -129.4 110.69 12.11 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 103.367 -2.827 . . . . 0.0 103.367 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.486 HD11 ' CE1' ' A' ' 115' ' ' PHE . 21.6 pt -134.52 140.92 44.79 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 C-N-CA 124.776 1.231 . . . . 0.0 110.774 -173.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.574 HG21 ' HB3' ' A' ' 148' ' ' ALA . 23.3 m -127.48 130.58 49.46 Favored 'General case' 0 C--N 1.363 1.179 0 O-C-N 120.1 -1.625 . . . . 0.0 112.131 -176.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.445 ' HB3' ' HB ' ' A' ' 152' ' ' THR . 33.0 t0 -173.75 166.51 4.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.8 -3.037 . . . . 0.0 102.8 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.734 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.33 -38.51 3.2 Favored Glycine 0 C--N 1.351 1.411 0 CA-C-O 123.661 1.701 . . . . 0.0 111.072 172.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 108' ' ' ASP . 29.1 m-80 121.23 -8.85 0.0 OUTLIER 'General case' 0 N--CA 1.422 -1.849 1 C-N-CA 139.497 7.119 . . . . 0.0 108.453 -168.213 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.749 ' HA ' HG23 ' A' ' 136' ' ' ILE 0.641 0.0 OUTLIER -79.26 136.01 36.92 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 130.24 3.416 . . . . 0.0 116.596 177.245 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -97.21 100.48 11.95 Favored 'General case' 0 C--N 1.37 1.463 0 N-CA-C 100.26 -3.978 . . . . 0.0 100.26 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.428 HD22 ' HG ' ' A' ' 111' ' ' LEU . 1.3 pt? -119.25 123.06 43.36 Favored 'General case' 0 C--N 1.361 1.086 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -117.36 142.95 17.7 Favored Glycine 0 C--N 1.355 1.621 0 N-CA-C 106.596 -2.602 . . . . 0.0 106.596 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.486 ' CE1' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -131.85 142.22 49.64 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 176.091 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 31.4 m -125.05 129.63 50.65 Favored 'General case' 0 CA--C 1.485 -1.544 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 -173.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.0 144.05 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 127.147 2.179 . . . . 0.0 108.884 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.309 86.4 m -56.87 107.5 0.41 Allowed 'General case' 0 C--N 1.379 1.867 0 CA-C-N 120.9 1.682 . . . . 0.0 111.593 179.697 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.252 22.7 ttmm -68.81 -40.02 15.94 Favored Pre-proline 0 N--CA 1.444 -0.73 0 CA-C-O 116.057 -1.925 . . . . 0.0 115.28 -170.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.48 59.46 5.51 Favored 'Trans proline' 0 CA--C 1.56 1.778 0 CA-C-N 126.042 3.194 . . . . 0.0 113.071 171.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.258 18.8 p-10 163.71 124.24 0.01 OUTLIER 'General case' 0 C--N 1.367 1.359 0 C-N-CA 129.648 3.179 . . . . 0.0 111.47 178.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -146.46 67.15 1.18 Allowed 'General case' 0 N--CA 1.432 -1.341 0 O-C-N 117.331 -3.356 . . . . 0.0 111.241 168.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -105.42 11.99 32.03 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 126.339 1.855 . . . . 0.0 107.832 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -128.31 150.75 49.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.088 2.555 . . . . 0.0 113.354 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.515 ' HB2' HD22 ' A' ' 81' ' ' LEU 0.266 2.4 mppt? -101.82 -45.62 5.16 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.417 1.487 . . . . 0.0 111.183 178.348 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.3 85.25 6.77 Favored Pre-proline 0 C--N 1.367 1.346 0 C-N-CA 129.058 2.943 . . . . 0.0 108.018 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -81.49 -173.12 1.68 Allowed 'Trans proline' 0 CA--C 1.497 -1.342 1 C-N-CA 132.652 8.901 . . . . 0.0 114.106 -177.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.6 p -98.44 138.94 34.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 100.375 -3.935 . . . . 0.0 100.375 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.7 134.91 42.97 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 121.136 1.789 . . . . 0.0 106.629 -167.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' A' ' 118' ' ' CYS 0.252 1.1 pt20 -95.85 66.59 2.65 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 125.486 1.514 . . . . 0.0 109.538 -169.407 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.309 2.1 p 98.68 148.65 0.02 OUTLIER 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.409 1.884 . . . . 0.0 109.669 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -115.09 124.16 50.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 101.164 -3.643 . . . . 0.0 101.164 165.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.486 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . 4.3 ttp -102.95 108.25 19.36 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -121.72 115.16 22.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.605 1.162 . . . . 0.0 108.439 -175.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.7 mm -139.1 136.38 42.16 Favored 'Isoleucine or valine' 0 C--N 1.363 1.186 0 N-CA-C 105.658 -1.979 . . . . 0.0 105.658 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -133.65 -179.39 3.31 Favored 'Isoleucine or valine' 0 C--N 1.351 0.651 0 C-N-CA 127.196 2.198 . . . . 0.0 112.822 -172.706 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.647 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.0 OUTLIER -135.53 149.52 49.49 Favored 'General case' 0 CA--C 1.557 1.224 1 C-N-CA 135.418 5.487 . . . . 0.0 106.972 167.199 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.436 ' HB2' HD23 ' A' ' 141' ' ' LEU . 51.4 m -164.67 -103.54 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.65 ' CD ' ' HG2' ' A' ' 140' ' ' ARG 0.258 0.0 OUTLIER -118.15 -66.69 1.05 Allowed 'General case' 0 C--N 1.355 0.815 0 C-N-CA 129.671 3.188 . . . . 0.0 113.608 -160.264 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.65 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 12.2 ptp180 -105.66 2.14 27.85 Favored 'General case' 0 CA--C 1.497 -1.079 1 C-N-CA 133.684 4.794 . . . . 0.0 108.659 174.617 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.556 HD13 ' HD2' ' A' ' 142' ' ' PRO . 0.2 OUTLIER -82.61 142.48 46.04 Favored Pre-proline 0 CA--C 1.574 1.895 0 CA-C-O 114.514 -2.66 . . . . 0.0 106.387 -152.463 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.556 ' HD2' HD13 ' A' ' 141' ' ' LEU . 17.2 Cg_exo -45.15 -50.41 8.91 Favored 'Trans proline' 0 N--CA 1.48 0.702 2 C-N-CA 127.051 5.167 . . . . 0.0 125.441 -167.569 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -126.67 -165.51 11.98 Favored Glycine 0 CA--C 1.492 -1.376 0 C-N-CA 126.281 1.896 . . . . 0.0 111.883 -177.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -152.11 136.69 16.92 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 127.926 2.49 . . . . 0.0 111.842 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 163.07 120.86 0.0 OUTLIER 'General case' 0 C--N 1.36 1.047 0 C-N-CA 129.725 3.21 . . . . 0.0 111.902 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 75.6 m -141.86 119.66 11.88 Favored 'General case' 0 C--N 1.368 1.386 0 O-C-N 120.258 -1.526 . . . . 0.0 108.624 174.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -162.97 83.51 0.5 Allowed 'General case' 0 CA--C 1.498 -1.044 0 C-N-CA 125.338 1.455 . . . . 0.0 111.959 178.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.574 ' HB3' HG21 ' A' ' 107' ' ' THR . . . 164.32 144.89 0.01 OUTLIER 'General case' 0 C--N 1.373 1.596 0 C-N-CA 128.042 2.537 . . . . 0.0 104.925 -176.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -148.88 108.21 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.259 0 CA-C-N 121.756 2.071 . . . . 0.0 112.649 -178.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.752 HD11 ' H ' ' A' ' 153' ' ' GLN . 0.4 OUTLIER -129.3 146.59 33.98 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 131.173 3.789 . . . . 0.0 104.946 173.292 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.354 21.3 mttp -93.42 137.13 33.03 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 123.717 2.962 . . . . 0.0 104.382 153.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.445 ' HB ' ' HB3' ' A' ' 108' ' ' ASP 0.355 1.0 OUTLIER -79.17 116.1 19.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 120.033 3.346 . . . . 0.0 120.033 -140.332 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.752 ' H ' HD11 ' A' ' 150' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.433 2 C-N-CA 135.765 5.626 . . . . 0.0 122.93 -173.79 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm . . . . . 0 N--CA 1.452 -0.354 0 N-CA-C 104.78 -2.304 . . . . 0.0 104.78 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 77.7 p -89.46 148.19 23.58 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 128.019 2.528 . . . . 0.0 115.819 -173.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.6 mt -112.34 50.0 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.042 0 C-N-CA 127.7 2.4 . . . . 0.0 110.248 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.521 ' HA ' HG13 ' A' ' 7' ' ' VAL . 5.3 m120 -47.26 -4.29 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 1 C-N-CA 132.031 4.132 . . . . 0.0 120.26 -175.632 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -58.37 4.31 Favored 'General case' 0 C--O 1.24 0.589 1 C-N-CA 133.172 4.589 . . . . 0.0 111.048 173.004 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -73.55 -13.62 61.06 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.096 1.759 . . . . 0.0 113.07 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.521 HG13 ' HA ' ' A' ' 4' ' ' ASN . 0.7 OUTLIER -84.88 -31.61 7.19 Favored 'Isoleucine or valine' 0 C--N 1.358 0.946 0 C-N-CA 127.808 2.443 . . . . 0.0 110.214 176.605 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.3 -38.39 71.76 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 127.567 2.347 . . . . 0.0 108.413 174.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -61.07 -44.65 98.69 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.887 164.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 1.2 mmp_? -61.4 -47.46 85.7 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 120.951 1.705 . . . . 0.0 113.916 171.439 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -56.83 -27.29 59.94 Favored 'General case' 0 C--N 1.376 1.736 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 164.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -76.77 -50.68 12.96 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 119.486 -2.009 . . . . 0.0 111.877 171.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -56.83 -28.4 61.5 Favored 'General case' 0 C--N 1.376 1.721 0 C-N-CA 126.828 2.051 . . . . 0.0 112.754 171.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.452 ' O ' HD22 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -73.62 -46.56 46.13 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 113.755 -1.566 . . . . 0.0 111.621 170.256 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.434 4.2 ptp180 -58.22 -36.28 72.92 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.16 -1.587 . . . . 0.0 114.586 173.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.9 mtt180 -64.19 -41.96 96.87 Favored 'General case' 0 C--N 1.384 2.069 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 162.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.502 ' CD2' HG22 ' A' ' 61' ' ' THR 0.251 3.0 t60 -62.22 -47.97 82.08 Favored 'General case' 0 C--N 1.383 2.024 0 C-N-CA 127.941 2.496 . . . . 0.0 114.392 174.473 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -59.06 -53.77 54.62 Favored 'General case' 0 C--N 1.369 1.449 1 C-N-CA 132.883 4.473 . . . . 0.0 108.8 177.885 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -70.65 -46.64 62.9 Favored 'General case' 0 C--N 1.37 1.48 0 N-CA-C 118.556 2.799 . . . . 0.0 118.556 173.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m -66.29 -38.58 88.11 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 119.597 -1.94 . . . . 0.0 114.053 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.541 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.327 4.6 mp0 -77.11 -29.15 54.68 Favored 'General case' 0 C--N 1.362 1.113 0 O-C-N 120.708 -1.245 . . . . 0.0 111.013 172.207 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.3 -36.81 83.27 Favored 'General case' 0 C--N 1.387 2.202 0 O-C-N 120.178 -1.576 . . . . 0.0 114.137 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -68.09 -34.91 77.29 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 124.745 1.218 . . . . 0.0 110.47 169.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -63.49 -45.75 89.26 Favored 'General case' 0 C--N 1.364 1.223 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 169.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.51 HG21 HH22 ' A' ' 132' ' ' ARG . 2.1 mt -71.3 -45.48 69.87 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 O-C-N 119.277 -2.14 . . . . 0.0 111.795 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.539 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.336 48.8 m-20 -75.03 -23.75 58.22 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 120.87 -1.144 . . . . 0.0 112.391 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -75.84 -38.46 58.02 Favored 'General case' 0 C--N 1.382 2.012 0 CA-C-O 116.768 -1.587 . . . . 0.0 110.561 165.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.491 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 16.4 tp10 -65.97 -35.68 81.25 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-N 122.965 2.621 . . . . 0.0 115.793 172.004 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.542 HD13 ' CE2' ' A' ' 41' ' ' PHE 0.38 0.7 OUTLIER -73.06 -39.68 57.63 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 115.135 1.532 . . . . 0.0 115.135 174.625 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -74.4 -31.81 62.47 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 171.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.491 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 8.6 pt-20 -77.38 -38.06 50.76 Favored 'General case' 0 C--N 1.374 1.637 0 O-C-N 118.282 -2.762 . . . . 0.0 110.81 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.58 ' HB3' HG21 ' A' ' 74' ' ' VAL . . . -77.27 -36.5 54.31 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.428 1.091 . . . . 0.0 111.899 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.1 t -68.28 -35.45 77.88 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 121.213 -0.929 . . . . 0.0 110.346 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.05 -39.42 69.07 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.83 -28.38 61.58 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 126.48 1.912 . . . . 0.0 115.375 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.95 -15.58 58.11 Favored 'General case' 0 C--N 1.385 2.141 0 C-N-CA 124.75 1.22 . . . . 0.0 110.943 171.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 17.53 59.34 Favored Glycine 0 C--N 1.376 2.779 0 N-CA-C 114.994 0.757 . . . . 0.0 114.994 166.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.505 HG21 ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -109.82 151.76 12.01 Favored 'Isoleucine or valine' 0 C--N 1.36 1.023 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 178.557 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.453 ' HB2' ' CD1' ' A' ' 81' ' ' LEU 0.52 7.7 m -20.74 -47.72 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.743 2 N-CA-C 125.715 5.45 . . . . 0.0 125.715 -167.267 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.343 93.7 p 87.35 137.59 0.04 OUTLIER 'General case' 0 CA--C 1.501 -0.919 1 C-N-CA 131.758 4.023 . . . . 0.0 109.543 -178.502 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.542 ' CE2' HD13 ' A' ' 29' ' ' ILE . 9.7 p90 -112.51 140.53 47.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 -175.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.423 ' O ' ' HA ' ' A' ' 128' ' ' SER . 71.1 m80 -101.96 104.61 15.31 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -175.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.401 HD13 HD12 ' A' ' 129' ' ' LEU 0.294 0.3 OUTLIER -105.68 161.18 14.61 Favored 'General case' 0 CA--C 1.504 -0.791 0 O-C-N 116.863 -3.648 . . . . 0.0 115.451 -175.529 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -135.75 153.37 51.58 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.416 3.0 p90 -108.36 135.36 49.78 Favored 'General case' 0 C--N 1.36 1.03 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 167.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.449 ' O ' HD21 ' A' ' 49' ' ' LEU . 15.9 m -106.35 133.41 51.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 174.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -80.82 -10.76 59.69 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 121.717 3.969 . . . . 0.0 121.717 -170.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.47 -48.03 74.05 Favored 'General case' 0 N--CA 1.495 1.778 1 CA-C-N 126.582 4.265 . . . . 0.0 117.054 -175.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.83 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.47 -34.81 78.58 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-O 128.031 3.777 . . . . 0.0 113.804 174.954 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.83 ' H ' HD22 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -72.84 -44.87 60.88 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 109.729 -3.396 . . . . 0.0 108.887 171.378 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.463 ' HA ' ' CG2' ' A' ' 54' ' ' ILE . 19.6 t70 -55.77 -30.03 60.6 Favored 'General case' 0 C--N 1.37 1.467 0 C-N-CA 127.818 2.447 . . . . 0.0 109.665 -179.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.4 ttm-85 -68.16 -55.96 10.48 Favored 'General case' 0 C--N 1.375 1.714 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 157.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.35 71.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 120.603 3.557 . . . . 0.0 120.603 -177.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.724 HD12 HD21 ' A' ' 50' ' ' LEU . 5.4 tt -75.36 -39.65 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 1 C-N-CA 131.962 4.105 . . . . 0.0 110.619 178.635 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.569 ' HG2' HG23 ' A' ' 54' ' ' ILE . 19.3 mm-40 -107.82 -22.43 12.46 Favored 'General case' 0 C--N 1.373 1.617 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -86.5 10.11 16.28 Favored 'General case' 0 C--N 1.377 1.768 0 CA-C-N 122.597 2.453 . . . . 0.0 113.82 -172.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -155.13 -52.85 0.09 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 125.794 1.638 . . . . 0.0 108.88 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.403 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.507 0.0 OUTLIER 75.85 160.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.373 1.629 0 C-N-CA 126.565 1.946 . . . . 0.0 110.125 -179.727 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.451 ' N ' ' HG ' ' A' ' 14' ' ' LEU . 20.8 t70 34.87 45.63 0.16 Allowed 'General case' 0 N--CA 1.512 2.629 1 C-N-CA 131.821 4.048 . . . . 0.0 113.045 -175.244 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.43 ' O ' HG12 ' A' ' 63' ' ' VAL 0.622 0.0 OUTLIER -83.38 68.64 9.79 Favored 'General case' 0 C--O 1.206 -1.201 0 C-N-CA 128.018 2.527 . . . . 0.0 109.971 -178.233 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.502 HG22 ' CD2' ' A' ' 17' ' ' HIS 0.292 23.4 p -79.51 -18.19 52.44 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 130.354 3.461 . . . . 0.0 112.896 177.785 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -65.26 -33.72 76.66 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 131.467 3.907 . . . . 0.0 111.009 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.594 HG23 HD21 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -60.07 -47.43 91.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.24 0 C-N-CA 130.712 3.605 . . . . 0.0 108.351 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.541 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.297 29.2 m-85 -64.61 -40.63 95.84 Favored 'General case' 0 CA--C 1.494 -1.174 1 C-N-CA 134.569 5.148 . . . . 0.0 113.628 171.585 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -65.35 -45.26 84.9 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.565 2.346 . . . . 0.0 114.414 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.562 HD12 HD21 ' A' ' 113' ' ' LEU . 3.2 tm? -66.57 -51.04 60.83 Favored 'General case' 0 CA--C 1.567 1.617 0 C-N-CA 124.888 1.275 . . . . 0.0 112.166 171.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.749 0.0 OUTLIER -72.08 -14.71 61.92 Favored 'General case' 0 C--N 1.379 1.864 1 O-C-N 116.155 -4.091 . . . . 0.0 112.417 177.476 . . . . . . . . 5 4 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -75.82 -27.6 57.97 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 129.124 2.969 . . . . 0.0 111.136 165.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.336 43.6 mmtm -69.1 -27.02 65.23 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.269 -1.52 . . . . 0.0 109.836 159.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 153' ' ' GLN 0.495 5.5 mt -70.39 -9.08 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 N-CA-C 119.296 3.072 . . . . 0.0 119.296 166.544 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.445 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 16.3 pttm -75.21 -13.38 60.44 Favored 'General case' 0 CA--C 1.512 -0.517 1 O-C-N 116.027 -4.171 . . . . 0.0 114.054 177.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.381 70.4 m-20 -92.84 -27.31 17.22 Favored 'General case' 0 N--CA 1.432 -1.369 0 C-N-CA 129.422 3.089 . . . . 0.0 112.694 -178.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.457 ' CD2' HG12 ' A' ' 70' ' ' ILE . 3.6 t-80 -70.93 -1.09 10.76 Favored 'General case' 0 CA--C 1.493 -1.228 1 C-N-CA 135.012 5.325 . . . . 0.0 115.544 -170.773 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.58 HG21 ' HB3' ' A' ' 32' ' ' ALA . 55.0 t -27.33 -45.25 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.361 1.075 1 C-N-CA 132.104 4.162 . . . . 0.0 117.502 169.424 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.13 -31.39 62.73 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.458 2.303 . . . . 0.0 112.753 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -75.38 -43.26 51.16 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 126.415 1.886 . . . . 0.0 111.926 176.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.306 8.6 p -70.15 -31.2 46.59 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 C-N-CA 126.709 2.004 . . . . 0.0 110.804 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.505 ' HB3' HG21 ' A' ' 38' ' ' VAL . 49.0 m-20 -71.9 -30.65 65.6 Favored 'General case' 0 C--N 1.357 0.93 0 O-C-N 119.293 -2.13 . . . . 0.0 115.373 169.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -68.89 -34.62 75.72 Favored 'General case' 0 C--N 1.37 1.484 0 O-C-N 118.08 -2.887 . . . . 0.0 109.551 165.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.49 9.6 t80 -73.53 -4.39 33.61 Favored 'General case' 0 C--N 1.367 1.338 1 C-N-CA 131.779 4.032 . . . . 0.0 115.678 171.634 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.628 HD13 ' HB3' ' A' ' 125' ' ' LYS . 2.1 mt -40.65 -44.02 2.05 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 130.867 3.667 . . . . 0.0 113.152 -172.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.582 ' O ' HG11 ' A' ' 117' ' ' VAL 0.322 1.1 t -112.38 -43.25 3.54 Favored 'General case' 0 C--N 1.381 1.952 0 CA-C-N 123.755 2.979 . . . . 0.0 115.854 151.3 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.54 ' HE3' HG23 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -129.73 166.73 23.92 Favored Pre-proline 0 C--N 1.359 0.985 0 N-CA-C 100.949 -3.723 . . . . 0.0 100.949 166.765 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -60.84 119.5 6.71 Favored 'Trans proline' 0 CA--C 1.565 2.05 0 CA-C-N 126.909 3.503 . . . . 0.0 109.618 162.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.529 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 87.0 Cg_exo 39.29 135.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.29 1 C-N-CA 129.896 7.064 . . . . 0.0 121.871 -154.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.408 ' HD2' ' HB3' ' A' ' 85' ' ' PRO 0.444 0.0 OUTLIER -6.03 6.07 0.0 OUTLIER Pre-proline 0 CA--C 1.595 2.683 3 N-CA-C 139.969 10.729 . . . . 0.0 139.969 167.497 . . . . . . . . 5 4 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.529 ' HD3' ' O ' ' A' ' 85' ' ' PRO . 19.1 Cg_endo -131.5 160.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.894 2 CA-C-N 137.453 7.269 . . . . 0.0 116.448 -134.589 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.33 -13.33 15.7 Favored 'General case' 0 C--N 1.365 1.269 0 CA-C-O 124.735 2.207 . . . . 0.0 110.114 177.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -122.64 113.68 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 C-N-CA 130.082 3.353 . . . . 0.0 107.785 -176.096 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -94.56 -1.94 52.44 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 127.679 2.392 . . . . 0.0 110.133 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -100.02 -18.41 17.04 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 126.119 1.768 . . . . 0.0 112.853 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -127.89 -21.05 3.75 Favored 'General case' 0 CA--C 1.495 -1.144 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 -171.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -131.39 2.44 4.2 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 119.309 3.077 . . . . 0.0 119.309 -168.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.71 HD12 ' HB ' ' A' ' 97' ' ' VAL . 36.7 pt -88.45 138.57 18.89 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -178.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -143.25 -25.65 0.59 Allowed 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 112.235 -2.257 . . . . 0.0 111.541 -176.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.22 -2.28 60.67 Favored Glycine 0 C--N 1.354 1.561 0 C-N-CA 124.235 0.921 . . . . 0.0 111.166 175.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.71 ' HB ' HD12 ' A' ' 94' ' ' ILE . 97.2 t -95.53 114.61 32.56 Favored 'Isoleucine or valine' 0 C--N 1.368 1.388 0 CA-C-O 124.184 1.945 . . . . 0.0 112.726 -178.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -92.76 19.35 7.64 Favored 'General case' 0 CA--C 1.542 0.654 1 C-N-CA 132.504 4.322 . . . . 0.0 114.74 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 60.61 35.37 19.97 Favored 'General case' 0 N--CA 1.473 0.68 1 C-N-CA 131.767 4.027 . . . . 0.0 116.018 -177.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -113.05 168.02 8.34 Favored Pre-proline 0 C--N 1.355 0.833 0 C-N-CA 129.859 3.264 . . . . 0.0 110.328 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -60.13 174.58 1.34 Allowed 'Trans proline' 0 C--N 1.359 1.099 1 C-N-CA 126.469 4.78 . . . . 0.0 117.583 173.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.32 20.95 6.45 Favored Glycine 0 C--N 1.356 1.644 0 C-N-CA 127.114 2.292 . . . . 0.0 117.154 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.573 ' HE ' ' HG2' ' A' ' 120' ' ' PRO . 93.6 mtt180 -132.95 144.05 49.87 Favored 'General case' 0 C--N 1.351 0.668 0 N-CA-C 100.336 -3.95 . . . . 0.0 100.336 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.5 pp -120.79 147.94 44.67 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.201 -0.937 . . . . 0.0 112.333 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.422 ' HA ' ' HA2' ' A' ' 114' ' ' GLY . 41.2 tt0 -130.24 120.64 24.77 Favored 'General case' 0 C--N 1.368 1.397 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 178.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 6.3 pt -134.64 138.23 49.85 Favored 'Isoleucine or valine' 0 C--N 1.35 0.604 0 C-N-CA 125.089 1.355 . . . . 0.0 109.723 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.627 HG22 ' HB3' ' A' ' 148' ' ' ALA . 5.4 t -118.62 129.22 55.2 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 -178.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.403 ' HB2' HG13 ' A' ' 150' ' ' ILE . 6.4 t0 -154.5 -174.74 5.09 Favored 'General case' 0 C--N 1.367 1.346 0 N-CA-C 102.253 -3.24 . . . . 0.0 102.253 174.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.0 -66.65 3.9 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 119.23 -2.169 . . . . 0.0 113.547 173.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 159.64 -31.4 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.066 1 C-N-CA 139.902 7.281 . . . . 0.0 104.209 -163.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.833 ' HG ' HG23 ' A' ' 136' ' ' ILE . 4.5 mp -78.53 137.23 37.81 Favored 'General case' 0 C--N 1.368 1.393 1 C-N-CA 133.845 4.858 . . . . 0.0 121.064 -171.129 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -94.2 103.34 15.38 Favored 'General case' 0 C--N 1.375 1.676 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 164.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.562 HD21 HD12 ' A' ' 66' ' ' LEU . 3.1 mm? -100.12 133.51 44.41 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 105' ' ' GLU . . . -110.21 141.52 16.28 Favored Glycine 0 C--N 1.343 0.937 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 173.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -129.16 133.91 47.8 Favored 'General case' 0 C--N 1.353 0.755 1 N-CA-C 99.403 -4.295 . . . . 0.0 99.403 179.041 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 42.1 p -134.37 137.65 44.28 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 -171.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.582 HG11 ' O ' ' A' ' 82' ' ' SER 0.27 1.6 p -92.02 151.72 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 C-N-CA 125.39 1.476 . . . . 0.0 112.602 179.526 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 15.5 p -58.73 97.94 0.03 OUTLIER 'General case' 0 C--N 1.39 2.348 0 C-N-CA 128.063 2.545 . . . . 0.0 113.583 -177.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.597 17.8 ptpt 46.52 86.66 0.13 Allowed Pre-proline 0 C--N 1.351 0.651 0 C-N-CA 129.1 2.96 . . . . 0.0 115.501 -165.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.573 ' HG2' ' HE ' ' A' ' 103' ' ' ARG . 4.9 Cg_exo -45.33 108.87 0.15 Allowed 'Trans proline' 0 C--N 1.364 1.368 1 C-N-CA 125.914 4.409 . . . . 0.0 118.863 -159.625 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 38.3 p-10 -157.95 149.76 21.82 Favored 'General case' 0 C--N 1.364 1.216 0 C-N-CA 130.056 3.342 . . . . 0.0 109.268 -169.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -146.52 100.47 3.35 Favored 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 123.181 1.467 . . . . 0.0 110.11 166.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -108.1 -7.39 16.09 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.554 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.437 17.4 m-85 -157.0 176.01 13.33 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -164.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.628 ' HB3' HD13 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -138.28 104.99 5.34 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 103.641 -2.725 . . . . 0.0 103.641 177.841 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.9 t70 160.28 -25.89 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.542 0 C-N-CA 129.567 3.147 . . . . 0.0 115.94 -167.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.343 76.1 Cg_exo -53.12 -178.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.385 2.474 1 C-N-CA 127.638 5.559 . . . . 0.0 119.131 -179.195 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' SER . . . . . 0.423 ' HA ' ' O ' ' A' ' 42' ' ' HIS . 30.2 t -103.29 152.37 21.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.335 2.254 . . . . 0.0 109.392 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.401 HD12 HD13 ' A' ' 43' ' ' LEU . 20.2 mt -102.34 130.85 49.19 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 177.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -89.53 38.55 0.91 Allowed 'General case' 0 C--N 1.383 2.042 0 C-N-CA 128.427 2.691 . . . . 0.0 111.26 -163.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 19.5 t 98.66 143.93 0.02 OUTLIER 'General case' 0 C--N 1.371 1.521 0 C-N-CA 125.754 1.622 . . . . 0.0 106.929 -168.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.51 HH22 HG21 ' A' ' 25' ' ' ILE . 38.1 mtm180 -107.18 122.37 46.39 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 100.452 -3.907 . . . . 0.0 100.452 168.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.444 ' SD ' ' HB2' ' A' ' 49' ' ' LEU . 1.6 tmm? -93.02 118.67 31.45 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 104.313 -2.477 . . . . 0.0 104.313 -174.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -124.67 114.96 20.01 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . 0.267 80.4 mt -140.08 148.59 22.53 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.833 HG23 ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -133.96 -178.76 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 124.877 2.275 . . . . 0.0 110.461 -169.129 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.686 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.3 OUTLIER -157.28 138.67 13.79 Favored 'General case' 0 N--CA 1.441 -0.89 1 C-N-CA 134.268 5.027 . . . . 0.0 102.02 176.416 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.527 ' HB2' ' HG ' ' A' ' 141' ' ' LEU . 0.9 OUTLIER -164.91 -115.07 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 120.137 3.384 . . . . 0.0 120.137 -168.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.635 ' CD ' ' HG2' ' A' ' 140' ' ' ARG 0.25 0.0 OUTLIER -103.44 -69.48 0.8 Allowed 'General case' 0 C--N 1.354 0.763 1 C-N-CA 133.515 4.726 . . . . 0.0 114.594 -159.482 . . . . . . . . 5 4 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.635 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 12.5 ptp180 -111.55 9.92 21.22 Favored 'General case' 0 N--CA 1.446 -0.647 1 C-N-CA 133.05 4.54 . . . . 0.0 107.25 173.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.623 HD23 ' CD ' ' A' ' 139' ' ' ARG . 0.3 OUTLIER -84.53 163.69 46.01 Favored Pre-proline 0 CA--C 1.574 1.868 0 CA-C-O 115.658 -2.115 . . . . 0.0 106.878 -156.72 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.514 ' HD2' HD13 ' A' ' 141' ' ' LEU . 55.3 Cg_exo -54.43 -29.66 60.0 Favored 'Trans proline' 0 N--CA 1.48 0.698 3 N-CA-C 123.644 4.44 . . . . 0.0 123.644 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -161.98 -165.66 19.31 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 127.893 2.663 . . . . 0.0 110.939 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 0.505 ' HA ' ' HB2' ' A' ' 137' ' ' ASN . 35.7 ttmt -135.45 139.55 44.17 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 131.098 3.759 . . . . 0.0 110.956 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -179.57 178.6 0.65 Allowed 'General case' 0 C--N 1.367 1.355 0 C-N-CA 126.44 1.896 . . . . 0.0 110.483 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . 0.352 2.1 p 158.45 107.9 0.0 OUTLIER 'General case' 0 C--N 1.367 1.331 0 C-N-CA 130.512 3.525 . . . . 0.0 111.168 173.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -168.77 89.12 0.22 Allowed 'General case' 0 C--N 1.361 1.091 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.627 ' HB3' HG22 ' A' ' 107' ' ' THR . . . -177.55 170.63 2.02 Favored 'General case' 0 C--N 1.364 1.201 0 N-CA-C 100.468 -3.901 . . . . 0.0 100.468 -177.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 30.0 m -117.63 150.62 19.69 Favored 'Isoleucine or valine' 0 C--N 1.375 1.7 0 CA-C-N 123.079 2.672 . . . . 0.0 116.425 -174.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.564 HD12 ' O ' ' A' ' 151' ' ' LYS 0.424 0.1 OUTLIER -130.82 147.01 33.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 1 N-CA-C 125.988 5.551 . . . . 0.0 125.988 -160.316 . . . . . . . . 5 4 . 1 . 009 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.564 ' O ' HD12 ' A' ' 150' ' ' ILE 0.324 0.0 OUTLIER -78.92 149.04 32.48 Favored 'General case' 0 CA--C 1.496 -1.116 1 C-N-CA 140.861 7.664 . . . . 0.0 101.059 159.66 . . . . . . . . 5 4 . 1 . 009 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.608 ' O ' HG23 ' A' ' 152' ' ' THR . 11.7 t -79.35 97.21 6.23 Favored 'General case' 0 CA--C 1.566 1.561 1 CA-C-O 129.689 4.566 . . . . 0.0 111.108 168.76 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.563 ' HB2' HD11 ' A' ' 70' ' ' ILE . 10.5 tt0 . . . . . 1 N--CA 1.37 -4.46 2 C-N-CA 138.226 6.611 . . . . 0.0 106.838 173.063 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.1 tpp . . . . . 0 C--O 1.233 0.214 0 N-CA-C 107.427 -1.324 . . . . 0.0 107.427 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 53.9 p -120.77 116.59 25.53 Favored 'General case' 0 C--N 1.365 1.25 0 C-N-CA 126.299 1.839 . . . . 0.0 112.517 -177.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.8 mm -89.54 59.7 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.364 0 CA-C-O 125.179 2.419 . . . . 0.0 109.47 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.615 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.366 10.8 t-20 -54.44 -3.19 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.554 1 C-N-CA 133.831 4.852 . . . . 0.0 120.306 -170.833 . . . . . . . . 4 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.05 -59.2 2.56 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 130.894 3.678 . . . . 0.0 111.145 172.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.77 -12.31 61.48 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 128.142 2.577 . . . . 0.0 112.47 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.615 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.7 t -88.43 -30.11 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 C-N-CA 130.508 3.523 . . . . 0.0 108.39 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.4 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 45.2 t80 -73.57 -42.11 62.04 Favored 'General case' 0 C--N 1.369 1.426 0 C-N-CA 125.778 1.631 . . . . 0.0 109.038 174.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.69 -42.91 93.75 Favored 'Isoleucine or valine' 0 C--N 1.369 1.433 0 C-N-CA 126.958 2.103 . . . . 0.0 110.875 168.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.289 11.4 tpp180 -65.07 -47.29 77.81 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.4 mtm180 -57.89 -31.82 67.12 Favored 'General case' 0 C--N 1.379 1.849 0 C-N-CA 128.77 2.828 . . . . 0.0 117.507 167.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -77.15 -46.62 22.81 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 127.384 2.273 . . . . 0.0 110.683 170.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.64 ' HA ' ' HG3' ' A' ' 16' ' ' ARG 0.337 31.1 mtpt -59.3 -28.42 66.75 Favored 'General case' 0 C--N 1.367 1.341 0 C-N-CA 126.646 1.979 . . . . 0.0 111.36 172.271 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.6 OUTLIER -71.81 -49.31 39.72 Favored 'General case' 0 C--O 1.21 -1.018 0 C-N-CA 125.504 1.522 . . . . 0.0 111.591 169.474 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.386 15.5 ptt180 -55.78 -33.34 64.27 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 170.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.64 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.292 0.1 OUTLIER -75.43 -38.16 59.96 Favored 'General case' 0 C--N 1.399 2.747 0 O-C-N 120.393 -1.442 . . . . 0.0 113.772 167.009 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.296 89.6 m-70 -56.93 -44.89 82.93 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 130.177 3.391 . . . . 0.0 109.402 172.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.602 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -65.51 -53.49 41.71 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 129.78 3.232 . . . . 0.0 110.802 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -69.07 -40.01 78.74 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.3 m -73.56 -35.47 65.47 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.861 2.064 . . . . 0.0 112.371 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.536 ' HB3' ' CD2' ' A' ' 64' ' ' PHE 0.281 50.7 mt-10 -77.3 -29.09 53.52 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 119.279 -2.138 . . . . 0.0 109.988 168.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -34.21 74.64 Favored 'General case' 0 C--N 1.376 1.72 0 O-C-N 119.196 -2.19 . . . . 0.0 112.637 169.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.321 7.4 ptm180 -69.65 -35.91 75.6 Favored 'General case' 0 C--N 1.375 1.7 0 CA-C-O 118.17 -0.919 . . . . 0.0 113.473 164.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -59.46 -50.41 74.03 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.3 mt -71.77 -44.56 68.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 C-N-CA 125.475 1.51 . . . . 0.0 110.35 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.596 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.625 0.0 OUTLIER -70.15 -24.11 63.11 Favored 'General case' 0 C--N 1.375 1.679 0 O-C-N 119.396 -2.065 . . . . 0.0 114.247 174.443 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -75.02 -37.35 61.8 Favored 'General case' 0 C--N 1.375 1.693 0 O-C-N 119.683 -1.886 . . . . 0.0 112.879 170.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.505 ' HA ' ' HG2' ' A' ' 31' ' ' GLU 0.451 0.0 OUTLIER -69.3 -34.4 74.62 Favored 'General case' 0 C--N 1.402 2.89 0 CA-C-N 122.816 2.553 . . . . 0.0 113.735 172.866 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.73 HD13 ' CE1' ' A' ' 41' ' ' PHE 0.257 2.2 pp -67.19 -44.94 87.42 Favored 'Isoleucine or valine' 0 C--N 1.387 2.202 0 C-N-CA 124.624 1.169 . . . . 0.0 112.183 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -61.25 -38.57 87.18 Favored 'General case' 0 C--N 1.363 1.167 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 170.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.9 pt-20 -76.87 -41.57 43.34 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 119.432 -2.043 . . . . 0.0 113.031 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB3' HG21 ' A' ' 74' ' ' VAL . . . -73.46 -39.66 64.76 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.3 t -71.46 -35.5 70.89 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.896 1.278 . . . . 0.0 110.356 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -70.4 -38.0 74.59 Favored 'General case' 0 C--N 1.388 2.244 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 167.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.42 62.41 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.298 1.839 . . . . 0.0 114.251 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.25 -18.9 61.18 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 120.018 1.281 . . . . 0.0 112.162 170.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.14 18.23 47.39 Favored Glycine 0 C--N 1.376 2.753 0 CA-C-O 121.82 0.678 . . . . 0.0 113.355 168.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.511 HG23 HD22 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -119.89 162.76 18.0 Favored 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 123.774 0.83 . . . . 0.0 109.343 -175.212 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 22.67 -51.09 0.0 OUTLIER 'General case' 0 C--N 1.371 1.504 1 C-N-CA 137.974 6.51 . . . . 0.0 120.718 176.665 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.2 m 72.75 92.48 0.08 Allowed 'General case' 0 C--N 1.364 1.209 0 C-N-CA 131.141 3.776 . . . . 0.0 109.737 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.73 ' CE1' HD13 ' A' ' 29' ' ' ILE . 36.7 p90 -113.96 140.87 48.05 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 122.019 0.914 . . . . 0.0 111.568 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -102.71 167.64 9.77 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 129.163 2.985 . . . . 0.0 105.114 170.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.397 2.8 pp -122.64 156.6 33.99 Favored 'General case' 0 CA--C 1.495 -1.162 0 O-C-N 119.639 -1.913 . . . . 0.0 110.829 167.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -138.83 146.01 40.74 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 100.33 -3.952 . . . . 0.0 100.33 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -142.66 151.8 41.77 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 121.719 0.771 . . . . 0.0 110.151 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.3 t -105.23 140.62 38.11 Favored 'General case' 0 C--N 1.358 0.952 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . 0.327 7.4 mm-40 -80.82 -9.27 59.83 Favored 'General case' 0 C--O 1.203 -1.369 0 C-N-CA 127.874 2.47 . . . . 0.0 116.309 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.06 -48.3 82.38 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 125.731 3.878 . . . . 0.0 118.367 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.676 HD23 ' H ' ' A' ' 134' ' ' ALA . 0.0 OUTLIER -64.81 -34.23 77.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-O 125.024 2.345 . . . . 0.0 112.365 172.799 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.755 ' CD2' HD11 ' A' ' 54' ' ' ILE 0.292 0.7 OUTLIER -68.09 -44.43 76.26 Favored 'General case' 0 C--O 1.196 -1.729 0 C-N-CA 129.671 3.188 . . . . 0.0 107.03 172.79 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -54.58 -37.83 65.99 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 129.461 3.104 . . . . 0.0 111.253 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -71.87 -39.34 69.7 Favored 'General case' 0 C--N 1.374 1.645 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 163.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.66 95.03 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 124.607 3.367 . . . . 0.0 115.345 170.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.755 HD11 ' CD2' ' A' ' 50' ' ' LEU . 56.7 mt -58.8 -45.79 91.22 Favored 'Isoleucine or valine' 0 C--N 1.368 1.389 1 C-N-CA 133.686 4.795 . . . . 0.0 112.562 176.925 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -106.99 -21.89 12.85 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 118.659 2.836 . . . . 0.0 118.659 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.4 ttp-105 -87.32 -30.91 20.48 Favored 'General case' 0 C--N 1.366 1.305 0 CA-C-N 123.893 3.042 . . . . 0.0 111.498 -178.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.705 ' HA ' HD22 ' A' ' 141' ' ' LEU . 23.4 mt-10 -102.75 -57.56 2.03 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.689 1.595 . . . . 0.0 111.309 -176.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.457 HD12 ' N ' ' A' ' 59' ' ' ASP 0.557 0.2 OUTLIER 55.44 135.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 C-N-CA 129.152 2.981 . . . . 0.0 114.379 178.475 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.457 ' N ' HD12 ' A' ' 58' ' ' ILE 0.718 32.8 t70 61.07 25.26 15.3 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 127.784 2.433 . . . . 0.0 113.73 -174.54 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.534 ' O ' HG12 ' A' ' 63' ' ' VAL 0.873 0.4 OUTLIER -65.42 58.31 0.03 OUTLIER 'General case' 0 C--O 1.2 -1.539 0 C-N-CA 129.597 3.159 . . . . 0.0 117.314 -177.09 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.503 1.7 p -78.6 -10.01 59.58 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 130.977 3.711 . . . . 0.0 114.681 174.05 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 136' ' ' ILE . 71.1 t80 -68.18 -34.23 75.91 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.238 3.015 . . . . 0.0 108.156 165.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 60' ' ' GLU 0.279 0.4 OUTLIER -62.87 -46.04 97.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.362 0 C-N-CA 129.623 3.169 . . . . 0.0 107.929 177.957 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.536 ' CD2' ' HB3' ' A' ' 21' ' ' GLU . 85.1 m-85 -61.44 -32.61 72.59 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 131.678 3.991 . . . . 0.0 115.175 164.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -73.61 -43.44 59.64 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-N 123.63 2.923 . . . . 0.0 112.016 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.642 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 0.9 OUTLIER -70.64 -40.32 73.13 Favored 'General case' 0 CA--C 1.559 1.324 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.913 0.0 OUTLIER -77.76 -16.28 58.51 Favored 'General case' 0 C--N 1.377 1.787 0 O-C-N 119.972 -1.705 . . . . 0.0 114.754 176.315 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.432 ' CD2' ' O ' ' A' ' 64' ' ' PHE . 31.3 m-70 -76.29 -30.24 57.69 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.972 2.509 . . . . 0.0 108.622 163.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -72.26 -25.49 61.63 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.473 -2.017 . . . . 0.0 112.301 163.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.429 HG13 ' HA ' ' A' ' 67' ' ' PHE . 1.0 OUTLIER -74.68 -31.63 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 C-N-CA 128.463 2.705 . . . . 0.0 111.581 172.339 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 pttp -52.68 -24.54 8.75 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 129.949 3.299 . . . . 0.0 118.676 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.267 35.8 t70 -97.37 -27.24 14.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.155 2.182 . . . . 0.0 109.513 -175.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.505 ' CE1' ' H ' ' A' ' 152' ' ' THR . 16.0 m-70 -77.28 6.79 6.09 Favored 'General case' 0 C--N 1.368 1.377 1 C-N-CA 132.454 4.302 . . . . 0.0 114.708 -174.501 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 32' ' ' ALA . 93.0 t -36.72 -35.68 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 C-N-CA 129.16 2.984 . . . . 0.0 115.915 166.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.417 HD22 ' H ' ' A' ' 75' ' ' LEU . 0.8 OUTLIER -70.29 -34.25 72.53 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.783 -1.823 . . . . 0.0 113.6 177.651 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 79' ' ' GLU 0.323 35.0 mt-10 -76.41 -34.04 58.81 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.294 1.438 . . . . 0.0 113.794 171.715 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.345 1.9 m -70.72 -36.96 67.24 Favored 'Isoleucine or valine' 0 C--N 1.377 1.785 0 CA-C-O 125.439 2.542 . . . . 0.0 110.68 172.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.564 ' O ' HD23 ' A' ' 81' ' ' LEU . 1.7 m120 -65.34 -32.41 74.03 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 128.107 2.563 . . . . 0.0 112.559 169.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 76' ' ' GLU 0.404 5.6 pt-20 -71.5 -29.66 65.05 Favored 'General case' 0 C--N 1.369 1.439 0 O-C-N 117.7 -3.125 . . . . 0.0 112.33 164.464 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -74.41 -5.59 43.29 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 128.14 2.576 . . . . 0.0 114.197 168.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 78' ' ' ASN . 2.9 pp -40.04 -46.73 2.17 Favored 'General case' 0 N--CA 1.508 2.43 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 -164.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 60.3 p -112.6 -49.15 2.96 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-N 125.404 3.729 . . . . 0.0 113.175 138.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.506 ' CE ' HG23 ' A' ' 97' ' ' VAL . 0.8 OUTLIER -130.13 169.52 13.24 Favored Pre-proline 0 N--CA 1.442 -0.839 2 C-N-CA 144.316 9.046 . . . . 0.0 99.519 156.353 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -52.32 149.45 22.71 Favored 'Trans proline' 0 CA--C 1.568 2.187 1 CA-C-N 129.663 4.487 . . . . 0.0 113.486 171.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . 0.281 21.6 Cg_exo -32.98 148.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.908 2 C-N-CA 127.95 5.766 . . . . 0.0 125.345 -151.173 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 24.7 mtm180 -105.87 53.24 0.15 Allowed Pre-proline 0 C--N 1.374 1.656 0 N-CA-C 118.584 2.809 . . . . 0.0 118.584 174.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -51.35 160.89 2.06 Favored 'Trans proline' 0 C--N 1.373 1.856 1 C-N-CA 129.051 6.501 . . . . 0.0 117.369 170.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -43.76 -43.21 5.94 Favored 'General case' 0 C--N 1.359 1.021 1 C-N-CA 133.005 4.522 . . . . 0.0 118.305 -173.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -77.47 154.25 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 127.79 2.436 . . . . 0.0 114.653 173.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -115.64 -11.44 11.69 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 112.972 -1.922 . . . . 0.0 110.209 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -104.69 -27.67 11.67 Favored 'General case' 0 C--N 1.354 0.795 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -175.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -109.92 1.83 19.39 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 126.855 2.062 . . . . 0.0 111.328 -176.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.332 0.2 OUTLIER -140.16 -86.85 0.2 Allowed 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 179.894 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . 0.306 0.4 OUTLIER -84.56 87.33 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.861 0 CA-C-O 127.849 3.69 . . . . 0.0 117.542 -169.661 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -106.18 -19.16 13.8 Favored 'General case' 0 C--N 1.313 -0.995 2 CA-C-N 105.142 -5.481 . . . . 0.0 110.118 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -91.91 -9.79 62.06 Favored Glycine 0 C--N 1.363 2.039 0 C-N-CA 127.097 2.284 . . . . 0.0 110.761 174.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.506 HG23 ' CE ' ' A' ' 83' ' ' MET . 68.7 t -91.85 91.62 3.56 Favored 'Isoleucine or valine' 0 C--N 1.372 1.553 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 173.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -115.22 19.13 15.83 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 127.934 2.494 . . . . 0.0 108.475 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 57.39 70.88 0.61 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 130.393 3.477 . . . . 0.0 115.778 -177.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.2 mmm180 -112.15 167.05 9.73 Favored Pre-proline 0 C--N 1.358 0.962 0 C-N-CA 125.364 1.466 . . . . 0.0 111.426 -175.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -62.18 135.62 55.55 Favored 'Trans proline' 0 C--N 1.362 1.247 1 C-N-CA 125.332 4.021 . . . . 0.0 116.614 176.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.05 56.5 4.61 Favored Glycine 0 C--N 1.361 1.928 0 C-N-CA 125.235 1.398 . . . . 0.0 113.701 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -137.01 158.01 45.44 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 120.467 -1.607 . . . . 0.0 111.411 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.665 HD23 HD11 ' A' ' 106' ' ' ILE . 12.7 tp -133.02 151.77 52.03 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.397 1.879 . . . . 0.0 113.132 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -125.92 118.2 24.91 Favored 'General case' 0 C--N 1.369 1.433 0 N-CA-C 103.649 -2.722 . . . . 0.0 103.649 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.665 HD11 HD23 ' A' ' 104' ' ' LEU . 1.0 OUTLIER -122.95 119.19 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 126.882 2.073 . . . . 0.0 106.676 -174.173 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 149' ' ' VAL . 2.9 m -127.21 108.23 10.71 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.417 ' CG ' HD21 ' A' ' 66' ' ' LEU . 53.0 t0 -159.17 161.61 36.23 Favored 'General case' 0 CA--C 1.482 -1.657 0 N-CA-C 101.087 -3.671 . . . . 0.0 101.087 -172.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.642 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 83.8 -38.0 2.81 Favored Glycine 0 N--CA 1.474 1.222 0 O-C-N 119.708 -1.87 . . . . 0.0 114.251 174.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 108.95 0.3 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.613 1 C-N-CA 136.157 5.783 . . . . 0.0 108.19 -161.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.839 ' HA ' HG23 ' A' ' 136' ' ' ILE . 2.3 tp -79.78 129.36 34.41 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 128.867 2.867 . . . . 0.0 109.264 175.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.7 m95 -96.73 100.97 12.5 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 170.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.319 2.0 mm? -97.26 131.24 44.17 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 173.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -105.92 125.3 8.15 Favored Glycine 0 C--N 1.351 1.394 0 N-CA-C 107.234 -2.346 . . . . 0.0 107.234 162.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.565 ' CE1' HD12 ' A' ' 106' ' ' ILE 0.294 1.0 OUTLIER -118.56 152.54 35.82 Favored 'General case' 0 C--N 1.374 1.667 0 CA-C-N 122.373 3.087 . . . . 0.0 106.712 179.163 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.7 m -122.27 137.8 54.72 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 100.438 -3.912 . . . . 0.0 100.438 166.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.22 128.64 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.369 0 N-CA-C 100.702 -3.814 . . . . 0.0 100.702 165.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.438 ' HB2' HD22 ' A' ' 121' ' ' ASN . 14.2 p 40.31 -137.4 0.12 Allowed 'General case' 0 C--N 1.363 1.163 0 N-CA-C 121.266 3.802 . . . . 0.0 121.266 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.359 88.3 tttt 159.31 -65.72 0.0 OUTLIER Pre-proline 0 N--CA 1.421 -1.885 2 C-N-CA 133.879 4.872 . . . . 0.0 109.182 161.812 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -75.46 53.62 3.59 Favored 'Trans proline' 0 CA--C 1.554 1.515 0 C-N-CA 123.267 2.644 . . . . 0.0 115.431 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.438 HD22 ' HB2' ' A' ' 118' ' ' CYS . 18.5 p30 -170.16 172.32 6.41 Favored 'General case' 0 C--N 1.371 1.5 0 N-CA-C 117.148 2.277 . . . . 0.0 117.148 -177.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.623 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 29.0 tt0 -141.83 -91.29 0.14 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 128.495 2.718 . . . . 0.0 105.634 156.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 6.9 mptt 50.77 14.85 0.2 Allowed 'General case' 0 C--N 1.364 1.223 1 C-N-CA 136.735 6.014 . . . . 0.0 117.505 -172.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.623 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -169.83 -119.83 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.171 0 C-N-CA 130.669 3.588 . . . . 0.0 106.964 -167.563 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.465 ' H ' ' HB3' ' A' ' 124' ' ' PHE . 10.0 mmtt -108.72 -65.53 1.13 Allowed 'General case' 0 N--CA 1.425 -1.712 0 N-CA-C 102.634 -3.098 . . . . 0.0 102.634 171.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -177.31 145.98 0.62 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 128.341 2.657 . . . . 0.0 107.893 169.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -147.2 38.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.065 0 N-CA-C 118.681 2.531 . . . . 0.0 118.681 -171.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.8 m -144.06 156.37 44.35 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 170.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.24 130.47 53.38 Favored 'General case' 0 C--N 1.358 0.978 1 N-CA-C 99.001 -4.444 . . . . 0.0 99.001 159.739 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . 0.327 35.9 mt-30 -119.99 72.39 0.93 Allowed 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 120.232 -1.542 . . . . 0.0 107.311 -172.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.256 4.8 t 104.12 117.1 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 125.597 1.559 . . . . 0.0 110.124 -177.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -114.87 113.86 24.76 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 173.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.407 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 6.0 ttp -94.01 108.16 20.01 Favored 'General case' 0 CA--C 1.497 -1.063 0 C-N-CA 126.077 1.751 . . . . 0.0 108.465 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.676 ' H ' HD23 ' A' ' 49' ' ' LEU . . . -123.61 114.81 20.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 121.276 0.56 . . . . 0.0 110.227 -172.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 6.3 mm -134.68 134.17 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.398 1.079 . . . . 0.0 110.544 178.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.839 HG23 ' HA ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -142.65 -179.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.15 0 C-N-CA 127.488 2.315 . . . . 0.0 113.278 -173.087 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.88 106.34 18.32 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 131.156 3.782 . . . . 0.0 107.719 155.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.729 ' CB ' HD21 ' A' ' 141' ' ' LEU 0.277 0.4 OUTLIER -96.59 -91.91 0.23 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 120.069 3.359 . . . . 0.0 120.069 -175.838 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.574 ' HB2' ' HG2' ' A' ' 140' ' ' ARG . 27.0 mtp180 -127.55 -51.99 1.37 Allowed 'General case' 0 C--N 1.371 1.5 0 CA-C-O 123.384 1.564 . . . . 0.0 109.2 -158.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.574 ' HG2' ' HB2' ' A' ' 139' ' ' ARG . 1.6 ptm180 -123.58 19.95 9.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 129.729 3.212 . . . . 0.0 111.335 -168.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.729 HD21 ' CB ' ' A' ' 138' ' ' SER . 0.4 OUTLIER -138.83 164.8 37.07 Favored Pre-proline 0 CA--C 1.492 -1.255 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.871 -170.325 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.59 -41.15 0.85 Allowed 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 124.566 3.511 . . . . 0.0 114.592 171.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 74.2 156.75 4.76 Favored Glycine 0 CA--C 1.496 -1.143 0 C-N-CA 129.567 3.46 . . . . 0.0 115.625 -162.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -85.96 98.71 10.96 Favored 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 128.596 2.758 . . . . 0.0 112.293 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 74.72 -167.59 0.09 Allowed 'General case' 0 C--N 1.36 1.06 0 C-N-CA 129.17 2.988 . . . . 0.0 115.65 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 7.6 p -171.84 136.15 0.89 Allowed 'General case' 0 C--N 1.361 1.106 0 C-N-CA 126.044 1.738 . . . . 0.0 108.575 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 147' ' ' LYS . 19.1 tptt 168.01 155.61 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 101.986 -3.338 . . . . 0.0 101.986 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -150.03 85.93 1.42 Allowed 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 -176.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' VAL . . . . . 0.531 ' H ' HG22 ' A' ' 107' ' ' THR . 50.6 t -77.07 -53.81 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 C-N-CA 130.578 3.551 . . . . 0.0 115.169 -169.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.467 HD11 ' CG2' ' A' ' 106' ' ' ILE . 1.2 pp -107.3 146.08 13.95 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 C-N-CA 131.444 3.898 . . . . 0.0 112.948 -174.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.443 68.6 mttt -114.43 148.19 38.12 Favored 'General case' 0 C--N 1.355 0.845 1 N-CA-C 98.48 -4.637 . . . . 0.0 98.48 148.268 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.505 ' H ' ' CE1' ' A' ' 73' ' ' HIS 0.994 0.5 OUTLIER -76.82 146.05 38.04 Favored 'General case' 0 N--CA 1.494 1.74 1 N-CA-C 129.65 6.907 . . . . 0.0 129.65 -134.56 . . . . . . . . 5 4 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 . . . . . 0 N--CA 1.416 -2.133 2 C-N-CA 135.27 5.428 . . . . 0.0 105.418 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.7 tmm? . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . 0.452 7.7 p 73.39 179.76 0.21 Allowed 'General case' 0 C--N 1.358 0.952 0 C-N-CA 127.806 2.442 . . . . 0.0 117.406 -177.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.5 mm -83.75 44.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.364 1.21 0 C-N-CA 128.198 2.599 . . . . 0.0 115.04 -171.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.669 ' HA ' HG13 ' A' ' 7' ' ' VAL . 18.1 m-80 -59.44 -8.66 1.91 Allowed 'General case' 0 N--CA 1.476 0.856 1 C-N-CA 133.07 4.548 . . . . 0.0 115.838 176.1 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.74 -57.91 10.39 Favored 'General case' 0 C--N 1.347 0.495 1 C-N-CA 133.268 4.627 . . . . 0.0 111.694 171.594 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.0 -15.24 61.1 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.562 2.345 . . . . 0.0 113.294 177.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.669 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.252 0.6 OUTLIER -87.77 -37.03 10.28 Favored 'Isoleucine or valine' 0 C--N 1.355 0.827 0 C-N-CA 127.514 2.325 . . . . 0.0 110.565 179.304 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -70.26 -40.42 74.38 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 129.435 3.094 . . . . 0.0 108.795 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.17 -43.91 99.08 Favored 'Isoleucine or valine' 0 C--N 1.376 1.759 0 C-N-CA 125.02 1.328 . . . . 0.0 109.629 165.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.269 0.3 OUTLIER -58.11 -49.35 77.26 Favored 'General case' 0 C--N 1.37 1.472 0 N-CA-C 116.175 1.917 . . . . 0.0 116.175 171.939 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.4 -31.39 72.06 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 169.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -77.15 -51.24 11.33 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 126.93 2.092 . . . . 0.0 111.846 174.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -59.11 -28.76 66.83 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.173 3.389 . . . . 0.0 110.15 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.4 OUTLIER -70.14 -51.6 30.18 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 124.779 1.232 . . . . 0.0 111.27 167.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.3 ttt-85 -55.08 -39.56 69.43 Favored 'General case' 0 CA--C 1.566 1.587 0 C-N-CA 125.692 1.597 . . . . 0.0 112.622 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.5 mmt-85 -63.39 -43.86 96.37 Favored 'General case' 0 C--N 1.38 1.9 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 165.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.2 m-70 -56.89 -49.6 75.05 Favored 'General case' 0 C--N 1.39 2.368 0 C-N-CA 128.878 2.871 . . . . 0.0 110.327 171.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.661 ' CE2' HD11 ' A' ' 50' ' ' LEU . 1.4 t80 -54.92 -54.21 45.58 Favored 'General case' 0 C--N 1.379 1.864 0 C-N-CA 131.107 3.763 . . . . 0.0 110.079 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.72 -42.48 67.27 Favored 'General case' 0 C--N 1.372 1.58 0 N-CA-C 119.336 3.088 . . . . 0.0 119.336 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.6 m -69.95 -42.74 72.82 Favored 'General case' 0 C--N 1.363 1.183 0 C-N-CA 127.047 2.139 . . . . 0.0 113.337 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.626 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 4.5 mp0 -74.84 -29.19 60.97 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.208 1.403 . . . . 0.0 109.878 171.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.264 0.2 OUTLIER -62.26 -34.18 76.05 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.043 -1.66 . . . . 0.0 113.275 166.393 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -62.99 -37.55 87.62 Favored 'General case' 0 C--N 1.381 1.974 0 C-N-CA 124.313 1.045 . . . . 0.0 111.432 167.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 tp60 -60.16 -47.71 84.77 Favored 'General case' 0 C--N 1.371 1.537 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 166.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.6 mt -66.84 -45.11 88.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 O-C-N 120.942 -1.099 . . . . 0.0 112.162 178.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.59 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.56 0.7 OUTLIER -72.75 -23.02 60.77 Favored 'General case' 0 C--N 1.366 1.322 0 O-C-N 120.248 -1.533 . . . . 0.0 114.796 173.528 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -73.38 -36.09 66.01 Favored 'General case' 0 C--N 1.362 1.149 0 O-C-N 120.223 -1.548 . . . . 0.0 112.41 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.545 ' HG2' ' HG2' ' A' ' 71' ' ' LYS . 4.0 tp10 -74.03 -43.32 58.34 Favored 'General case' 0 C--N 1.394 2.521 0 O-C-N 119.281 -2.137 . . . . 0.0 109.645 171.146 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.59 HG13 ' HA ' ' A' ' 26' ' ' ASN 0.431 0.7 OUTLIER -63.66 -42.55 96.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 CA-C-N 120.714 1.597 . . . . 0.0 115.058 176.507 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -71.12 -32.34 68.89 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 120.204 1.366 . . . . 0.0 114.114 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -76.45 -39.62 52.83 Favored 'General case' 0 C--N 1.377 1.781 0 O-C-N 119.449 -2.032 . . . . 0.0 111.275 177.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.63 -44.58 56.61 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.348 1.459 . . . . 0.0 114.277 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.263 59.5 p -68.43 -30.37 69.25 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 120.092 -1.63 . . . . 0.0 112.481 175.039 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -70.05 -47.35 62.37 Favored 'General case' 0 C--N 1.379 1.848 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 162.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.41 -33.09 74.92 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 126.421 1.888 . . . . 0.0 115.988 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -14.96 61.48 Favored 'General case' 0 C--N 1.376 1.72 0 CA-C-N 119.865 1.211 . . . . 0.0 112.645 168.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 17.91 47.41 Favored Glycine 0 C--N 1.385 3.251 0 O-C-N 121.076 -1.015 . . . . 0.0 113.324 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.512 HG11 ' CG ' ' A' ' 78' ' ' ASN 0.277 0.6 OUTLIER -107.84 177.24 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.987 0 C-N-CA 126.534 1.934 . . . . 0.0 107.224 -174.868 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 6.94 -65.89 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.564 2 C-N-CA 135.758 5.623 . . . . 0.0 122.019 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.0 m 80.28 88.72 0.05 OUTLIER 'General case' 0 C--N 1.36 1.05 1 C-N-CA 132.075 4.15 . . . . 0.0 102.422 -165.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.462 ' CZ ' HG21 ' A' ' 77' ' ' VAL 0.321 52.0 p90 -111.15 140.87 45.34 Favored 'General case' 0 C--N 1.361 1.1 0 CA-C-O 122.743 1.259 . . . . 0.0 109.666 -167.173 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -100.96 162.4 12.92 Favored 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 126.148 1.779 . . . . 0.0 106.808 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.72 122.46 44.59 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.014 0.926 . . . . 0.0 108.916 -178.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -137.49 141.38 41.5 Favored 'General case' 0 N--CA 1.426 -1.663 1 N-CA-C 99.233 -4.358 . . . . 0.0 99.233 174.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.401 ' CD2' ' CD1' ' A' ' 50' ' ' LEU . 3.6 p90 -130.96 155.02 47.5 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 174.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.9 m -99.62 139.61 35.03 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 104.782 -2.303 . . . . 0.0 104.782 167.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -79.44 -8.74 59.33 Favored 'General case' 0 C--O 1.208 -1.129 0 C-N-CA 128.805 2.842 . . . . 0.0 116.374 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.38 96.6 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 124.447 3.294 . . . . 0.0 116.539 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.778 HD22 ' H ' ' A' ' 49' ' ' LEU 0.321 0.2 OUTLIER -68.62 -39.07 80.98 Favored 'General case' 0 CA--C 1.444 -3.127 0 C-N-CA 130.065 3.346 . . . . 0.0 113.151 174.884 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.888 HD23 HD11 ' A' ' 54' ' ' ILE 0.286 0.2 OUTLIER -65.01 -45.98 83.3 Favored 'General case' 0 C--O 1.202 -1.415 1 CA-C-N 108.304 -4.044 . . . . 0.0 108.991 170.71 . . . . . . . . 5 4 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -55.02 -34.32 63.39 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 117.28 -3.387 . . . . 0.0 110.915 170.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -76.63 -27.05 55.55 Favored 'General case' 0 C--N 1.365 1.281 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 166.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.0 -49.26 11.16 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 117.493 -3.254 . . . . 0.0 113.921 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.888 HD11 HD23 ' A' ' 50' ' ' LEU . 66.8 mt -51.56 -43.3 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 1 C-N-CA 134.686 5.194 . . . . 0.0 111.461 174.975 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.436 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -107.0 -26.0 11.36 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 119.549 3.166 . . . . 0.0 119.549 171.555 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -85.44 -16.6 39.16 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-N 124.394 3.27 . . . . 0.0 113.015 -175.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.605 ' HA ' HD22 ' A' ' 141' ' ' LEU . 16.6 mt-10 -121.59 -56.76 1.86 Allowed 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 128.443 2.697 . . . . 0.0 110.268 -175.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.553 HD13 ' N ' ' A' ' 59' ' ' ASP 0.608 0.0 OUTLIER 73.6 -169.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 C-N-CA 129.894 3.278 . . . . 0.0 108.925 -178.089 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.553 ' N ' HD13 ' A' ' 58' ' ' ILE . 13.2 t70 -8.25 69.24 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.791 1 C-N-CA 133.756 4.822 . . . . 0.0 116.275 173.741 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.5 ' O ' HG12 ' A' ' 63' ' ' VAL 0.393 11.7 pt-20 -98.51 62.17 1.42 Allowed 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 129.469 3.108 . . . . 0.0 108.682 -173.993 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.389 24.3 p -79.21 -11.91 59.97 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 126.793 3.187 . . . . 0.0 113.244 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.626 ' CE2' HG21 ' A' ' 136' ' ' ILE . 25.2 t80 -69.56 -33.58 72.96 Favored 'General case' 0 CA--C 1.551 1.003 1 C-N-CA 133.131 4.572 . . . . 0.0 109.692 166.499 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.548 HG23 HD13 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -61.98 -44.96 99.64 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 C-N-CA 128.477 2.711 . . . . 0.0 108.767 -178.381 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.287 43.9 m-85 -62.42 -45.27 93.84 Favored 'General case' 0 C--O 1.205 -1.249 1 C-N-CA 134.38 5.072 . . . . 0.0 111.976 167.34 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -61.48 -46.21 90.98 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 124.902 3.501 . . . . 0.0 115.575 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.641 HD12 HD21 ' A' ' 111' ' ' LEU . 2.0 tm? -67.76 -45.94 73.5 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.744 1.217 . . . . 0.0 113.908 169.004 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.41 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.964 0.0 OUTLIER -77.05 -16.13 59.36 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.153 -2.217 . . . . 0.0 115.869 -179.616 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -72.65 -36.64 68.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 130.066 3.346 . . . . 0.0 107.214 162.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.95 -15.85 61.11 Favored 'General case' 0 CA--C 1.59 2.518 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.663 HG23 ' CD2' ' A' ' 73' ' ' HIS . 4.4 mm -86.23 -40.15 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 128.079 2.552 . . . . 0.0 113.743 171.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.545 ' HG2' ' HG2' ' A' ' 28' ' ' GLU . 31.6 ttpt -52.75 -14.27 0.52 Allowed 'General case' 0 N--CA 1.503 2.203 1 C-N-CA 136.104 5.762 . . . . 0.0 115.951 175.496 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.343 35.3 t70 -80.89 -34.51 33.47 Favored 'General case' 0 N--CA 1.432 -1.369 1 C-N-CA 135.97 5.708 . . . . 0.0 111.014 176.914 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.663 ' CD2' HG23 ' A' ' 70' ' ' ILE 0.371 0.0 OUTLIER -88.12 24.31 1.88 Allowed 'General case' 0 CA--C 1.487 -1.459 0 C-N-CA 130.103 3.361 . . . . 0.0 116.573 -168.407 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.593 ' HA ' HG13 ' A' ' 77' ' ' VAL . 73.1 t -38.4 -33.51 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 129.206 3.002 . . . . 0.0 113.989 158.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.436 ' H ' HD22 ' A' ' 75' ' ' LEU . 2.6 mm? -64.92 -39.5 93.6 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 131.217 3.807 . . . . 0.0 115.628 171.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -74.82 -36.74 62.42 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 127.039 2.135 . . . . 0.0 111.921 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.593 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.514 0.2 OUTLIER -71.34 -28.85 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-O 124.178 1.942 . . . . 0.0 113.149 172.801 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.512 ' CG ' HG11 ' A' ' 38' ' ' VAL . 0.8 OUTLIER -63.53 -47.66 80.71 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 128.765 2.826 . . . . 0.0 110.957 164.464 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -59.26 -30.49 68.33 Favored 'General case' 0 C--N 1.382 2.002 0 C-N-CA 126.459 1.903 . . . . 0.0 114.58 168.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -68.57 -37.9 80.27 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 127.652 2.381 . . . . 0.0 112.697 171.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.686 HD22 ' HB2' ' A' ' 125' ' ' LYS . 2.3 tm? -75.41 -12.9 60.35 Favored 'General case' 0 C--N 1.377 1.791 0 C-N-CA 129.227 3.011 . . . . 0.0 111.489 170.235 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.4 t -87.02 3.12 47.25 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 128.835 2.854 . . . . 0.0 117.587 -174.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.526 ' HE3' ' HB ' ' A' ' 94' ' ' ILE . 6.5 ttt -79.19 153.51 77.02 Favored Pre-proline 0 C--N 1.371 1.514 0 CA-C-O 115.388 -2.244 . . . . 0.0 105.495 171.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -62.08 -179.29 0.41 Allowed 'Trans proline' 0 CA--C 1.553 1.471 1 C-N-CA 125.864 4.376 . . . . 0.0 116.594 -168.183 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.73 149.78 74.93 Favored 'Trans proline' 0 C--N 1.37 1.704 0 CA-C-N 127.343 3.658 . . . . 0.0 113.522 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.718 ' HD2' HG21 ' A' ' 97' ' ' VAL 0.327 10.6 mmt85 -102.19 53.13 0.05 OUTLIER Pre-proline 0 CA--C 1.595 2.674 1 N-CA-C 121.906 4.039 . . . . 0.0 121.906 178.123 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.512 ' O ' ' HB2' ' A' ' 93' ' ' PHE 0.306 81.3 Cg_exo -67.48 160.28 48.59 Favored 'Trans proline' 0 C--N 1.388 2.624 1 C-N-CA 129.59 6.86 . . . . 0.0 117.004 170.887 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -23.24 -29.89 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 2 C-N-CA 135.401 5.481 . . . . 0.0 124.317 177.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . 0.273 0.0 OUTLIER -60.06 -156.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 1 C-N-CA 133.842 4.857 . . . . 0.0 119.65 179.869 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -146.36 -12.05 0.47 Allowed 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 129.669 3.188 . . . . 0.0 109.584 176.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -87.35 -13.64 42.96 Favored 'General case' 0 C--N 1.351 0.649 0 CA-C-O 123.097 1.427 . . . . 0.0 108.836 164.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.5 ' O ' ' HA ' ' A' ' 86' ' ' ARG . 1.0 OUTLIER -138.72 -3.15 1.68 Allowed 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 126.704 2.001 . . . . 0.0 114.782 -176.527 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' A' ' 87' ' ' PRO 0.355 3.2 t80 -137.03 93.15 2.8 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-O 126.059 2.838 . . . . 0.0 109.042 175.529 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.526 ' HB ' ' HE3' ' A' ' 83' ' ' MET 0.375 6.7 mt -103.93 93.11 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.519 1 CA-C-N 108.343 -4.026 . . . . 0.0 121.781 -152.651 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.27 5.2 t70 31.11 -63.21 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.662 1 C-N-CA 132.666 4.386 . . . . 0.0 120.974 177.987 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -72.63 -9.12 73.7 Favored Glycine 0 C--N 1.37 2.437 0 C-N-CA 127.303 2.382 . . . . 0.0 113.242 165.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.718 HG21 ' HD2' ' A' ' 86' ' ' ARG . 55.8 t -82.13 98.0 4.28 Favored 'Isoleucine or valine' 0 C--N 1.365 1.247 0 C-N-CA 128.692 2.797 . . . . 0.0 107.3 171.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . 0.319 64.1 tt0 46.39 -23.81 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 2 N-CA-C 123.756 4.724 . . . . 0.0 123.756 178.298 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.99 -63.01 1.18 Allowed 'General case' 0 CA--C 1.532 0.285 1 C-N-CA 133.369 4.667 . . . . 0.0 111.539 178.641 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -112.25 164.78 14.42 Favored Pre-proline 0 C--N 1.354 0.781 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 171.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -59.18 144.43 99.39 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 125.133 3.889 . . . . 0.0 117.427 -174.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -104.6 60.1 0.44 Allowed Glycine 0 C--N 1.354 1.563 0 C-N-CA 126.3 1.905 . . . . 0.0 109.173 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 43.1 ptt85 -118.57 149.57 41.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.937 1.827 . . . . 0.0 113.996 -176.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.87 143.39 47.0 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 129.255 3.022 . . . . 0.0 108.305 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -129.88 117.83 20.78 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 103.035 -2.95 . . . . 0.0 103.035 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.432 ' HB ' HD11 ' A' ' 150' ' ' ILE 0.319 15.4 pt -135.57 140.98 43.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 C-N-CA 127.175 2.19 . . . . 0.0 107.664 -175.58 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.6 m -132.93 125.09 29.07 Favored 'General case' 0 CA--C 1.497 -1.087 0 O-C-N 118.252 -2.78 . . . . 0.0 106.29 -172.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.574 ' HB3' HD11 ' A' ' 66' ' ' LEU . 2.1 t0 -148.12 162.49 39.31 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 103.128 -2.915 . . . . 0.0 103.128 -169.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.617 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 84.29 -61.33 4.73 Favored Glycine 0 N--CA 1.479 1.552 0 O-C-N 119.885 -1.759 . . . . 0.0 115.793 170.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 162.12 -30.34 0.0 OUTLIER 'General case' 0 CA--C 1.563 1.456 1 C-N-CA 137.845 6.458 . . . . 0.0 106.611 -167.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.751 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.559 0.5 OUTLIER -79.56 136.61 36.91 Favored 'General case' 0 C--N 1.379 1.878 2 C-N-CA 132.657 4.383 . . . . 0.0 122.358 -175.908 . . . . . . . . 5 4 . 1 . 011 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -90.32 101.84 14.57 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.276 0.2 OUTLIER -94.49 131.57 40.06 Favored 'General case' 0 C--N 1.383 2.032 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 177.847 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.92 127.19 7.69 Favored Glycine 0 C--N 1.353 1.514 0 N-CA-C 105.95 -2.86 . . . . 0.0 105.95 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -120.95 139.93 52.57 Favored 'General case' 0 C--N 1.368 1.405 0 N-CA-C 104.121 -2.548 . . . . 0.0 104.121 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -132.52 137.42 47.16 Favored 'General case' 0 CA--C 1.481 -1.688 0 N-CA-C 100.956 -3.72 . . . . 0.0 100.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -68.62 164.04 2.9 Favored 'Isoleucine or valine' 0 C--N 1.368 1.39 0 CA-C-N 120.282 1.401 . . . . 0.0 109.41 169.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.503 ' SG ' ' HD2' ' A' ' 127' ' ' PRO . 24.8 p -39.04 99.2 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 126.662 1.985 . . . . 0.0 115.813 169.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.264 54.5 tptt -68.02 -40.62 23.3 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 119.404 3.113 . . . . 0.0 119.404 -168.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -100.15 58.46 0.04 OUTLIER 'Trans proline' 0 CA--C 1.549 1.271 0 CA-C-N 125.327 2.938 . . . . 0.0 111.165 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 174.34 -173.83 0.07 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 125.721 1.609 . . . . 0.0 107.009 -175.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.436 ' H ' ' HD2' ' A' ' 123' ' ' LYS . 2.9 tp10 -156.09 -77.54 0.09 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 153.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.436 ' HD2' ' H ' ' A' ' 122' ' ' GLU 0.3 1.7 mptp? 60.84 -32.54 0.07 Allowed 'General case' 0 N--CA 1.436 -1.15 1 C-N-CA 135.58 5.552 . . . . 0.0 117.137 -172.872 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.31 -149.07 0.43 Allowed 'General case' 0 N--CA 1.442 -0.827 1 C-N-CA 132.119 4.168 . . . . 0.0 109.602 -179.523 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.686 ' HB2' HD22 ' A' ' 81' ' ' LEU 0.306 0.0 OUTLIER -99.7 -54.01 3.03 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 129.066 2.947 . . . . 0.0 107.456 172.534 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -171.65 107.36 0.38 Allowed Pre-proline 0 C--N 1.356 0.886 0 C-N-CA 125.485 1.514 . . . . 0.0 114.199 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.503 ' HD2' ' SG ' ' A' ' 118' ' ' CYS . 8.2 Cg_endo -121.69 19.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.375 1.957 0 CA-C-N 124.015 2.47 . . . . 0.0 118.125 174.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.26 0.7 OUTLIER -146.29 153.5 40.63 Favored 'General case' 0 CA--C 1.479 -1.769 0 N-CA-C 103.361 -2.829 . . . . 0.0 103.361 159.256 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mt -103.82 135.03 46.13 Favored 'General case' 0 C--N 1.365 1.27 1 N-CA-C 99.758 -4.164 . . . . 0.0 99.758 161.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -129.95 74.85 1.61 Allowed 'General case' 0 CA--C 1.488 -1.41 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 -173.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.285 71.7 m 120.85 78.48 0.0 OUTLIER 'General case' 0 C--N 1.359 1.013 0 N-CA-C 103.845 -2.65 . . . . 0.0 103.845 -174.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -101.66 109.03 20.74 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 102.537 -3.134 . . . . 0.0 102.537 170.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.35 135.17 50.09 Favored 'General case' 0 C--N 1.348 0.528 0 C-N-CA 127.06 2.144 . . . . 0.0 111.134 -174.115 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.07 116.29 19.06 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 126.62 1.968 . . . . 0.0 110.647 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -135.2 133.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.365 1.255 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 174.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.796 HG22 ' H ' ' A' ' 137' ' ' ASN . 0.2 OUTLIER -121.35 -167.92 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.764 0 C-N-CA 127.432 2.293 . . . . 0.0 112.225 -172.243 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.796 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -177.19 -173.49 0.45 Allowed 'General case' 0 CA--C 1.476 -1.885 1 C-N-CA 137.991 6.517 . . . . 0.0 106.989 177.353 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.574 ' HB2' ' CD ' ' A' ' 139' ' ' ARG 0.375 12.5 m 153.81 -49.94 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 109.923 -3.308 . . . . 0.0 103.975 -168.064 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.574 ' CD ' ' HB2' ' A' ' 138' ' ' SER . 0.0 OUTLIER -133.17 -78.66 0.48 Allowed 'General case' 0 N--CA 1.424 -1.765 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.985 -157.421 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.558 ' HG3' ' HD3' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -105.89 -19.44 13.74 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 130.222 3.409 . . . . 0.0 119.394 -165.413 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.724 ' HB2' ' HA ' ' A' ' 137' ' ' ASN . 2.7 mt -83.75 158.32 62.61 Favored Pre-proline 0 N--CA 1.439 -1.019 0 C-N-CA 129.647 3.179 . . . . 0.0 114.049 -162.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -80.02 -41.19 0.19 Allowed 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 124.489 3.459 . . . . 0.0 114.237 -170.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 87.14 -91.94 1.77 Allowed Glycine 0 CA--C 1.493 -1.342 1 C-N-CA 131.96 4.6 . . . . 0.0 119.105 166.19 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . 0.253 22.4 pttp -53.35 90.77 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 120.943 3.683 . . . . 0.0 120.943 -165.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -144.52 30.81 1.21 Allowed 'General case' 0 C--N 1.354 0.784 0 C-N-CA 125.664 1.586 . . . . 0.0 113.792 -176.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 24.9 m 174.5 161.82 0.2 Allowed 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 100.711 -3.811 . . . . 0.0 100.711 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -168.21 100.06 0.44 Allowed 'General case' 0 C--N 1.364 1.23 0 CA-C-N 121.902 2.137 . . . . 0.0 116.338 -177.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -176.49 82.69 0.02 OUTLIER 'General case' 0 C--N 1.379 1.85 0 C-N-CA 124.685 1.194 . . . . 0.0 111.622 -175.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . 0.267 21.7 m -53.5 110.73 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.247 0 N-CA-C 121.351 3.834 . . . . 0.0 121.351 -175.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.432 HD11 ' HB ' ' A' ' 106' ' ' ILE . 4.5 pt -129.94 144.09 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 131.387 3.875 . . . . 0.0 113.226 177.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.385 38.7 mttm -116.65 146.98 42.35 Favored 'General case' 0 CA--C 1.5 -0.956 1 N-CA-C 98.969 -4.456 . . . . 0.0 98.969 155.043 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 5.9 t -77.62 139.47 39.5 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 -132.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 . . . . . 0 C--O 1.262 1.761 0 CA-C-N 109.01 -3.723 . . . . 0.0 117.51 -162.011 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.0 mtt . . . . . 0 CA--C 1.518 -0.28 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.9 p -67.35 120.26 13.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 129.397 3.079 . . . . 0.0 114.05 176.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 mm -47.69 41.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 1 C-N-CA 133.916 4.886 . . . . 0.0 121.292 -172.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.711 ' HA ' HG13 ' A' ' 7' ' ' VAL . 35.4 m-80 -59.14 -1.88 0.22 Allowed 'General case' 0 N--CA 1.478 0.967 1 C-N-CA 133.165 4.586 . . . . 0.0 117.322 177.051 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.33 -57.7 9.53 Favored 'General case' 0 C--N 1.349 0.571 1 C-N-CA 131.956 4.102 . . . . 0.0 111.728 172.839 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -75.13 -14.57 60.58 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.013 2.125 . . . . 0.0 112.616 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.711 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.316 0.8 OUTLIER -86.66 -33.67 7.26 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 126.791 2.036 . . . . 0.0 110.696 176.395 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -66.76 -44.69 80.76 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 128.599 2.759 . . . . 0.0 109.002 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mt -58.2 -43.21 85.23 Favored 'Isoleucine or valine' 0 C--N 1.363 1.169 0 CA-C-N 113.615 -1.629 . . . . 0.0 111.696 165.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 12.6 ttm105 -59.94 -49.44 77.66 Favored 'General case' 0 C--N 1.369 1.435 0 O-C-N 119.733 -1.855 . . . . 0.0 115.654 170.332 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.431 ' HD2' ' HG2' ' A' ' 55' ' ' GLN . 75.9 mtm180 -58.59 -30.53 67.27 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 119.113 3.005 . . . . 0.0 119.113 167.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -77.16 -49.02 16.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.696 3.198 . . . . 0.0 111.035 173.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 14.2 mmtp -57.49 -29.14 64.02 Favored 'General case' 0 C--N 1.376 1.752 0 C-N-CA 128.629 2.772 . . . . 0.0 109.679 170.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.66 HD13 HG23 ' A' ' 54' ' ' ILE . 0.0 OUTLIER -72.32 -43.45 64.12 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.038 1.335 . . . . 0.0 113.854 168.821 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -55.8 -40.92 73.38 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 119.764 -1.835 . . . . 0.0 112.496 168.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.3 mmt-85 -63.38 -48.09 79.36 Favored 'General case' 0 C--N 1.379 1.879 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 165.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.407 ' CG ' ' O ' ' A' ' 13' ' ' LYS 0.29 11.4 m-70 -57.03 -46.89 82.04 Favored 'General case' 0 C--N 1.39 2.354 1 C-N-CA 131.932 4.093 . . . . 0.0 110.27 175.81 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.625 ' CE1' HD21 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -58.55 -54.54 45.91 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 130.144 3.378 . . . . 0.0 110.889 175.238 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.17 -45.16 58.11 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 118.046 2.609 . . . . 0.0 118.046 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.9 m -65.78 -41.41 92.06 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.252 2.221 . . . . 0.0 112.748 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.567 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.392 3.7 mp0 -77.28 -29.25 53.7 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 120.611 -1.306 . . . . 0.0 111.249 172.071 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.67 -31.27 70.52 Favored 'General case' 0 C--N 1.388 2.258 0 O-C-N 119.18 -2.2 . . . . 0.0 112.76 167.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -69.17 -38.33 78.64 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 125.203 1.401 . . . . 0.0 110.632 165.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 31.4 tp60 -58.47 -46.87 85.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 168.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.7 mt -70.75 -45.46 73.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 O-C-N 121.24 -0.912 . . . . 0.0 112.285 175.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.628 0.5 OUTLIER -70.61 -23.69 62.6 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 119.825 1.193 . . . . 0.0 113.662 177.099 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -69.31 -45.95 68.3 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.19 -1.569 . . . . 0.0 109.814 167.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.42 ' HG2' ' CG ' ' A' ' 71' ' ' LYS . 18.9 tp10 -64.19 -36.75 85.09 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.764 -1.835 . . . . 0.0 114.308 174.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.409 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 4.8 mt -62.31 -50.09 81.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 C-N-CA 125.055 1.342 . . . . 0.0 113.943 171.228 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttm105 -68.31 -28.6 67.32 Favored 'General case' 0 C--N 1.361 1.085 0 CA-C-N 121.534 1.97 . . . . 0.0 115.056 176.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -76.21 -45.38 33.34 Favored 'General case' 0 C--N 1.37 1.489 0 O-C-N 119.776 -1.827 . . . . 0.0 110.331 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.6 -40.42 66.53 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.443 ' HA ' HD21 ' A' ' 78' ' ' ASN 0.348 4.0 p -68.93 -39.04 79.84 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.617 1.167 . . . . 0.0 111.19 177.801 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 mmtp -66.32 -46.25 77.53 Favored 'General case' 0 C--N 1.376 1.758 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 167.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.93 71.93 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 126.114 1.766 . . . . 0.0 114.783 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.33 -13.89 60.81 Favored 'General case' 0 C--N 1.376 1.736 0 CA-C-N 119.411 1.005 . . . . 0.0 113.495 169.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.98 18.02 30.68 Favored Glycine 0 C--N 1.38 2.988 0 CA-C-N 119.567 1.076 . . . . 0.0 114.094 171.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.556 HG23 HD11 ' A' ' 81' ' ' LEU . 1.9 m -118.83 175.8 3.56 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 -175.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.316 3.6 m -52.44 162.04 0.59 Allowed 'General case' 0 N--CA 1.428 -1.546 1 C-N-CA 132.574 4.35 . . . . 0.0 118.966 176.86 . . . . . . . . 3 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.6 m -92.82 112.71 24.76 Favored 'General case' 0 CA--C 1.49 -1.335 0 C-N-CA 124.821 1.249 . . . . 0.0 107.632 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.489 ' HA ' ' O ' ' A' ' 127' ' ' PRO 0.277 42.9 p90 -114.0 144.53 42.95 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.056 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -118.35 163.12 17.19 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-O 123.601 1.667 . . . . 0.0 112.359 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -122.06 121.78 37.76 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 125.766 1.626 . . . . 0.0 114.403 -174.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -122.01 162.05 21.84 Favored 'General case' 0 C--N 1.373 1.621 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 171.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.46 ' CD2' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -116.34 172.55 7.12 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 170.035 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.9 m -97.59 117.84 32.76 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 102.893 -3.002 . . . . 0.0 102.893 159.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.54 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.529 0.0 OUTLIER -78.12 -10.16 59.5 Favored 'General case' 0 CA--C 1.556 1.18 0 O-C-N 120.004 -1.685 . . . . 0.0 115.281 -175.298 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.7 -38.82 46.57 Favored 'General case' 0 C--N 1.376 1.746 0 CA-C-O 126.127 2.87 . . . . 0.0 110.071 172.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.402 HD21 ' HA ' ' A' ' 133' ' ' MET . 21.0 tp -64.45 -35.01 79.55 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 127.809 2.444 . . . . 0.0 111.213 168.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.625 HD21 ' CE1' ' A' ' 18' ' ' PHE . 1.8 mp -74.71 -28.09 60.66 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.123 166.152 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.15 -30.6 64.6 Favored 'General case' 0 C--N 1.365 1.262 0 O-C-N 118.299 -2.75 . . . . 0.0 109.747 171.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -79.53 -55.43 5.04 Favored 'General case' 0 C--N 1.386 2.195 0 N-CA-C 117.821 2.526 . . . . 0.0 117.821 158.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.16 -30.69 70.55 Favored 'General case' 0 N--CA 1.502 2.15 1 CA-C-N 127.366 4.621 . . . . 0.0 118.852 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.66 HG23 HD13 ' A' ' 14' ' ' LEU . 42.1 mt -68.53 -46.49 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 128.08 2.552 . . . . 0.0 112.529 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.551 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.1 mt-30 -102.54 -18.98 15.04 Favored 'General case' 0 C--N 1.371 1.517 0 N-CA-C 119.031 2.975 . . . . 0.0 119.031 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -90.0 -7.41 54.05 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-N 123.168 2.713 . . . . 0.0 111.794 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 141' ' ' LEU . 28.4 mt-10 -125.96 -65.25 1.0 Allowed 'General case' 0 C--N 1.354 0.786 0 C-N-CA 126.403 1.881 . . . . 0.0 108.93 -176.097 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.551 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.49 0.2 OUTLIER 71.47 147.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 128.574 2.75 . . . . 0.0 112.593 178.243 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.421 ' HB2' HD12 ' A' ' 58' ' ' ILE . 22.0 t70 58.6 -61.52 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 129.409 3.084 . . . . 0.0 113.679 -175.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.59 ' O ' HG12 ' A' ' 63' ' ' VAL 0.508 7.0 pt-20 27.69 61.56 0.1 Allowed 'General case' 0 C--O 1.205 -1.275 1 C-N-CA 133.799 4.84 . . . . 0.0 114.301 -178.101 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.438 34.9 p -78.03 -10.82 59.79 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 118.171 -2.831 . . . . 0.0 114.043 -172.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.435 ' HE2' HG21 ' A' ' 136' ' ' ILE . 10.8 t80 -68.95 -33.49 73.8 Favored 'General case' 0 CA--C 1.552 1.032 1 C-N-CA 133.653 4.781 . . . . 0.0 110.56 164.314 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.59 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -67.52 -44.33 86.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.412 0 C-N-CA 129.785 3.234 . . . . 0.0 108.804 -178.518 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.567 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.292 28.1 m-85 -63.81 -43.94 94.74 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 130.591 3.556 . . . . 0.0 112.682 166.445 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -59.25 -44.91 92.36 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.259 2.3 . . . . 0.0 114.681 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.73 ' HG ' HD21 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -59.47 -50.72 72.83 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 129.4 3.08 . . . . 0.0 113.125 169.797 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.812 0.1 OUTLIER -77.67 -17.48 57.64 Favored 'General case' 0 C--N 1.377 1.779 0 O-C-N 119.201 -2.187 . . . . 0.0 114.64 176.842 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -80.03 -16.29 55.42 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 126.852 2.061 . . . . 0.0 111.405 166.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -84.36 -40.93 17.27 Favored 'General case' 0 CA--C 1.556 1.201 0 O-C-N 120.38 -1.45 . . . . 0.0 110.488 160.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.676 HD13 ' N ' ' A' ' 153' ' ' GLN 0.327 0.9 OUTLIER -58.51 -26.16 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.808 0 C-N-CA 128.521 2.728 . . . . 0.0 113.896 176.009 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.42 ' CG ' ' HG2' ' A' ' 28' ' ' GLU . 29.5 pttt -61.72 -11.95 14.39 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 129.615 3.166 . . . . 0.0 117.431 174.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.316 80.5 m-20 -89.18 -36.81 15.46 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 123.8 1.762 . . . . 0.0 109.987 -173.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.529 ' NE2' ' HG3' ' A' ' 151' ' ' LYS . 1.9 t-80 -87.46 24.14 1.73 Allowed 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 131.48 3.912 . . . . 0.0 116.206 -166.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.561 ' HA ' HG13 ' A' ' 77' ' ' VAL 0.283 95.7 t -41.95 -31.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 128.171 2.589 . . . . 0.0 114.118 161.168 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.97 -39.07 92.92 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 127.108 2.163 . . . . 0.0 115.748 171.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.47 ' HG3' ' HE1' ' A' ' 73' ' ' HIS 0.368 63.9 mm-40 -76.24 -34.74 59.2 Favored 'General case' 0 C--N 1.366 1.324 0 O-C-N 118.908 -2.37 . . . . 0.0 113.698 170.413 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.561 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.404 1.9 p -70.81 -29.29 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.699 0 CA-C-O 124.084 1.897 . . . . 0.0 113.654 173.318 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.443 HD21 ' HA ' ' A' ' 33' ' ' SER . 4.6 m120 -64.43 -45.37 87.79 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 130.36 3.464 . . . . 0.0 110.326 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.28 -30.28 71.13 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 126.187 1.795 . . . . 0.0 112.762 172.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.518 ' CE1' HG23 ' A' ' 77' ' ' VAL 0.609 0.2 OUTLIER -74.86 -29.6 61.08 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 169.381 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.556 HD11 HG23 ' A' ' 38' ' ' VAL 0.307 0.4 OUTLIER -76.86 -46.52 24.37 Favored 'General case' 0 C--N 1.377 1.795 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 168.955 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.5 m -66.64 3.32 1.03 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 120.676 3.584 . . . . 0.0 120.676 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.826 ' CE ' HG23 ' A' ' 97' ' ' VAL . 8.0 ptm -77.04 166.67 42.92 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 128.644 2.778 . . . . 0.0 112.587 178.356 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.421 ' HA ' ' HD3' ' A' ' 85' ' ' PRO . 83.1 Cg_exo -56.93 142.21 93.46 Favored 'Trans proline' 0 C--N 1.367 1.522 1 C-N-CA 125.321 4.014 . . . . 0.0 112.824 176.606 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 84' ' ' PRO . 50.2 Cg_exo -58.2 158.37 22.35 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 124.228 3.285 . . . . 0.0 118.634 -157.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.443 ' HB2' ' HA ' ' A' ' 123' ' ' LYS . 4.7 mmm-85 -66.22 2.0 0.03 OUTLIER Pre-proline 0 CA--C 1.583 2.221 1 N-CA-C 123.353 4.575 . . . . 0.0 123.353 172.757 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -52.52 160.9 3.24 Favored 'Trans proline' 0 C--N 1.38 2.216 3 C-N-CA 127.726 5.618 . . . . 0.0 123.048 -169.2 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -42.61 -26.98 0.14 Allowed 'General case' 0 C--N 1.361 1.107 1 C-N-CA 137.73 6.412 . . . . 0.0 119.036 -175.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.0 -41.03 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.351 0 C-N-CA 129.145 2.978 . . . . 0.0 115.743 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 55.81 -18.21 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.813 1 C-N-CA 136.182 5.793 . . . . 0.0 115.588 -177.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -98.3 -18.36 18.4 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 126.919 2.088 . . . . 0.0 113.536 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -113.95 3.73 15.5 Favored 'General case' 0 CA--C 1.505 -0.767 0 C-N-CA 123.66 0.784 . . . . 0.0 111.411 -174.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.257 1.3 m-85 -122.4 -66.42 1.03 Allowed 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 117.979 2.585 . . . . 0.0 117.979 -178.592 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.419 ' HB ' ' HB ' ' A' ' 97' ' ' VAL . 3.4 pt -78.26 138.02 21.02 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 127.857 2.463 . . . . 0.0 113.161 -177.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -137.97 -26.15 0.95 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 111.883 -2.417 . . . . 0.0 112.327 -170.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -95.9 -6.23 59.37 Favored Glycine 0 C--N 1.36 1.912 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.826 HG23 ' CE ' ' A' ' 83' ' ' MET . 11.6 t -113.24 113.57 44.42 Favored 'Isoleucine or valine' 0 C--N 1.365 1.264 0 N-CA-C 104.083 -2.562 . . . . 0.0 104.083 175.053 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -79.91 42.88 0.57 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.463 2.305 . . . . 0.0 116.672 -175.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 11.5 t80 77.42 -22.62 0.27 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 129.956 3.302 . . . . 0.0 115.362 178.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 45.1 ptt85 -87.59 168.57 16.8 Favored Pre-proline 0 C--N 1.352 0.71 0 C-N-CA 130.555 3.542 . . . . 0.0 110.72 178.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -52.42 155.71 9.36 Favored 'Trans proline' 0 C--N 1.356 0.929 1 C-N-CA 126.348 4.699 . . . . 0.0 119.821 178.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -92.22 54.28 2.84 Favored Glycine 0 C--N 1.353 1.487 0 C-N-CA 126.555 2.026 . . . . 0.0 113.347 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.1 ptt180 -119.42 146.56 45.27 Favored 'General case' 0 C--N 1.349 0.546 0 C-N-CA 125.59 1.556 . . . . 0.0 111.695 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pp -140.16 150.42 44.2 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 126.423 1.889 . . . . 0.0 111.715 -175.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -130.16 130.87 45.29 Favored 'General case' 0 C--N 1.367 1.336 0 C-N-CA 127.277 2.231 . . . . 0.0 105.444 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.855 HD13 ' HG2' ' A' ' 153' ' ' GLN . 4.9 pt -134.51 138.68 49.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.662 ' O ' HG22 ' A' ' 150' ' ' ILE . 8.9 t -101.64 106.97 18.09 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 173.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.39 143.77 34.14 Favored 'General case' 0 CA--C 1.477 -1.845 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 -168.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 81.71 -21.76 6.23 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.866 2.174 . . . . 0.0 112.23 178.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 116.53 -9.49 0.0 OUTLIER 'General case' 0 C--N 1.376 1.73 1 C-N-CA 135.653 5.581 . . . . 0.0 110.623 -167.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.826 HD13 HD12 ' A' ' 136' ' ' ILE 0.64 0.0 OUTLIER -78.82 138.2 38.07 Favored 'General case' 0 CA--C 1.481 -1.68 1 C-N-CA 135.025 5.33 . . . . 0.0 118.654 -178.649 . . . . . . . . 5 4 . 1 . 012 nuclear build full ' A' A ' 112' ' ' TRP . . . . . 0.478 ' HE1' ' ND2' ' A' ' 137' ' ' ASN . 54.8 m95 -90.45 98.48 11.8 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 103.191 -2.892 . . . . 0.0 103.191 172.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.571 HD13 HD11 ' A' ' 66' ' ' LEU 0.369 0.1 OUTLIER -108.46 119.43 39.49 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.758 176.085 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -106.76 131.73 10.79 Favored Glycine 0 C--N 1.361 1.943 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.672 ' CE1' HD11 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -115.53 145.97 42.14 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 103.249 -2.871 . . . . 0.0 103.249 177.997 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -138.86 124.42 19.5 Favored 'General case' 0 CA--C 1.488 -1.42 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -79.57 145.03 9.94 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 120.116 1.326 . . . . 0.0 110.876 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 25.0 m -4.44 84.1 0.0 OUTLIER 'General case' 0 C--N 1.37 1.458 0 C-N-CA 130.353 3.461 . . . . 0.0 119.856 -172.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.266 19.0 tptm -43.39 -48.63 17.57 Favored Pre-proline 0 C--N 1.365 1.266 0 C-N-CA 129.955 3.302 . . . . 0.0 116.238 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -87.06 90.02 0.6 Allowed 'Trans proline' 0 CA--C 1.561 1.87 0 C-N-CA 123.464 2.776 . . . . 0.0 107.589 156.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.264 8.7 m-80 -47.78 116.97 1.65 Allowed 'General case' 0 C--N 1.369 1.413 0 C-N-CA 131.19 3.796 . . . . 0.0 119.226 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -83.48 -7.41 59.55 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 130.927 3.691 . . . . 0.0 120.652 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 86' ' ' ARG 0.295 19.4 mmtm 53.51 46.69 25.63 Favored 'General case' 0 N--CA 1.434 -1.229 1 C-N-CA 132.017 4.127 . . . . 0.0 119.958 176.71 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.271 38.1 m-85 -156.63 170.36 22.56 Favored 'General case' 0 CA--C 1.489 -1.384 0 CA-C-N 114.475 -1.238 . . . . 0.0 113.972 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.78 76.27 0.97 Allowed 'General case' 0 C--N 1.364 1.224 0 C-N-CA 127.575 2.35 . . . . 0.0 109.416 174.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.449 ' N ' ' HD3' ' A' ' 127' ' ' PRO . 1.2 p30 -175.48 49.9 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.321 1 C-N-CA 137.937 6.495 . . . . 0.0 110.564 177.151 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.489 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 11.1 Cg_exo -98.7 -178.23 0.26 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.057 3.172 . . . . 0.0 114.182 -164.056 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.5 p -125.74 163.98 21.65 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.08 130.38 48.66 Favored 'General case' 0 C--N 1.361 1.104 0 N-CA-C 100.288 -3.967 . . . . 0.0 100.288 176.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -109.68 58.49 0.61 Allowed 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 -168.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 17.2 t 119.08 120.39 0.0 OUTLIER 'General case' 0 C--N 1.364 1.22 0 O-C-N 126.796 2.56 . . . . 0.0 106.259 -169.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -114.55 109.42 18.24 Favored 'General case' 0 C--N 1.357 0.907 1 N-CA-C 97.199 -5.112 . . . . 0.0 97.199 159.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' MET . . . . . 0.421 ' O ' ' HA ' ' A' ' 113' ' ' LEU . 0.0 OUTLIER -93.88 119.52 32.91 Favored 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 125.632 1.573 . . . . 0.0 107.87 -177.26 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -127.77 114.93 17.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 120.347 1.43 . . . . 0.0 108.422 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 5.3 mt -142.35 144.19 25.2 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.826 HD12 HD13 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -125.51 177.66 4.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.65 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -164.161 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.478 ' ND2' ' HE1' ' A' ' 112' ' ' TRP . 0.2 OUTLIER -133.14 117.5 17.56 Favored 'General case' 0 C--N 1.361 1.082 2 N-CA-C 98.023 -4.806 . . . . 0.0 98.023 162.202 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.99 -61.65 0.03 OUTLIER 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 103.838 -2.652 . . . . 0.0 103.838 -173.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.718 ' CD ' ' H ' ' A' ' 140' ' ' ARG 0.716 0.2 OUTLIER 94.88 132.09 0.02 OUTLIER 'General case' 0 C--N 1.369 1.417 0 CA-C-O 122.524 1.154 . . . . 0.0 112.704 -177.736 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.718 ' H ' ' CD ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER 124.5 -41.32 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.454 3 C-N-CA 135.705 5.602 . . . . 0.0 99.018 -144.388 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.64 HD13 ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -106.15 154.4 39.66 Favored Pre-proline 0 C--N 1.38 1.893 2 N-CA-C 127.924 6.268 . . . . 0.0 127.924 171.046 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -97.35 -22.67 0.12 Allowed 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 125.257 3.971 . . . . 0.0 115.823 175.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 3.44 -88.65 0.0 OUTLIER Glycine 0 N--CA 1.479 1.561 1 C-N-CA 136.136 6.589 . . . . 0.0 120.254 -164.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.07 132.29 14.47 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 128.223 2.609 . . . . 0.0 105.394 175.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -115.09 123.33 48.72 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 -176.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 38.3 m 175.6 165.34 0.34 Allowed 'General case' 0 C--N 1.363 1.166 1 N-CA-C 98.756 -4.535 . . . . 0.0 98.756 178.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.336 97.1 mttt -131.11 -79.78 0.53 Allowed 'General case' 0 C--N 1.369 1.437 0 CA-C-N 124.002 3.092 . . . . 0.0 115.688 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.634 ' HB3' HG21 ' A' ' 107' ' ' THR 0.264 . . 69.3 176.55 0.27 Allowed 'General case' 0 CA--C 1.569 1.691 0 N-CA-C 118.682 2.845 . . . . 0.0 118.682 172.896 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 10.4 t -132.38 118.19 34.74 Favored 'Isoleucine or valine' 0 C--N 1.38 1.925 0 O-C-N 118.379 -2.701 . . . . 0.0 116.366 -171.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.861 HD13 ' HG2' ' A' ' 151' ' ' LYS 0.432 0.0 OUTLIER -130.35 151.01 35.21 Favored 'Isoleucine or valine' 0 C--N 1.364 1.237 1 C-N-CA 134.455 5.102 . . . . 0.0 109.783 175.802 . . . . . . . . 5 4 . 1 . 012 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.861 ' HG2' HD13 ' A' ' 150' ' ' ILE 0.381 7.2 ptmt -73.87 152.82 40.11 Favored 'General case' 0 CA--C 1.511 -0.523 1 C-N-CA 135.177 5.391 . . . . 0.0 105.095 175.73 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.484 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 82.8 p -86.21 93.64 9.1 Favored 'General case' 0 C--O 1.203 -1.38 2 O-C-N 114.173 -5.33 . . . . 0.0 109.077 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.855 ' HG2' HD13 ' A' ' 106' ' ' ILE 0.426 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 1 N-CA-C 126.395 5.702 . . . . 0.0 126.395 -162.303 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.4 mtt . . . . . 0 N--CA 1.466 0.347 0 CA-C-O 123.017 1.389 . . . . 0.0 108.719 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -71.92 64.11 0.49 Allowed 'General case' 0 C--N 1.359 1.008 0 N-CA-C 117.957 2.577 . . . . 0.0 117.957 -171.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.0 mm 31.04 52.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.374 1.636 1 C-N-CA 134.685 5.194 . . . . 0.0 114.168 176.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.37 3.4 m120 -50.19 -10.23 0.05 Allowed 'General case' 0 N--CA 1.466 0.347 1 C-N-CA 132.685 4.394 . . . . 0.0 119.673 -170.921 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -50.75 72.8 Favored 'General case' 0 N--CA 1.445 -0.717 1 C-N-CA 133.341 4.656 . . . . 0.0 111.696 166.922 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -80.35 -16.83 53.64 Favored 'General case' 0 C--N 1.372 1.57 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.0 t -81.55 -39.42 17.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.213 0 C-N-CA 130.41 3.484 . . . . 0.0 108.828 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.56 -47.99 76.7 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.363 2.665 . . . . 0.0 110.339 173.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.81 -43.22 66.47 Favored 'Isoleucine or valine' 0 C--N 1.362 1.14 0 C-N-CA 125.708 1.603 . . . . 0.0 113.495 166.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.1 mtm180 -60.45 -50.78 72.19 Favored 'General case' 0 CA--C 1.56 1.345 0 C-N-CA 126.132 1.773 . . . . 0.0 114.086 171.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -60.47 -26.98 67.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 128.793 2.837 . . . . 0.0 117.634 167.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -77.72 -51.09 11.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 130.381 3.472 . . . . 0.0 110.991 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.8 mmtt -57.75 -29.75 65.04 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 128.907 2.883 . . . . 0.0 109.739 169.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' A' ' 54' ' ' ILE . 0.2 OUTLIER -66.68 -49.75 65.11 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 114.233 -1.349 . . . . 0.0 113.887 164.27 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -57.64 -39.56 77.27 Favored 'General case' 0 C--N 1.371 1.533 0 CA-C-N 123.474 2.852 . . . . 0.0 114.452 171.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -61.18 -53.18 60.15 Favored 'General case' 0 C--N 1.379 1.85 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 167.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.293 50.1 m-70 -58.21 -48.73 79.45 Favored 'General case' 0 C--N 1.383 2.046 0 C-N-CA 129.157 2.983 . . . . 0.0 111.922 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.612 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU 0.287 0.9 OUTLIER -57.07 -55.64 32.04 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 128.372 2.669 . . . . 0.0 114.583 174.947 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.98 -35.46 62.05 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -176.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -67.96 -45.01 75.39 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 124.634 1.174 . . . . 0.0 112.806 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.64 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 38.1 mt-10 -77.56 -29.96 52.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.263 -1.523 . . . . 0.0 112.491 173.023 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.312 2.2 m-85 -67.38 -25.96 66.22 Favored 'General case' 0 C--N 1.383 2.05 0 O-C-N 118.706 -2.497 . . . . 0.0 112.362 169.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -66.31 -46.97 75.09 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-O 117.088 -1.434 . . . . 0.0 109.827 161.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -56.68 -47.61 79.47 Favored 'General case' 0 C--N 1.364 1.227 0 N-CA-C 118.842 2.904 . . . . 0.0 118.842 171.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 6.8 mt -70.21 -42.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 O-C-N 120.638 -1.289 . . . . 0.0 111.49 176.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.729 0.0 OUTLIER -74.75 -23.27 58.52 Favored 'General case' 0 C--N 1.373 1.59 0 O-C-N 119.224 -2.173 . . . . 0.0 115.345 177.186 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.61 -37.38 73.84 Favored 'General case' 0 C--N 1.383 2.026 0 C-N-CA 125.652 1.581 . . . . 0.0 110.724 167.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.93 -39.36 93.39 Favored 'General case' 0 C--N 1.388 2.245 0 O-C-N 118.961 -2.337 . . . . 0.0 112.013 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.456 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.6 mt -61.55 -42.0 92.34 Favored 'Isoleucine or valine' 0 C--N 1.373 1.59 0 CA-C-N 120.177 1.353 . . . . 0.0 114.321 172.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.424 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 44.8 ttm180 -59.71 -49.52 77.41 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 124.815 1.246 . . . . 0.0 114.356 174.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -77.06 -37.97 53.54 Favored 'General case' 0 C--N 1.372 1.58 0 C-N-CA 128.527 2.731 . . . . 0.0 113.912 -176.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.534 ' HB3' HG11 ' A' ' 74' ' ' VAL . . . -80.31 -29.16 38.09 Favored 'General case' 0 CA--C 1.494 -1.175 0 CA-C-O 122.49 1.138 . . . . 0.0 113.336 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.461 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.344 23.2 p -79.11 -32.78 44.66 Favored 'General case' 0 C--N 1.357 0.904 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.727 173.277 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 90.2 mttt -60.43 -38.78 85.15 Favored 'General case' 0 C--N 1.374 1.647 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 163.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.09 -36.76 64.29 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.764 2.426 . . . . 0.0 112.843 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.61 61.25 Favored 'General case' 0 C--N 1.383 2.033 0 CA-C-N 119.342 0.974 . . . . 0.0 112.508 168.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.36 17.15 51.16 Favored Glycine 0 C--N 1.364 2.114 0 C-N-CA 127.161 2.315 . . . . 0.0 114.076 172.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.8 HG23 HD11 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -119.52 148.13 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.607 0 CA-C-O 124.482 2.086 . . . . 0.0 108.824 -174.776 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.322 0.1 OUTLIER -11.25 -58.77 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.655 2 C-N-CA 135.757 5.623 . . . . 0.0 121.846 -179.584 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.302 90.8 p 100.23 171.28 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.743 0 C-N-CA 129.3 3.04 . . . . 0.0 108.542 -171.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.456 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 54.2 p90 -151.12 154.79 37.62 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 126.189 1.796 . . . . 0.0 107.195 176.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.428 ' O ' ' HA ' ' A' ' 128' ' ' SER . 72.0 t60 -116.33 124.15 49.41 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 122.296 1.046 . . . . 0.0 109.835 174.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -94.55 160.91 14.43 Favored 'General case' 0 C--N 1.338 0.105 0 O-C-N 118.275 -2.765 . . . . 0.0 114.356 -175.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -138.73 141.41 38.91 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.25 1.82 . . . . 0.0 106.631 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -108.56 154.61 21.7 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 125.445 1.498 . . . . 0.0 108.238 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 110.71 22.76 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 125.063 1.345 . . . . 0.0 113.067 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.563 ' HA ' ' CB ' ' A' ' 50' ' ' LEU 0.965 0.0 OUTLIER -72.73 -8.28 54.62 Favored 'General case' 0 C--N 1.355 0.816 1 C-N-CA 134.004 4.922 . . . . 0.0 120.656 -175.304 . . . . . . . . 5 4 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 -47.08 15.82 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 125.292 2.472 . . . . 0.0 109.707 167.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.8 tp -60.67 -36.07 77.83 Favored 'General case' 0 C--N 1.369 1.429 0 C-N-CA 128.339 2.656 . . . . 0.0 110.06 164.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.612 ' HG ' ' CZ ' ' A' ' 18' ' ' PHE 0.367 0.2 OUTLIER -74.52 -28.51 61.0 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 113.203 -1.817 . . . . 0.0 111.443 170.414 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -59.93 -29.47 68.41 Favored 'General case' 0 CA--C 1.559 1.31 0 O-C-N 116.524 -3.86 . . . . 0.0 109.287 171.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -73.21 -50.93 19.72 Favored 'General case' 0 C--N 1.381 1.948 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 158.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.456 ' HB3' HD13 ' A' ' 50' ' ' LEU . . . -61.8 -29.48 70.18 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 123.945 3.066 . . . . 0.0 116.919 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.573 ' HA ' HD23 ' A' ' 14' ' ' LEU . 1.3 tt -75.58 -39.01 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.139 1 C-N-CA 132.754 4.422 . . . . 0.0 112.693 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.19 -26.28 15.0 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 118.525 -1.27 . . . . 0.0 112.8 172.289 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -74.03 -52.31 13.12 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 120.617 -1.302 . . . . 0.0 112.179 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.511 ' HG2' HD11 ' A' ' 141' ' ' LEU . 2.6 mp0 -109.51 8.42 25.16 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 116.826 2.158 . . . . 0.0 116.826 -175.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 59' ' ' ASP 0.474 0.0 OUTLIER 23.83 -26.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.633 2 C-N-CA 136.656 5.982 . . . . 0.0 125.723 175.096 . . . . . . . . 5 4 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.487 ' N ' HD13 ' A' ' 58' ' ' ILE . 10.6 p-10 -112.92 -47.47 3.04 Favored 'General case' 0 CA--C 1.467 -2.214 1 C-N-CA 132.334 4.253 . . . . 0.0 108.706 176.613 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.469 ' O ' ' HB ' ' A' ' 63' ' ' VAL 0.892 0.0 OUTLIER 15.47 55.61 0.01 OUTLIER 'General case' 0 C--N 1.359 0.995 0 N-CA-C 121.348 3.833 . . . . 0.0 121.348 -166.887 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.258 21.6 p -78.78 -19.07 53.08 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 129.605 3.162 . . . . 0.0 110.705 174.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.412 ' HE2' HG21 ' A' ' 136' ' ' ILE 0.266 40.5 t80 -65.48 -34.51 78.43 Favored 'General case' 0 CA--C 1.543 0.703 1 C-N-CA 132.458 4.303 . . . . 0.0 111.636 168.621 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.484 ' CG2' HD21 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -60.66 -45.87 96.77 Favored 'Isoleucine or valine' 0 C--N 1.364 1.233 0 C-N-CA 130.231 3.413 . . . . 0.0 109.076 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.64 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 43.2 m-85 -62.61 -46.0 90.29 Favored 'General case' 0 CA--C 1.493 -1.241 1 C-N-CA 132.422 4.289 . . . . 0.0 112.79 170.078 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.89 -42.47 97.46 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 121.564 1.984 . . . . 0.0 114.902 177.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.459 HD21 ' HB3' ' A' ' 108' ' ' ASP . 2.2 tm? -65.02 -49.27 70.83 Favored 'General case' 0 CA--C 1.565 1.526 0 C-N-CA 127.797 2.439 . . . . 0.0 113.516 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.431 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.782 0.0 OUTLIER -78.5 -16.26 57.7 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 118.485 -2.634 . . . . 0.0 115.909 178.23 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -76.81 -28.31 55.52 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 129.405 3.082 . . . . 0.0 106.797 164.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -70.08 -34.89 73.74 Favored 'General case' 0 CA--C 1.569 1.704 0 O-C-N 118.769 -2.457 . . . . 0.0 112.483 159.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.804 HD13 ' HB2' ' A' ' 153' ' ' GLN . 20.1 mm -72.1 -11.88 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.087 1 C-N-CA 132.258 4.223 . . . . 0.0 118.05 176.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.3 pttm -60.06 -26.94 66.55 Favored 'General case' 0 C--N 1.32 -0.699 2 N-CA-C 124.157 4.873 . . . . 0.0 124.157 -175.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.34 -20.26 15.93 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 127.239 2.215 . . . . 0.0 108.735 -172.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.631 ' CG ' ' HG2' ' A' ' 153' ' ' GLN . 6.1 m80 -77.22 16.07 0.64 Allowed 'General case' 0 C--N 1.372 1.563 0 C-N-CA 129.174 2.99 . . . . 0.0 112.414 172.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.571 ' HA ' ' CG1' ' A' ' 77' ' ' VAL . 3.9 p -49.99 -27.93 4.08 Favored 'Isoleucine or valine' 0 C--N 1.378 1.82 0 C-N-CA 128.678 2.791 . . . . 0.0 111.569 157.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.24 -31.01 69.29 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 128.215 2.606 . . . . 0.0 113.22 174.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -76.28 -40.06 52.69 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 126.967 2.107 . . . . 0.0 112.324 172.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.571 ' CG1' ' HA ' ' A' ' 74' ' ' VAL 0.461 3.0 p -70.11 -27.82 33.81 Favored 'Isoleucine or valine' 0 C--N 1.367 1.353 0 CA-C-O 124.629 2.156 . . . . 0.0 111.636 171.405 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.461 HD21 ' HB2' ' A' ' 33' ' ' SER . 9.1 m120 -70.12 -38.7 75.64 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.991 2.116 . . . . 0.0 114.39 167.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -30.43 70.0 Favored 'General case' 0 C--N 1.369 1.423 0 CA-C-N 121.075 1.761 . . . . 0.0 111.269 170.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -64.04 -36.17 83.11 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 129.139 2.976 . . . . 0.0 112.03 167.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.8 HD11 HG23 ' A' ' 38' ' ' VAL 0.275 0.5 OUTLIER -73.36 -45.84 52.65 Favored 'General case' 0 C--N 1.39 2.365 0 O-C-N 119.81 -1.806 . . . . 0.0 113.769 170.321 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.486 ' N ' HD12 ' A' ' 81' ' ' LEU . 15.5 m -70.81 -39.51 73.03 Favored 'General case' 0 CA--C 1.5 -0.954 1 C-N-CA 132.695 4.398 . . . . 0.0 117.546 -171.849 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.677 ' CE ' HG23 ' A' ' 97' ' ' VAL . 15.5 mmm -125.39 99.2 33.84 Favored Pre-proline 0 C--N 1.376 1.722 0 CA-C-O 125.712 2.672 . . . . 0.0 115.363 166.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.476 ' HD2' ' CE ' ' A' ' 125' ' ' LYS . 4.8 Cg_endo -138.21 -176.88 0.0 OUTLIER 'Trans proline' 0 CA--C 1.576 2.613 2 C-N-CA 133.116 9.211 . . . . 0.0 99.951 146.802 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -86.73 134.49 3.87 Favored 'Trans proline' 0 CA--C 1.566 2.117 2 O-C-N 112.765 -4.387 . . . . 0.0 118.426 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.437 ' HG2' ' H ' ' A' ' 86' ' ' ARG . 6.3 ptm180 -85.64 -27.58 0.38 Allowed Pre-proline 0 CA--C 1.563 1.45 1 C-N-CA 136.17 5.788 . . . . 0.0 116.633 159.943 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -85.16 160.51 11.47 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 124.286 3.324 . . . . 0.0 117.773 -169.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.83 -17.77 13.98 Favored 'General case' 0 C--N 1.355 0.816 0 CA-C-N 113.046 -1.888 . . . . 0.0 109.984 170.046 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -96.35 174.27 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 C-N-CA 130.467 3.507 . . . . 0.0 117.104 -172.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -119.72 -9.75 9.69 Favored 'General case' 0 C--N 1.349 0.563 0 CA-C-N 110.748 -2.933 . . . . 0.0 113.031 -176.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -106.82 -36.73 6.58 Favored 'General case' 0 C--N 1.353 0.755 0 C-N-CA 126.321 1.848 . . . . 0.0 115.015 -176.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -120.42 34.07 5.35 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 128.746 2.819 . . . . 0.0 106.918 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.284 1.5 p90 -66.28 -136.94 0.0 OUTLIER 'General case' 0 C--N 1.353 0.733 0 C-N-CA 128.875 2.87 . . . . 0.0 117.741 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 6.1 pt -112.15 139.06 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 C-N-CA 127.635 2.374 . . . . 0.0 110.921 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -144.83 -23.59 0.51 Allowed 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 111.497 -2.592 . . . . 0.0 112.376 -171.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -94.23 -7.22 60.96 Favored Glycine 0 C--N 1.36 1.916 0 N-CA-C 110.294 -1.123 . . . . 0.0 110.294 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.677 HG23 ' CE ' ' A' ' 83' ' ' MET . 95.5 t -81.82 91.64 2.17 Favored 'Isoleucine or valine' 0 C--N 1.366 1.319 0 CA-C-O 125.224 2.44 . . . . 0.0 110.225 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -125.8 21.18 7.67 Favored 'General case' 0 N--CA 1.445 -0.704 1 C-N-CA 132.313 4.245 . . . . 0.0 105.582 175.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.344 0.1 OUTLIER -30.3 157.51 0.0 OUTLIER 'General case' 0 C--N 1.354 0.765 2 N-CA-C 125.06 5.207 . . . . 0.0 125.06 -170.888 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 67.9 mtm180 -112.25 159.32 34.31 Favored Pre-proline 0 C--N 1.361 1.078 0 C-N-CA 127.02 2.128 . . . . 0.0 108.232 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -74.5 156.89 45.2 Favored 'Trans proline' 0 C--N 1.364 1.355 0 C-N-CA 125.22 3.947 . . . . 0.0 112.893 176.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.6 24.68 2.61 Favored Glycine 0 C--N 1.362 2.014 0 C-N-CA 128.872 3.13 . . . . 0.0 119.017 -167.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -140.99 140.96 34.44 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 120.961 -1.317 . . . . 0.0 107.695 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 mt -115.95 129.3 56.33 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 127.004 2.122 . . . . 0.0 108.54 -176.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -129.89 110.87 12.04 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 18.0 pt -135.72 139.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 110.673 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -112.49 127.71 56.13 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 173.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.459 ' HB3' HD21 ' A' ' 66' ' ' LEU . 47.8 t0 -139.11 -174.54 3.88 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 100.625 -3.843 . . . . 0.0 100.625 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.81 -59.44 3.01 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 121.468 3.347 . . . . 0.0 121.468 154.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . 0.272 1.1 m-80 129.74 -28.57 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 131.163 3.785 . . . . 0.0 104.403 -144.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.484 HD21 ' CG2' ' A' ' 63' ' ' VAL . 0.2 OUTLIER -79.47 132.47 36.36 Favored 'General case' 0 C--N 1.359 1.006 1 C-N-CA 132.412 4.285 . . . . 0.0 117.959 -171.853 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -92.02 101.48 14.02 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 167.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.443 HD11 ' CD1' ' A' ' 66' ' ' LEU 0.294 1.4 mm? -95.09 121.53 36.82 Favored 'General case' 0 C--N 1.383 2.037 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 176.456 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -116.19 122.65 5.6 Favored Glycine 0 C--N 1.355 1.611 0 N-CA-C 106.484 -2.647 . . . . 0.0 106.484 171.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -117.6 147.0 43.25 Favored 'General case' 0 C--N 1.367 1.347 0 CA-C-N 121.402 2.601 . . . . 0.0 104.656 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.9 m -134.57 133.31 40.09 Favored 'General case' 0 C--N 1.367 1.334 0 N-CA-C 103.118 -2.919 . . . . 0.0 103.118 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -92.84 139.96 17.12 Favored 'Isoleucine or valine' 0 C--N 1.352 0.698 0 C-N-CA 125.497 1.519 . . . . 0.0 109.514 177.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.306 20.0 p -7.41 73.15 0.0 OUTLIER 'General case' 0 C--N 1.38 1.898 0 C-N-CA 131.571 3.948 . . . . 0.0 119.869 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.333 44.5 tttp -44.3 -53.68 13.56 Favored Pre-proline 0 C--N 1.363 1.161 1 C-N-CA 133.585 4.754 . . . . 0.0 116.959 -171.869 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.64 71.52 1.45 Allowed 'Trans proline' 0 CA--C 1.564 1.983 0 C-N-CA 123.368 2.712 . . . . 0.0 110.429 161.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -55.66 141.25 38.54 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 120.692 3.59 . . . . 0.0 120.692 -173.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.15 113.48 2.96 Favored 'General case' 0 N--CA 1.425 -1.706 2 N-CA-C 95.529 -5.73 . . . . 0.0 95.529 167.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 33.6 mmtm -71.43 55.98 0.24 Allowed 'General case' 0 C--N 1.345 0.382 0 C-N-CA 129.937 3.295 . . . . 0.0 117.241 -172.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -58.28 148.83 26.04 Favored 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.538 4.335 . . . . 0.0 117.586 177.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.476 ' CE ' ' HD2' ' A' ' 84' ' ' PRO 0.307 0.0 OUTLIER -110.82 48.78 0.9 Allowed 'General case' 0 C--N 1.368 1.391 0 CA-C-O 123.816 1.769 . . . . 0.0 107.546 176.024 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.408 ' N ' ' HD3' ' A' ' 127' ' ' PRO . 31.4 t70 -173.36 62.77 0.28 Allowed Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 130.789 3.635 . . . . 0.0 108.448 176.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.41 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 29.8 Cg_exo -71.78 -177.07 2.32 Favored 'Trans proline' 0 C--N 1.355 0.88 1 C-N-CA 126.589 4.859 . . . . 0.0 118.838 -175.018 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 128' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 42' ' ' HIS . 77.7 p -137.63 153.07 49.92 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-N 110.413 -3.085 . . . . 0.0 103.343 167.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 43.1 mt -103.24 130.68 50.53 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 101.329 -3.582 . . . . 0.0 101.329 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -126.34 67.4 1.22 Allowed 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -160.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 72.5 m 110.8 84.04 0.0 OUTLIER 'General case' 0 C--N 1.372 1.587 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -101.58 109.81 21.68 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 101.418 -3.549 . . . . 0.0 101.418 173.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.52 121.98 45.39 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 127.325 2.25 . . . . 0.0 107.355 -174.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.15 114.76 17.42 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 176.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -133.8 149.73 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-O 123.053 1.406 . . . . 0.0 109.211 -176.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.537 HD13 HD21 ' A' ' 141' ' ' LEU . 0.1 OUTLIER -129.02 -179.7 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 C-N-CA 125.275 1.43 . . . . 0.0 108.597 -175.975 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.524 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -133.6 124.52 27.0 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 128.735 2.814 . . . . 0.0 116.863 -170.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.401 ' HB3' HH11 ' A' ' 139' ' ' ARG 0.36 14.5 m 150.22 -83.8 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.089 1 C-N-CA 132.135 4.174 . . . . 0.0 102.926 176.561 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.65 ' HG2' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER 153.83 152.23 0.01 OUTLIER 'General case' 0 CA--C 1.483 -1.596 1 N-CA-C 96.747 -5.279 . . . . 0.0 96.747 -166.309 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.65 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 39.77 -51.78 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.975 2 CA-C-N 129.347 5.522 . . . . 0.0 124.173 -178.657 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.537 HD21 HD13 ' A' ' 136' ' ' ILE 0.416 0.0 OUTLIER 73.12 132.78 0.04 OUTLIER Pre-proline 0 N--CA 1.427 -1.621 1 C-N-CA 150.524 11.53 . . . . 0.0 118.821 178.175 . . . . . . . . 5 4 . 1 . 013 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -74.86 -46.29 0.25 Allowed 'Trans proline' 0 C--N 1.368 1.562 0 C-N-CA 124.309 3.34 . . . . 0.0 111.226 162.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 116.12 123.03 3.5 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 130.093 3.711 . . . . 0.0 115.413 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -145.61 128.62 16.51 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 120.783 -1.422 . . . . 0.0 112.464 175.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -175.13 -171.22 0.5 Allowed 'General case' 0 C--N 1.349 0.586 0 C-N-CA 127.258 2.223 . . . . 0.0 108.267 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 24.5 t -133.65 -166.7 1.82 Allowed 'General case' 0 C--N 1.364 1.231 0 C-N-CA 125.971 1.709 . . . . 0.0 106.832 178.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -107.93 68.69 0.71 Allowed 'General case' 0 CA--C 1.512 -0.514 0 C-N-CA 127.257 2.223 . . . . 0.0 112.434 -177.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.353 . . -152.14 31.2 0.55 Allowed 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 113.084 -1.871 . . . . 0.0 108.43 -169.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 34.7 m -130.87 -166.15 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.96 0 C-N-CA 126.283 1.833 . . . . 0.0 110.636 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.466 ' CD1' ' HG2' ' A' ' 151' ' ' LYS 0.543 0.0 OUTLIER -87.88 150.07 3.88 Favored 'Isoleucine or valine' 0 C--N 1.356 0.866 1 C-N-CA 133.397 4.679 . . . . 0.0 110.089 176.107 . . . . . . . . 5 4 . 1 . 013 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.517 ' HD2' ' CE1' ' A' ' 73' ' ' HIS . 0.0 OUTLIER -75.12 158.31 33.29 Favored 'General case' 0 N--CA 1.416 -2.127 1 C-N-CA 145.279 9.432 . . . . 0.0 110.91 -171.888 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.506 ' O ' HG23 ' A' ' 152' ' ' THR . 14.6 t -74.18 113.88 11.89 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 128.003 3.763 . . . . 0.0 102.883 166.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.804 ' HB2' HD13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.402 -2.844 0 CA-C-N 109.582 -3.463 . . . . 0.0 108.841 -167.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 tpt . . . . . 0 CA--C 1.517 -0.319 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 29.4 p -90.73 -174.51 4.09 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 127.62 2.368 . . . . 0.0 112.761 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.3 mm -95.2 25.23 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.972 0 CA-C-O 125.049 2.356 . . . . 0.0 110.111 176.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -90.07 33.63 0.87 Allowed 'General case' 0 C--N 1.35 0.605 0 C-N-CA 127.94 2.496 . . . . 0.0 114.264 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -58.23 1.93 Allowed 'General case' 0 N--CA 1.448 -0.557 1 C-N-CA 135.515 5.526 . . . . 0.0 106.768 164.557 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 13.5 mt-10 -66.21 -9.82 35.79 Favored 'General case' 0 C--N 1.369 1.449 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.31 -38.14 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 C-N-CA 129.561 3.145 . . . . 0.0 112.035 177.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -71.56 -47.4 55.29 Favored 'General case' 0 C--N 1.357 0.933 1 C-N-CA 132.148 4.179 . . . . 0.0 107.665 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.9 mt -58.72 -43.88 88.76 Favored 'Isoleucine or valine' 0 C--N 1.37 1.497 0 C-N-CA 125.254 1.422 . . . . 0.0 112.132 168.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HB3' HD13 ' A' ' 58' ' ' ILE 0.296 91.2 mtm-85 -64.09 -50.14 69.48 Favored 'General case' 0 C--N 1.376 1.739 0 O-C-N 120.046 -1.659 . . . . 0.0 114.33 169.09 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 29.7 mtp180 -57.5 -28.64 63.63 Favored 'General case' 0 C--N 1.374 1.639 0 CA-C-N 124.405 3.275 . . . . 0.0 119.165 172.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -77.6 -51.64 10.32 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 130.374 3.47 . . . . 0.0 112.006 172.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -57.44 -28.62 63.48 Favored 'General case' 0 C--N 1.378 1.809 0 C-N-CA 128.131 2.572 . . . . 0.0 110.742 170.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.661 HD12 ' HA ' ' A' ' 58' ' ' ILE . 0.2 OUTLIER -70.71 -45.36 65.08 Favored 'General case' 0 C--O 1.206 -1.215 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.544 167.585 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -55.81 -40.39 72.67 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.747 -1.221 . . . . 0.0 114.106 169.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 mmt-85 -63.45 -49.08 75.08 Favored 'General case' 0 C--N 1.374 1.654 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 166.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -56.77 -43.51 80.87 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 129.397 3.079 . . . . 0.0 110.875 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.446 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.76 -54.95 39.01 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 130.546 3.538 . . . . 0.0 112.174 175.753 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -75.82 -39.62 56.42 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 -178.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -73.2 -36.11 66.46 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.749 2.42 . . . . 0.0 112.426 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.654 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.341 33.4 mt-10 -77.64 -29.37 51.66 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 120.463 -1.398 . . . . 0.0 110.89 167.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.515 ' CZ ' ' CE2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -59.18 -32.58 70.04 Favored 'General case' 0 C--N 1.383 2.049 0 O-C-N 119.175 -2.203 . . . . 0.0 113.511 168.59 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -45.98 74.27 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 127.774 2.43 . . . . 0.0 109.527 167.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -57.47 -39.75 77.06 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 170.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.1 mt -72.07 -45.56 62.59 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 O-C-N 120.908 -1.12 . . . . 0.0 111.657 177.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.488 1.0 OUTLIER -70.84 -24.16 62.48 Favored 'General case' 0 C--N 1.373 1.61 0 O-C-N 120.179 -1.575 . . . . 0.0 114.283 173.746 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -73.77 -29.99 62.52 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.159 2.184 . . . . 0.0 110.182 169.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.402 ' OE1' ' HD2' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -73.68 -38.46 64.9 Favored 'General case' 0 C--N 1.39 2.346 0 O-C-N 118.315 -2.741 . . . . 0.0 109.739 172.87 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.436 HG12 ' CE2' ' A' ' 41' ' ' PHE . 1.3 mt -64.62 -46.13 93.37 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 CA-C-O 118.04 -0.981 . . . . 0.0 111.101 167.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.8 tpp180 -55.38 -45.0 76.62 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 122.632 2.469 . . . . 0.0 116.705 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.59 -41.16 47.27 Favored 'General case' 0 CA--C 1.488 -1.418 0 C-N-CA 128.018 2.527 . . . . 0.0 112.639 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.13 -31.4 30.6 Favored 'General case' 0 C--N 1.355 0.835 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.297 25.6 p -75.4 -34.82 61.1 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.388 1.475 . . . . 0.0 108.722 177.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -71.15 -35.88 71.85 Favored 'General case' 0 C--N 1.368 1.395 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 165.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 -36.2 64.31 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.79 -14.74 60.31 Favored 'General case' 0 C--N 1.375 1.697 0 CA-C-N 120.761 1.619 . . . . 0.0 114.016 171.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.37 15.42 44.15 Favored Glycine 0 C--N 1.376 2.8 0 O-C-N 121.187 -0.945 . . . . 0.0 114.51 172.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.776 HG22 HD23 ' A' ' 81' ' ' LEU . 7.5 p -99.98 179.37 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 126.379 1.872 . . . . 0.0 107.026 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.82 ' HB3' HD21 ' A' ' 81' ' ' LEU 0.27 32.5 t -83.56 155.71 23.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 124.676 2.179 . . . . 0.0 110.957 167.444 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.9 m -92.89 130.1 38.59 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.935 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.436 ' CE2' HG12 ' A' ' 29' ' ' ILE . 5.0 p90 -113.41 152.73 29.66 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 129.09 2.956 . . . . 0.0 105.704 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -101.5 161.35 13.7 Favored 'General case' 0 C--N 1.354 0.795 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -121.41 120.3 34.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.146 -1.596 . . . . 0.0 111.281 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.55 141.46 51.36 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.768 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 4.3 m-85 -101.48 150.16 23.33 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.892 1.277 . . . . 0.0 108.871 172.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.4 m -123.06 85.78 2.48 Favored 'General case' 0 C--N 1.349 0.587 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 165.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.415 ' HG2' ' H ' ' A' ' 47' ' ' GLN . 4.7 mm-40 -48.24 -10.9 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 121.217 3.784 . . . . 0.0 121.217 -168.034 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.68 -37.55 79.09 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 125.948 3.976 . . . . 0.0 116.166 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.799 HD13 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -68.28 -43.38 77.86 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-O 125.968 2.794 . . . . 0.0 111.132 171.458 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.799 ' H ' HD13 ' A' ' 49' ' ' LEU . 2.7 tt -64.11 -38.72 92.07 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 118.62 -2.55 . . . . 0.0 109.533 176.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -60.43 -32.46 71.38 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 129.621 3.168 . . . . 0.0 109.585 171.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 78.0 mtm180 -63.02 -47.12 84.42 Favored 'General case' 0 C--N 1.391 2.383 0 O-C-N 120.357 -1.464 . . . . 0.0 113.625 161.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -28.59 68.47 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.581 HD12 ' CD2' ' A' ' 50' ' ' LEU 0.336 0.1 OUTLIER -70.3 -39.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 131.698 3.999 . . . . 0.0 111.179 179.299 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.4 mt-30 -107.39 -26.48 10.96 Favored 'General case' 0 C--N 1.372 1.559 0 N-CA-C 117.24 2.311 . . . . 0.0 117.24 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -83.5 -18.6 37.92 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.801 2.091 . . . . 0.0 113.933 -175.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 140' ' ' ARG . 1.9 mp0 -115.21 -67.68 0.98 Allowed 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 127.528 2.331 . . . . 0.0 109.085 166.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.661 ' HA ' HD12 ' A' ' 14' ' ' LEU 0.487 0.3 OUTLIER 74.91 135.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.429 -1.419 . . . . 0.0 111.121 -173.477 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.543 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 21.6 t70 44.88 45.19 8.4 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 130.922 3.689 . . . . 0.0 114.77 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.514 ' HG2' HD11 ' A' ' 14' ' ' LEU 0.399 10.4 pt-20 -74.33 62.26 0.95 Allowed 'General case' 0 CA--C 1.491 -1.308 0 C-N-CA 129.632 3.173 . . . . 0.0 114.436 179.43 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.39 14.0 p -79.0 -20.94 47.82 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.862 2.865 . . . . 0.0 113.18 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.523 ' CD2' HD21 ' A' ' 141' ' ' LEU . 5.9 t80 -64.21 -33.35 75.61 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.726 2.01 . . . . 0.0 111.151 166.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.5 HG23 HD13 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -57.62 -46.48 86.42 Favored 'Isoleucine or valine' 0 C--N 1.37 1.466 0 C-N-CA 128.846 2.858 . . . . 0.0 109.392 -175.674 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.654 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 45.9 m-85 -61.68 -45.39 94.19 Favored 'General case' 0 CA--C 1.495 -1.171 1 C-N-CA 134.184 4.994 . . . . 0.0 112.65 169.527 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -66.12 -44.62 83.76 Favored 'General case' 0 C--N 1.35 0.597 0 CA-C-N 122.001 2.182 . . . . 0.0 114.503 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.717 ' HG ' HD21 ' A' ' 111' ' ' LEU . 1.4 tm? -63.09 -50.46 70.45 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.36 1.864 . . . . 0.0 114.177 166.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.429 ' CZ ' HG13 ' A' ' 63' ' ' VAL 0.742 0.0 OUTLIER -76.7 -29.15 56.16 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 118.979 -2.326 . . . . 0.0 111.59 -175.829 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.402 ' HD2' ' OE1' ' A' ' 28' ' ' GLU . 24.9 m80 -64.17 -28.17 69.57 Favored 'General case' 0 C--N 1.367 1.353 0 C-N-CA 125.489 1.515 . . . . 0.0 112.147 162.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -77.27 -26.66 52.67 Favored 'General case' 0 C--N 1.377 1.786 0 O-C-N 121.214 -0.929 . . . . 0.0 112.017 171.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.322 0.0 OUTLIER -88.13 -44.29 15.68 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 C-N-CA 126.353 1.861 . . . . 0.0 115.054 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.553 9.1 mmpt? -49.02 0.21 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 1 C-N-CA 137.194 6.197 . . . . 0.0 120.365 -178.129 . . . . . . . . 3 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.62 -24.04 67.46 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 131.033 3.733 . . . . 0.0 107.859 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.413 ' NE2' ' HB2' ' A' ' 153' ' ' GLN . 0.1 OUTLIER -42.07 1.55 0.0 OUTLIER 'General case' 0 C--N 1.389 2.315 1 C-N-CA 139.394 7.078 . . . . 0.0 119.207 176.659 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.485 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 46.2 t -50.03 -49.22 22.21 Favored 'Isoleucine or valine' 0 CA--C 1.461 -2.463 1 C-N-CA 135.864 5.666 . . . . 0.0 107.382 170.486 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.49 ' H ' HD22 ' A' ' 75' ' ' LEU . 1.7 mm? -58.88 -29.26 66.88 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 117.468 2.395 . . . . 0.0 117.468 176.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -75.19 -50.84 14.96 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 127.523 2.329 . . . . 0.0 112.634 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.372 14.6 p -66.93 -29.55 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.043 0 C-N-CA 127.631 2.373 . . . . 0.0 111.545 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.485 ' HB3' ' O ' ' A' ' 74' ' ' VAL . 8.0 t-20 -75.11 -32.75 61.49 Favored 'General case' 0 C--N 1.365 1.255 1 C-N-CA 132.322 4.249 . . . . 0.0 112.826 169.135 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . 0.356 6.7 pt-20 -67.74 -29.81 69.13 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 122.407 2.367 . . . . 0.0 110.034 169.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -66.47 -47.66 72.37 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 163.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.82 HD21 ' HB3' ' A' ' 39' ' ' SER 0.381 15.9 tp -71.96 -11.16 60.65 Favored 'General case' 0 C--N 1.373 1.595 0 C-N-CA 130.011 3.325 . . . . 0.0 119.762 176.773 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.9 m -65.83 3.48 0.78 Allowed 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 128.223 2.609 . . . . 0.0 117.975 -175.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 46.0 ttp -124.21 163.13 37.82 Favored Pre-proline 0 CA--C 1.567 1.624 0 C-N-CA 128.818 2.847 . . . . 0.0 106.411 174.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -65.24 -175.64 0.42 Allowed 'Trans proline' 0 C--N 1.38 2.187 1 C-N-CA 128.894 6.396 . . . . 0.0 111.449 167.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.27 134.9 38.49 Favored 'Trans proline' 0 C--N 1.392 2.822 2 CA-C-N 134.767 6.31 . . . . 0.0 112.422 175.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.401 ' HD2' HG12 ' A' ' 94' ' ' ILE 0.364 25.5 ttp180 -25.48 -55.22 0.18 Allowed Pre-proline 0 C--N 1.35 0.619 0 C-N-CA 129.554 3.142 . . . . 0.0 118.487 -174.122 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -65.02 141.46 70.42 Favored 'Trans proline' 0 CA--C 1.542 0.891 1 C-N-CA 126.526 4.817 . . . . 0.0 121.63 168.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.456 ' H ' HD12 ' A' ' 89' ' ' ILE . 2.9 m-20 -109.28 -22.51 12.04 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.96 2.904 . . . . 0.0 111.561 169.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.568 HD13 ' N ' ' A' ' 93' ' ' PHE . 0.4 OUTLIER -132.85 -168.2 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.519 1 C-N-CA 135.702 5.601 . . . . 0.0 108.067 -174.613 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -110.61 -18.7 13.11 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 169.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.435 ' H ' ' HB ' ' A' ' 89' ' ' ILE . 16.3 pt-20 -103.75 -30.79 10.18 Favored 'General case' 0 C--N 1.365 1.281 1 N-CA-C 122.752 4.353 . . . . 0.0 122.752 -169.32 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -104.83 -5.99 20.65 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 120.543 -1.348 . . . . 0.0 110.794 -177.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.568 ' N ' HD13 ' A' ' 89' ' ' ILE 0.797 4.0 p90 25.39 -48.78 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.761 2 N-CA-C 125.412 5.338 . . . . 0.0 125.412 -172.195 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.51 ' CG2' HG12 ' A' ' 97' ' ' VAL . 19.3 mt -91.5 129.09 42.75 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.286 0 C-N-CA 129.314 3.045 . . . . 0.0 112.774 175.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -134.75 -56.07 0.83 Allowed 'General case' 0 CA--C 1.495 -1.144 0 CA-C-N 113.885 -1.507 . . . . 0.0 113.658 -175.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -109.21 29.54 9.54 Favored Glycine 0 CA--C 1.49 -1.473 0 N-CA-C 108.639 -1.784 . . . . 0.0 108.639 172.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.51 HG12 ' CG2' ' A' ' 94' ' ' ILE . 1.2 t -113.65 142.03 27.59 Favored 'Isoleucine or valine' 0 C--N 1.365 1.265 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 170.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -85.72 16.71 3.78 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 127.7 2.4 . . . . 0.0 116.564 -175.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.4 t80 68.06 41.59 1.99 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 128.004 2.522 . . . . 0.0 112.665 178.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -112.07 153.69 44.52 Favored Pre-proline 0 N--CA 1.447 -0.613 0 C-N-CA 127.649 2.38 . . . . 0.0 111.116 -173.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -78.12 170.57 18.5 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 125.163 3.909 . . . . 0.0 113.545 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.24 33.63 4.02 Favored Glycine 0 C--N 1.349 1.283 0 N-CA-C 118.164 2.026 . . . . 0.0 118.164 -175.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.2 ptt-85 -141.06 152.54 44.91 Favored 'General case' 0 N--CA 1.44 -0.974 0 O-C-N 121.067 -1.255 . . . . 0.0 109.024 177.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -109.24 125.84 52.68 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 126.37 1.868 . . . . 0.0 107.223 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -128.51 109.4 11.35 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.523 HD11 ' CZ ' ' A' ' 115' ' ' PHE . 9.7 pt -135.97 140.59 43.76 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 C-N-CA 125.235 1.414 . . . . 0.0 112.61 -174.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.419 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 2.7 m -111.57 121.85 46.24 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 119.871 -1.768 . . . . 0.0 108.73 173.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.708 ' HB2' HG22 ' A' ' 150' ' ' ILE . 42.1 t0 -139.19 171.77 13.8 Favored 'General case' 0 CA--C 1.504 -0.826 1 N-CA-C 100.093 -4.04 . . . . 0.0 100.093 177.411 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.75 -68.37 3.03 Favored Glycine 0 N--CA 1.475 1.288 0 O-C-N 118.033 -2.917 . . . . 0.0 113.378 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.612 HD21 HD11 ' A' ' 141' ' ' LEU . 0.1 OUTLIER 156.01 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.366 1.294 2 C-N-CA 134.324 5.05 . . . . 0.0 109.474 -152.609 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.717 HD21 ' HG ' ' A' ' 66' ' ' LEU 0.476 1.1 pt? -78.22 137.4 38.11 Favored 'General case' 0 CA--C 1.507 -0.706 1 C-N-CA 134.978 5.311 . . . . 0.0 119.813 -177.543 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.34 100.66 13.42 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.435 HD11 ' CD1' ' A' ' 66' ' ' LEU 0.314 0.0 OUTLIER -94.84 127.78 41.1 Favored 'General case' 0 C--N 1.38 1.907 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 176.191 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -125.16 130.43 7.34 Favored Glycine 0 C--N 1.352 1.464 0 N-CA-C 106.138 -2.785 . . . . 0.0 106.138 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.523 ' CZ ' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -131.95 137.17 47.83 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.469 2.634 . . . . 0.0 105.671 178.384 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.0 m -124.99 102.05 7.34 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.841 1.655 . . . . 0.0 106.808 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.08 116.35 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 121.328 1.876 . . . . 0.0 107.276 172.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 1.6 m 3.66 104.58 0.0 OUTLIER 'General case' 0 C--N 1.38 1.921 0 C-N-CA 130.937 3.695 . . . . 0.0 117.677 -160.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.522 ' H ' ' HB2' ' A' ' 130' ' ' GLN . 34.4 ttpt -34.31 -44.25 0.56 Allowed Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 118.474 2.768 . . . . 0.0 118.474 -178.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -98.13 18.7 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.288 0 C-N-CA 123.47 2.78 . . . . 0.0 114.305 172.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.461 12.9 p30 -161.53 108.05 1.38 Allowed 'General case' 0 CA--C 1.562 1.417 0 N-CA-C 118.899 2.926 . . . . 0.0 118.899 -178.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -99.3 -45.05 6.0 Favored 'General case' 0 C--N 1.351 0.671 0 O-C-N 118.67 -2.519 . . . . 0.0 115.193 170.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.411 0.0 OUTLIER -40.2 -14.74 0.01 OUTLIER 'General case' 0 C--N 1.353 0.726 1 C-N-CA 136.278 5.831 . . . . 0.0 120.754 -172.347 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -110.46 -6.07 15.01 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.773 2.029 . . . . 0.0 113.073 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.552 ' HB2' HD13 ' A' ' 81' ' ' LEU 0.416 0.0 OUTLIER 64.65 -51.71 0.31 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 128.379 2.672 . . . . 0.0 117.567 176.341 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.283 2.5 p30 -64.03 -15.97 0.33 Allowed Pre-proline 0 CA--C 1.551 1.004 1 C-N-CA 132.08 4.152 . . . . 0.0 119.562 173.386 . . . . . . . . 3 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.358 39.7 Cg_exo -37.78 -176.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.486 1 C-N-CA 128.771 6.314 . . . . 0.0 121.008 166.464 . . . . . . . . 3 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.0 m -99.61 164.3 12.13 Favored 'General case' 0 CA--C 1.486 -1.518 0 N-CA-C 104.113 -2.551 . . . . 0.0 104.113 -173.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.3 mp -100.12 129.04 46.11 Favored 'General case' 0 C--N 1.348 0.505 0 N-CA-C 100.208 -3.997 . . . . 0.0 100.208 176.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.522 ' HB2' ' H ' ' A' ' 119' ' ' LYS . 0.6 OUTLIER -93.19 60.21 3.18 Favored 'General case' 0 C--N 1.364 1.198 0 C-N-CA 126.258 1.823 . . . . 0.0 107.635 -171.038 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.304 1.9 p 102.8 138.27 0.01 OUTLIER 'General case' 0 C--N 1.373 1.593 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 -171.113 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -114.87 133.69 55.76 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 100.796 -3.779 . . . . 0.0 100.796 163.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 7.7 ttp -109.29 120.36 42.27 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 127.263 2.225 . . . . 0.0 105.446 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.627 ' H ' HD21 ' A' ' 49' ' ' LEU . . . -127.71 116.16 19.83 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.0 mm -139.8 138.44 38.66 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 CA-C-N 119.341 0.973 . . . . 0.0 109.495 178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.621 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -127.68 169.03 19.74 Favored 'Isoleucine or valine' 0 C--N 1.349 0.583 0 C-N-CA 128.164 2.586 . . . . 0.0 108.022 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.512 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -100.33 123.64 44.81 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.13 2.972 . . . . 0.0 114.398 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.261 2.5 p 171.86 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 123.934 1.825 . . . . 0.0 115.424 175.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.0 -50.32 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 109.628 -3.442 . . . . 0.0 107.871 -155.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.485 ' HA ' ' O ' ' A' ' 57' ' ' GLU . 14.6 ptp180 175.74 73.81 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.564 0 CA-C-O 126.005 2.812 . . . . 0.0 104.081 -170.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.612 HD11 HD21 ' A' ' 110' ' ' ASN 0.285 0.0 OUTLIER -61.69 133.5 93.55 Favored Pre-proline 0 N--CA 1.447 -0.599 0 N-CA-C 117.764 2.505 . . . . 0.0 117.764 -162.62 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 141' ' ' LEU . 63.4 Cg_endo -83.65 -12.18 8.89 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.969 3.112 . . . . 0.0 112.837 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.431 ' HA2' ' CD1' ' A' ' 62' ' ' TYR . . . 104.85 92.36 2.26 Favored Glycine 0 CA--C 1.491 -1.434 0 C-N-CA 127.206 2.336 . . . . 0.0 112.382 -168.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -94.2 156.55 16.49 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-O 122.578 1.18 . . . . 0.0 111.911 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -142.01 110.31 5.99 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 127.717 2.407 . . . . 0.0 104.898 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 32.9 p -138.4 89.83 2.41 Favored 'General case' 0 CA--C 1.5 -0.967 0 C-N-CA 124.123 0.969 . . . . 0.0 113.431 -171.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.272 48.7 mmtm 78.82 -45.13 0.37 Allowed 'General case' 0 CA--C 1.505 -0.777 0 C-N-CA 129.601 3.16 . . . . 0.0 112.571 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 76.92 87.96 0.08 Allowed 'General case' 0 C--N 1.358 0.952 0 N-CA-C 116.548 2.055 . . . . 0.0 116.548 163.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . 0.382 15.8 t -58.49 -72.83 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.371 1.542 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 -174.199 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.708 HG22 ' HB2' ' A' ' 108' ' ' ASP 0.506 0.0 OUTLIER -87.81 147.22 5.41 Favored 'Isoleucine or valine' 0 C--N 1.349 0.576 0 C-N-CA 131.065 3.746 . . . . 0.0 116.488 -175.526 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.46 ' O ' HG23 ' A' ' 150' ' ' ILE 0.334 5.6 ptpt -78.02 149.6 33.99 Favored 'General case' 0 N--CA 1.423 -1.802 2 C-N-CA 138.292 6.637 . . . . 0.0 113.584 177.24 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 20.2 p -96.33 97.73 9.72 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 118.314 -2.741 . . . . 0.0 107.809 169.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.413 ' HB2' ' NE2' ' A' ' 73' ' ' HIS . 2.5 mt-30 . . . . . 0 C--O 1.257 1.472 1 C-N-CA 135.319 5.448 . . . . 0.0 109.155 174.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 ttt . . . . . 0 CA--C 1.529 0.139 0 CA-C-O 124.366 2.031 . . . . 0.0 111.753 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.5 175.46 8.8 Favored 'General case' 0 C--N 1.348 0.528 0 C-N-CA 128.268 2.627 . . . . 0.0 113.933 -176.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 12.6 mm -80.79 47.42 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.893 0 C-N-CA 128.406 2.682 . . . . 0.0 112.507 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.47 ' HA ' HG13 ' A' ' 7' ' ' VAL . 14.1 m120 -75.42 18.24 0.23 Allowed 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 131.598 3.959 . . . . 0.0 113.414 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -81.86 -62.56 1.6 Allowed 'General case' 0 C--N 1.348 0.516 1 C-N-CA 133.714 4.806 . . . . 0.0 110.3 176.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -71.29 -9.23 57.79 Favored 'General case' 0 C--N 1.368 1.387 0 C-N-CA 125.585 1.554 . . . . 0.0 112.279 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.47 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.286 0.7 OUTLIER -88.41 -28.45 5.38 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 C-N-CA 126.877 2.071 . . . . 0.0 108.969 174.368 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -72.86 -38.96 66.87 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 125.7 1.6 . . . . 0.0 108.688 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 28.8 mt -61.68 -44.52 98.85 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 C-N-CA 125.051 1.34 . . . . 0.0 110.636 165.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.314 0.6 OUTLIER -58.85 -48.91 79.7 Favored 'General case' 0 C--N 1.367 1.336 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 173.301 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -57.74 -34.11 69.17 Favored 'General case' 0 C--N 1.374 1.636 0 N-CA-C 118.835 2.902 . . . . 0.0 118.835 166.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -77.08 -49.28 15.66 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 128.141 2.576 . . . . 0.0 111.917 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -58.18 -29.28 65.51 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 130.04 3.336 . . . . 0.0 109.375 170.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.717 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -76.14 -37.56 57.84 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 169.832 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -58.45 -44.19 89.1 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.767 1.227 . . . . 0.0 111.419 166.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -62.85 -45.14 93.98 Favored 'General case' 0 C--N 1.382 2.019 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 166.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -42.92 80.85 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 129.542 3.137 . . . . 0.0 112.207 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.448 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -66.01 -54.41 26.34 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 128.509 2.724 . . . . 0.0 113.114 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -74.67 -36.03 62.81 Favored 'General case' 0 C--N 1.367 1.361 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.5 m -72.78 -40.81 65.63 Favored 'General case' 0 C--N 1.365 1.256 0 C-N-CA 125.958 1.703 . . . . 0.0 111.946 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.621 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.545 52.0 mt-10 -77.77 -29.92 51.19 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 119.982 -1.699 . . . . 0.0 114.066 169.519 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -59.32 -36.95 76.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 118.284 -2.76 . . . . 0.0 112.665 168.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.251 7.4 ptm180 -71.22 -33.35 69.8 Favored 'General case' 0 C--N 1.376 1.756 0 C-N-CA 124.031 0.933 . . . . 0.0 112.368 168.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -61.91 -48.22 81.41 Favored 'General case' 0 C--N 1.362 1.134 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 170.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.1 mt -72.33 -46.42 57.02 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 O-C-N 121.333 -0.855 . . . . 0.0 110.975 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.567 0.0 OUTLIER -74.23 -23.5 59.17 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 119.761 -1.837 . . . . 0.0 114.29 177.698 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -72.83 -32.78 65.73 Favored 'General case' 0 C--N 1.388 2.24 0 O-C-N 120.213 -1.554 . . . . 0.0 110.515 168.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.52 -40.73 85.1 Favored 'General case' 0 C--N 1.389 2.307 0 O-C-N 118.509 -2.619 . . . . 0.0 112.407 168.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.486 ' HB ' ' CZ ' ' A' ' 41' ' ' PHE 0.395 0.1 OUTLIER -64.77 -44.63 96.43 Favored 'Isoleucine or valine' 0 C--N 1.369 1.422 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 176.461 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -67.97 -38.84 83.23 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -76.51 -35.91 58.06 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 125.325 1.45 . . . . 0.0 111.463 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.8 -33.74 60.15 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 176.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.3 t -73.77 -37.3 65.04 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 125.512 1.525 . . . . 0.0 109.852 175.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp -68.66 -44.65 73.65 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 168.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.25 -30.47 64.91 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.094 1.758 . . . . 0.0 113.543 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.03 -17.53 60.49 Favored 'General case' 0 C--N 1.383 2.022 0 CA-C-N 119.307 0.958 . . . . 0.0 113.197 169.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.37 18.31 28.9 Favored Glycine 0 C--N 1.374 2.693 0 O-C-N 121.179 -0.95 . . . . 0.0 114.775 174.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.488 HG23 HD23 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -111.48 171.59 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 t -59.06 177.84 0.15 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 129.398 3.079 . . . . 0.0 115.979 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.6 m -96.86 126.39 41.97 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 125.689 1.596 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.486 ' CZ ' ' HB ' ' A' ' 29' ' ' ILE 0.286 41.8 p90 -113.6 141.02 47.69 Favored 'General case' 0 C--N 1.357 0.921 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 174.858 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -116.14 164.9 13.79 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 123.42 1.581 . . . . 0.0 113.326 -172.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -121.18 133.96 55.2 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.361 1.864 . . . . 0.0 113.872 -174.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -139.44 162.04 36.02 Favored 'General case' 0 C--N 1.37 1.496 0 N-CA-C 105.026 -2.212 . . . . 0.0 105.026 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.287 9.8 m-85 -125.31 161.34 27.19 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 126.688 1.995 . . . . 0.0 113.589 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.1 m -132.66 89.83 2.69 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 103.334 -2.839 . . . . 0.0 103.334 159.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' A' ' 51' ' ' ASP . 11.1 mp0 -47.45 -10.25 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 131.658 3.983 . . . . 0.0 118.354 -175.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.47 -37.12 56.39 Favored 'General case' 0 N--CA 1.503 2.212 1 CA-C-N 128.417 5.099 . . . . 0.0 119.201 -176.085 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.678 HD12 ' H ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -69.6 -41.37 75.82 Favored 'General case' 0 C--O 1.242 0.7 1 C-N-CA 134.415 5.086 . . . . 0.0 110.82 173.798 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.678 ' H ' HD12 ' A' ' 49' ' ' LEU 0.282 4.2 tt -74.8 -28.99 60.95 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 127.343 2.257 . . . . 0.0 110.707 171.011 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.473 ' HA ' HG22 ' A' ' 54' ' ' ILE . 10.1 t70 -68.05 -31.95 71.96 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 130.323 3.449 . . . . 0.0 108.165 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -70.99 -40.79 71.66 Favored 'General case' 0 C--N 1.373 1.594 0 O-C-N 119.874 -1.766 . . . . 0.0 114.984 160.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.22 62.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.597 ' HA ' HD12 ' A' ' 14' ' ' LEU . 2.7 tt -72.89 -35.9 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 1 C-N-CA 132.064 4.146 . . . . 0.0 110.828 178.292 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.498 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.2 mt-30 -108.63 -30.14 8.37 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 119.155 3.02 . . . . 0.0 119.155 171.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -88.91 -5.24 58.13 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 119.701 -1.875 . . . . 0.0 114.067 -172.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' A' ' 60' ' ' GLU . 2.9 tt0 -137.73 -64.58 0.54 Allowed 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 -178.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.498 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.697 0.0 OUTLIER 119.55 -28.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.374 1.659 0 N-CA-C 121.768 3.988 . . . . 0.0 121.768 167.37 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.717 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 31.1 t70 -147.37 80.34 1.51 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 130.735 3.614 . . . . 0.0 105.992 -170.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.554 ' O ' HG12 ' A' ' 63' ' ' VAL 0.54 12.5 pt-20 -79.77 59.1 3.0 Favored 'General case' 0 C--N 1.38 1.922 0 O-C-N 118.883 -2.386 . . . . 0.0 112.301 177.216 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.369 36.0 p -79.56 -21.66 44.81 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 129.816 3.247 . . . . 0.0 113.955 177.238 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -67.45 -30.24 69.92 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 130.643 3.577 . . . . 0.0 111.132 167.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.693 HG23 HD21 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -64.9 -44.68 96.17 Favored 'Isoleucine or valine' 0 C--N 1.367 1.328 0 C-N-CA 126.078 1.751 . . . . 0.0 110.579 178.773 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.621 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 59.5 m-85 -58.88 -43.33 90.91 Favored 'General case' 0 C--O 1.204 -1.293 1 C-N-CA 133.727 4.811 . . . . 0.0 111.542 170.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -67.57 -45.6 75.11 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 121.786 2.084 . . . . 0.0 115.954 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.66 ' CD2' ' HA3' ' A' ' 109' ' ' GLY . 2.8 tm? -62.19 -49.21 76.72 Favored 'General case' 0 CA--C 1.57 1.738 0 O-C-N 119.198 -2.189 . . . . 0.0 112.315 169.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.645 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.859 0.0 OUTLIER -77.49 -16.28 58.82 Favored 'General case' 0 C--N 1.379 1.869 0 O-C-N 118.923 -2.361 . . . . 0.0 115.078 -178.657 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . 0.295 22.7 m80 -75.65 -23.13 56.28 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.437 2.295 . . . . 0.0 109.896 163.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.44 71.6 mmtt -75.47 -40.19 57.67 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 114.767 -2.773 . . . . 0.0 114.28 153.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.523 HD13 ' OXT' ' A' ' 153' ' ' GLN . 16.1 mm -53.63 -25.87 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 C-N-CA 129.643 3.177 . . . . 0.0 115.126 175.059 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -52.91 -26.1 13.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 C-N-CA 131.056 3.742 . . . . 0.0 118.209 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -101.3 2.89 40.22 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 125.282 1.433 . . . . 0.0 107.551 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 151' ' ' LYS 0.279 94.3 m-70 -86.17 13.22 8.19 Favored 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.622 2.769 . . . . 0.0 112.177 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.497 ' HB ' HD22 ' A' ' 75' ' ' LEU . 78.6 t -39.16 -55.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.576 1 C-N-CA 133.334 4.654 . . . . 0.0 109.55 157.368 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.497 HD22 ' HB ' ' A' ' 74' ' ' VAL . 3.6 mm? -58.59 -28.52 65.66 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.546 2.338 . . . . 0.0 115.996 176.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -75.47 -44.78 42.27 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 125.319 1.448 . . . . 0.0 112.23 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.415 HG21 ' CE2' ' A' ' 41' ' ' PHE 0.341 0.3 OUTLIER -67.83 -32.11 55.1 Favored 'Isoleucine or valine' 0 C--N 1.371 1.54 0 CA-C-O 124.338 2.018 . . . . 0.0 112.684 175.56 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -74.98 -39.49 61.25 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 129.883 3.273 . . . . 0.0 114.319 173.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.41 -29.2 70.53 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-N 120.694 1.588 . . . . 0.0 112.191 166.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -70.74 -32.08 69.13 Favored 'General case' 0 CA--C 1.58 2.098 0 C-N-CA 126.046 1.739 . . . . 0.0 114.485 167.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.509 HD22 ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -69.27 -45.76 68.87 Favored 'General case' 0 N--CA 1.51 2.566 0 C-N-CA 128.814 2.846 . . . . 0.0 112.239 169.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.2 m -66.13 3.27 0.9 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 130.097 3.359 . . . . 0.0 119.327 -165.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 27.8 ptm -83.86 165.56 38.78 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 124.691 1.196 . . . . 0.0 112.456 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -65.39 171.99 8.44 Favored 'Trans proline' 0 C--N 1.372 1.766 0 C-N-CA 124.951 3.768 . . . . 0.0 110.942 168.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -54.65 155.48 17.23 Favored 'Trans proline' 0 C--N 1.361 1.186 0 C-N-CA 125.183 3.922 . . . . 0.0 115.475 -167.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.45 ' CD ' HD12 ' A' ' 94' ' ' ILE 0.28 0.0 OUTLIER -70.07 -60.08 3.82 Favored Pre-proline 0 N--CA 1.483 1.211 0 O-C-N 120.502 -1.374 . . . . 0.0 112.851 -178.263 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -58.73 162.6 12.61 Favored 'Trans proline' 0 N--CA 1.454 -0.811 2 C-N-CA 126.002 4.468 . . . . 0.0 122.696 172.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 121.88 -6.3 0.0 OUTLIER 'General case' 0 C--N 1.372 1.55 3 C-N-CA 145.41 9.484 . . . . 0.0 101.142 -169.609 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.481 HG22 ' H ' ' A' ' 90' ' ' ASP 0.504 0.4 OUTLIER 105.3 161.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.382 1.999 1 C-N-CA 141.659 7.984 . . . . 0.0 114.124 163.096 . . . . . . . . 5 4 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASP . . . . . 0.481 ' H ' HG22 ' A' ' 89' ' ' ILE . 3.9 t70 -60.14 -11.52 6.29 Favored 'General case' 0 CA--C 1.553 1.063 0 O-C-N 118.099 -2.875 . . . . 0.0 114.433 170.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -93.87 -34.4 13.14 Favored 'General case' 0 C--N 1.358 0.962 0 C-N-CA 129.996 3.318 . . . . 0.0 115.21 167.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.59 -2.27 8.42 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 116.905 2.187 . . . . 0.0 116.905 -176.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -115.37 -49.78 2.75 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 116.826 2.158 . . . . 0.0 116.826 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.45 HD12 ' CD ' ' A' ' 86' ' ' ARG . 0.2 OUTLIER -77.51 137.71 21.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 -169.477 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -163.83 -37.74 0.03 OUTLIER 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 111.91 -2.405 . . . . 0.0 109.18 -170.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -91.47 21.44 35.39 Favored Glycine 0 C--N 1.366 2.229 0 C-N-CA 124.885 1.231 . . . . 0.0 112.855 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.411 HG11 HD13 ' A' ' 94' ' ' ILE 0.256 4.0 p -101.89 98.05 6.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-O 124.298 1.999 . . . . 0.0 110.531 179.822 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -88.27 7.08 33.89 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.25 3.02 . . . . 0.0 114.51 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -117.42 166.8 11.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 112.041 -2.345 . . . . 0.0 109.764 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -90.38 162.58 33.94 Favored Pre-proline 0 C--N 1.357 0.923 0 C-N-CA 125.225 1.41 . . . . 0.0 112.149 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -65.24 147.56 88.07 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 124.636 3.557 . . . . 0.0 116.193 178.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 63.98 -50.84 0.08 OUTLIER Glycine 0 C--N 1.357 1.714 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 162.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -128.87 159.56 35.41 Favored 'General case' 0 CA--C 1.501 -0.91 0 CA-C-O 123.931 1.824 . . . . 0.0 113.265 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.5 128.8 53.77 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.311 2.645 . . . . 0.0 104.647 174.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -129.78 131.86 46.36 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 103.526 -2.768 . . . . 0.0 103.526 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.511 HD12 HD12 ' A' ' 70' ' ' ILE . 2.8 mt -131.54 133.37 61.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.886 0 C-N-CA 126.487 1.915 . . . . 0.0 108.266 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.6 HG21 ' HA ' ' A' ' 148' ' ' ALA . 1.6 m -134.1 115.51 14.35 Favored 'General case' 0 C--N 1.353 0.743 0 O-C-N 120.72 -1.237 . . . . 0.0 110.615 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 176.14 -173.2 0.09 Allowed 'General case' 0 C--N 1.365 1.274 0 N-CA-C 100.217 -3.994 . . . . 0.0 100.217 173.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.66 ' HA3' ' CD2' ' A' ' 66' ' ' LEU . . . 72.6 9.23 73.77 Favored Glycine 1 CA--C 1.44 -4.597 0 O-C-N 118.285 -2.759 . . . . 0.0 117.29 175.375 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.542 ' O ' HG22 ' A' ' 136' ' ' ILE . 1.5 m-80 70.61 9.24 6.84 Favored 'General case' 0 C--N 1.377 1.781 0 C-N-CA 128.624 2.77 . . . . 0.0 110.876 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.693 HD21 HG23 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -120.56 130.33 54.16 Favored 'General case' 0 N--CA 1.44 -0.946 1 C-N-CA 134.45 5.1 . . . . 0.0 114.601 -164.587 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 112' ' ' TRP . . . . . 0.454 ' CE3' ' HA ' ' A' ' 146' ' ' SER . 9.8 m95 -112.51 100.15 8.52 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 101.065 -3.68 . . . . 0.0 101.065 174.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.296 1.3 pt? -107.51 138.59 43.45 Favored 'General case' 0 C--N 1.368 1.381 0 O-C-N 120.554 -1.341 . . . . 0.0 109.894 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.76 142.35 13.44 Favored Glycine 0 C--N 1.355 1.616 0 N-CA-C 107.452 -2.259 . . . . 0.0 107.452 172.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.45 132.36 44.23 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 104.636 -2.357 . . . . 0.0 104.636 176.395 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.4 m -109.97 108.94 19.36 Favored 'General case' 0 C--N 1.367 1.342 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.403 HG13 ' CB ' ' A' ' 127' ' ' PRO . 1.0 OUTLIER -75.03 105.31 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 C-N-CA 127.827 2.451 . . . . 0.0 111.663 -176.655 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 16.7 m 42.83 72.58 0.17 Allowed 'General case' 0 C--N 1.368 1.408 0 C-N-CA 129.831 3.252 . . . . 0.0 115.282 -170.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.363 37.9 ttpt -30.81 -62.04 0.25 Allowed Pre-proline 0 C--N 1.361 1.095 1 C-N-CA 132.275 4.23 . . . . 0.0 118.768 -171.924 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -71.84 66.97 3.17 Favored 'Trans proline' 0 CA--C 1.556 1.621 0 C-N-CA 125.087 3.858 . . . . 0.0 111.039 169.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.345 7.9 m120 -36.53 149.73 0.02 OUTLIER 'General case' 0 C--N 1.363 1.153 2 N-CA-C 125.615 5.413 . . . . 0.0 125.615 -170.012 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -162.65 -46.23 0.04 OUTLIER 'General case' 0 C--N 1.358 0.955 0 C-N-CA 130.91 3.684 . . . . 0.0 113.96 -174.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.353 0.0 OUTLIER 75.54 100.27 0.07 Allowed 'General case' 0 N--CA 1.424 -1.763 1 C-N-CA 133.185 4.594 . . . . 0.0 113.246 -178.833 . . . . . . . . 4 3 . 1 . 015 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -105.62 16.68 25.01 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 117.86 2.541 . . . . 0.0 117.86 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.72 0.0 OUTLIER 19.86 55.11 0.01 OUTLIER 'General case' 0 C--N 1.366 1.289 0 N-CA-C 121.292 3.812 . . . . 0.0 121.292 174.17 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.509 ' HA ' HD22 ' A' ' 81' ' ' LEU . 44.9 m-20 170.59 46.42 0.0 OUTLIER Pre-proline 0 CA--C 1.568 1.667 1 C-N-CA 140.319 7.448 . . . . 0.0 105.785 -172.889 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.43 ' CD ' ' H ' ' A' ' 126' ' ' ASP . 13.7 Cg_exo -92.56 -179.25 1.03 Allowed 'Trans proline' 0 C--N 1.361 1.205 0 CA-C-N 127.349 3.66 . . . . 0.0 118.951 -158.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 12.1 p -124.62 150.08 46.39 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.675 -2.342 . . . . 0.0 104.675 174.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 mp -101.82 130.34 48.24 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 102.174 -3.269 . . . . 0.0 102.174 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -114.62 45.72 1.51 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 119.949 -1.72 . . . . 0.0 109.364 -170.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' CYS . . . . . 0.437 ' SG ' HD21 ' A' ' 49' ' ' LEU . 45.4 t 141.81 126.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.522 0 C-N-CA 128.201 2.6 . . . . 0.0 105.194 -170.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -115.36 111.47 20.9 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 102.583 -3.117 . . . . 0.0 102.583 165.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 4.5 ttt -99.43 121.22 40.83 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.03 3.332 . . . . 0.0 108.505 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ALA . . . . . 0.486 ' HB1' HG21 ' A' ' 63' ' ' VAL . . . -128.69 116.44 19.55 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.56 1.544 . . . . 0.0 109.174 178.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 144' ' ' LYS . 11.5 mm -136.03 128.29 45.59 Favored 'Isoleucine or valine' 0 C--N 1.365 1.252 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 176.299 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.542 HG22 ' O ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -103.88 171.39 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 C-N-CA 127.723 2.409 . . . . 0.0 108.61 -179.079 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.72 -178.78 5.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.148 1.779 . . . . 0.0 106.398 163.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.744 52.6 p -65.24 75.8 0.06 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 117.644 2.461 . . . . 0.0 117.644 175.02 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.535 ' CD ' ' H ' ' A' ' 141' ' ' LEU . 0.0 OUTLIER -71.83 -21.49 61.68 Favored 'General case' 0 C--N 1.377 1.772 0 CA-C-N 110.989 -2.823 . . . . 0.0 106.614 148.891 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 139' ' ' ARG 0.402 70.6 mtt85 165.8 -45.86 0.0 OUTLIER 'General case' 0 CA--C 1.473 -2.009 1 C-N-CA 144.85 9.26 . . . . 0.0 114.218 -179.217 . . . . . . . . 4 3 . 1 . 015 nuclear build full ' A' A ' 141' ' ' LEU . . . . . 0.535 ' H ' ' CD ' ' A' ' 139' ' ' ARG 0.262 0.1 OUTLIER -41.82 103.92 0.33 Allowed Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 129.298 3.039 . . . . 0.0 117.513 -175.756 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -80.09 97.35 1.05 Allowed 'Trans proline' 0 C--N 1.304 -1.775 0 C-N-CA 124.442 3.428 . . . . 0.0 110.841 171.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -175.92 -99.08 0.12 Allowed Glycine 0 N--CA 1.464 0.52 0 N-CA-C 118.858 2.303 . . . . 0.0 118.858 -174.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 0.515 ' H ' HG22 ' A' ' 135' ' ' ILE 0.407 6.9 tttt 65.01 159.44 0.11 Allowed 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 120.383 3.475 . . . . 0.0 120.383 -173.115 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -141.73 -147.39 0.21 Allowed 'General case' 0 C--N 1.373 1.613 0 C-N-CA 127.458 2.303 . . . . 0.0 110.863 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.454 ' HA ' ' CE3' ' A' ' 112' ' ' TRP . 6.2 t -158.3 177.88 10.78 Favored 'General case' 0 C--N 1.376 1.75 0 O-C-N 119.418 -2.051 . . . . 0.0 111.945 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.29 84.1 tttt 153.64 -45.03 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.942 1 C-N-CA 133.599 4.76 . . . . 0.0 110.879 176.79 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.6 ' HA ' HG21 ' A' ' 107' ' ' THR . . . 87.05 6.68 0.27 Allowed 'General case' 0 C--N 1.354 0.79 0 N-CA-C 121.303 3.816 . . . . 0.0 121.303 168.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 3.4 t -140.15 144.06 28.6 Favored 'Isoleucine or valine' 0 C--N 1.375 1.714 0 CA-C-N 122.452 2.387 . . . . 0.0 115.801 -177.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.666 HD13 ' O ' ' A' ' 151' ' ' LYS 0.396 0.1 OUTLIER -130.31 144.9 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.646 2 N-CA-C 122.548 4.277 . . . . 0.0 122.548 -177.38 . . . . . . . . 5 4 . 1 . 015 nuclear build full ' A' A ' 151' ' ' LYS . . . . . 0.666 ' O ' HD13 ' A' ' 150' ' ' ILE . 0.0 OUTLIER -94.16 149.55 21.13 Favored 'General case' 0 CA--C 1.48 -1.744 2 C-N-CA 146.004 9.722 . . . . 0.0 97.652 167.87 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.584 ' O ' HG23 ' A' ' 152' ' ' THR 0.322 11.3 t -76.1 96.14 3.78 Favored 'General case' 0 CA--C 1.575 1.93 3 CA-C-O 130.563 4.982 . . . . 0.0 122.666 -162.49 . . . . . . . . 4 3 . 1 . 015 nuclear build full ' A' A ' 153' ' ' GLN . . . . . 0.546 ' HA ' HD12 ' A' ' 150' ' ' ILE 0.481 0.0 OUTLIER . . . . . 0 N--CA 1.381 -3.913 2 C-N-CA 136.099 5.759 . . . . 0.0 117.524 166.591 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.455 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 2.3 t-20 . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 117.743 2.497 . . . . 0.0 117.743 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -58.76 6.66 Favored 'General case' 0 N--CA 1.445 -0.715 1 C-N-CA 132.95 4.5 . . . . 0.0 112.274 169.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.84 -25.87 62.14 Favored 'General case' 0 C--N 1.37 1.469 0 C-N-CA 126.907 2.083 . . . . 0.0 113.065 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.455 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.9 OUTLIER -77.01 -39.52 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.947 0 C-N-CA 129.721 3.208 . . . . 0.0 112.551 176.698 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.431 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 27.3 t80 -65.36 -45.05 85.69 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 129.039 2.935 . . . . 0.0 109.611 175.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.3 -43.73 86.72 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 126.625 1.97 . . . . 0.0 110.99 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.651 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.257 9.2 ttp-105 -66.34 -47.32 73.84 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.431 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.8 mtm180 -61.17 -27.63 68.55 Favored 'General case' 0 C--N 1.377 1.762 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 167.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -77.12 -48.75 16.89 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 128.691 2.796 . . . . 0.0 110.139 173.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.606 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 27.6 mmtt -57.8 -28.44 64.02 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 127.529 2.331 . . . . 0.0 110.573 169.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 58' ' ' ILE . 0.3 OUTLIER -66.68 -49.07 67.31 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.519 166.271 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.416 ' HB2' HD11 ' A' ' 54' ' ' ILE . 39.2 ttt85 -55.81 -34.68 65.55 Favored 'General case' 0 C--N 1.353 0.742 0 CA-C-N 121.15 1.795 . . . . 0.0 115.21 169.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.606 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.289 0.1 OUTLIER -73.7 -37.04 65.31 Favored 'General case' 0 C--N 1.386 2.17 0 O-C-N 120.065 -1.647 . . . . 0.0 113.812 170.088 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.13 -44.27 97.59 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 129.063 2.945 . . . . 0.0 111.041 172.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.508 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -61.17 -52.59 64.18 Favored 'General case' 0 C--N 1.371 1.508 1 C-N-CA 132.003 4.121 . . . . 0.0 110.315 175.598 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -74.56 -39.53 62.22 Favored 'General case' 0 C--N 1.373 1.608 0 N-CA-C 118.218 2.673 . . . . 0.0 118.218 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -73.16 -40.52 64.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.024 1.73 . . . . 0.0 112.18 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.307 4.1 mp0 -75.95 -28.92 58.12 Favored 'General case' 0 C--N 1.355 0.812 0 O-C-N 118.637 -2.539 . . . . 0.0 110.41 171.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.339 0.3 OUTLIER -65.18 -31.21 72.27 Favored 'General case' 0 C--N 1.384 2.077 0 O-C-N 119.824 -1.797 . . . . 0.0 113.688 166.956 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.394 0.0 OUTLIER -66.36 -35.49 80.49 Favored 'General case' 0 C--N 1.382 2.02 0 CA-C-N 119.033 0.833 . . . . 0.0 111.8 166.604 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.519 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 47.2 tt0 -62.55 -45.02 94.85 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 169.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.488 HG12 ' CE1' ' A' ' 68' ' ' HIS . 3.1 mt -69.77 -43.48 79.88 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 O-C-N 120.617 -1.302 . . . . 0.0 113.06 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER -70.34 -26.49 63.77 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 119.379 0.991 . . . . 0.0 113.004 176.205 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -69.41 -39.78 77.72 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 121.109 -0.994 . . . . 0.0 110.166 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.401 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.492 0.0 OUTLIER -67.07 -35.01 78.9 Favored 'General case' 0 C--N 1.403 2.911 0 CA-C-N 120.405 1.457 . . . . 0.0 113.21 168.575 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.402 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.7 mt -61.92 -44.73 99.29 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 120.797 1.635 . . . . 0.0 114.702 174.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -59.96 -47.31 86.31 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 172.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -77.34 -37.45 52.41 Favored 'General case' 0 C--N 1.372 1.553 0 C-N-CA 125.165 1.386 . . . . 0.0 114.265 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.609 ' CB ' HG11 ' A' ' 74' ' ' VAL . . . -80.35 -34.01 36.87 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-O 121.638 0.732 . . . . 0.0 112.409 -178.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.6 t -71.35 -36.15 71.41 Favored 'General case' 0 C--N 1.365 1.245 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 42.2 mmtt -64.14 -42.42 96.8 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 167.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.38 -32.11 66.14 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 126.881 2.073 . . . . 0.0 113.936 176.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.32 -19.36 58.3 Favored 'General case' 0 C--N 1.375 1.692 0 C-N-CA 125.382 1.473 . . . . 0.0 111.94 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.03 17.7 31.5 Favored Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.272 0.869 . . . . 0.0 115.272 171.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.561 HG23 HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -123.76 147.18 28.24 Favored 'Isoleucine or valine' 0 C--N 1.358 0.974 0 CA-C-O 123.544 1.64 . . . . 0.0 108.998 -178.249 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.498 ' HB2' HD11 ' A' ' 81' ' ' LEU 0.277 10.0 t 5.8 -79.88 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.302 1 C-N-CA 132.715 4.406 . . . . 0.0 119.736 -173.777 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.0 m 121.71 124.27 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.689 2 N-CA-C 98.863 -4.495 . . . . 0.0 98.863 -169.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.454 ' CZ ' HG22 ' A' ' 77' ' ' VAL . 10.7 p90 -113.24 142.54 45.69 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -100.7 126.63 47.24 Favored 'General case' 0 C--N 1.361 1.103 0 C-N-CA 125.758 1.623 . . . . 0.0 108.039 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 HD22 ' A' ' 129' ' ' LEU . 0.1 OUTLIER -95.78 128.29 42.53 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.838 -173.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -139.34 143.97 38.03 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 101.994 -3.335 . . . . 0.0 101.994 177.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.533 ' CE1' HD13 ' A' ' 50' ' ' LEU . 2.4 p90 -131.09 154.39 48.33 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.61 118.79 28.51 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 127.26 2.224 . . . . 0.0 107.585 173.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.446 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.502 0.0 OUTLIER -68.39 -10.32 54.33 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 129.224 3.01 . . . . 0.0 116.936 -174.404 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.64 -41.29 27.3 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 128.09 2.556 . . . . 0.0 111.489 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 133' ' ' MET . 0.1 OUTLIER -59.42 -47.7 84.45 Favored 'General case' 0 C--N 1.375 1.675 0 CA-C-O 127.738 3.637 . . . . 0.0 109.102 170.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.533 HD13 ' CE1' ' A' ' 45' ' ' TYR 0.279 7.0 tt -74.11 -31.58 62.84 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-N 110.567 -3.015 . . . . 0.0 111.116 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -62.34 -34.33 76.44 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 125.821 1.648 . . . . 0.0 109.537 170.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -62.63 -47.86 81.91 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.53 -1.356 . . . . 0.0 113.232 167.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.48 -27.26 65.99 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 117.885 2.55 . . . . 0.0 117.885 171.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.499 HD12 ' CD2' ' A' ' 50' ' ' LEU 0.302 0.1 OUTLIER -73.68 -42.93 54.87 Favored 'Isoleucine or valine' 0 C--N 1.347 0.496 0 C-N-CA 129.52 3.128 . . . . 0.0 110.884 178.975 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -103.2 -26.83 12.84 Favored 'General case' 0 C--N 1.38 1.912 0 N-CA-C 117.079 2.251 . . . . 0.0 117.079 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -87.44 -29.14 21.66 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 119.456 -2.028 . . . . 0.0 111.426 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -124.97 44.05 2.88 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 128.392 2.677 . . . . 0.0 107.491 -172.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.651 HD11 ' HE ' ' A' ' 10' ' ' ARG 0.393 0.5 OUTLIER -56.19 134.32 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 C-N-CA 125.986 1.714 . . . . 0.0 112.419 -177.331 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.494 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 24.9 t70 57.54 21.21 6.85 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 130.822 3.649 . . . . 0.0 113.202 -173.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.463 0.7 OUTLIER -73.97 80.52 1.68 Allowed 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.863 2.865 . . . . 0.0 109.626 170.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.3 p -82.06 -26.59 33.56 Favored 'General case' 0 N--CA 1.437 -1.089 2 C-N-CA 141.404 7.882 . . . . 0.0 110.92 162.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.94 -33.32 71.75 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 128.008 2.523 . . . . 0.0 109.582 172.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.557 ' HA ' HD22 ' A' ' 111' ' ' LEU . 3.2 t -43.18 -57.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.993 1 C-N-CA 132.455 4.302 . . . . 0.0 111.572 165.195 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 47.8 m-85 -62.5 -36.74 83.5 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 131.452 3.901 . . . . 0.0 113.468 172.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -72.98 -45.29 58.82 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 126.259 1.823 . . . . 0.0 111.607 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.576 HD13 HD13 ' A' ' 70' ' ' ILE . 3.2 tm? -63.19 -38.44 91.17 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.559 1.544 . . . . 0.0 113.268 169.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.682 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.974 0.0 OUTLIER -78.27 -17.48 56.6 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 117.742 2.497 . . . . 0.0 117.742 170.739 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.519 ' CE1' ' HB3' ' A' ' 24' ' ' GLN . 25.4 m-70 -84.51 -19.13 33.74 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 129.014 2.926 . . . . 0.0 109.682 171.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.61 ' O ' HG21 ' A' ' 152' ' ' THR . 48.6 mmtm -93.74 -27.34 16.55 Favored 'General case' 0 C--N 1.364 1.223 0 C-N-CA 126.434 1.894 . . . . 0.0 107.895 168.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.682 ' HB ' ' HA ' ' A' ' 67' ' ' PHE 0.356 0.9 OUTLIER -74.98 -12.13 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 C-N-CA 129.787 3.235 . . . . 0.0 112.684 178.327 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HB2' ' CD ' ' A' ' 28' ' ' GLU 0.313 19.2 ptmt -49.49 -35.32 19.45 Favored 'General case' 0 N--CA 1.428 -1.542 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 -169.26 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.276 26.6 m-20 -78.77 -15.05 58.9 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 127.448 2.299 . . . . 0.0 108.565 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.716 ' CD2' ' HA ' ' A' ' 152' ' ' THR 0.373 0.0 OUTLIER -66.8 -7.08 18.82 Favored 'General case' 0 C--N 1.379 1.859 0 C-N-CA 129.173 2.989 . . . . 0.0 109.379 167.62 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.609 HG11 ' CB ' ' A' ' 32' ' ' ALA . 13.0 p -43.57 -38.66 1.18 Allowed 'Isoleucine or valine' 1 C--N 1.428 4.016 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 151.328 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 2.7 tm? -61.74 -36.49 81.13 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 129.941 3.296 . . . . 0.0 115.419 172.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.547 ' HA ' ' HG3' ' A' ' 79' ' ' GLU . 71.1 mm-40 -75.26 -38.82 60.32 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 120.211 -1.555 . . . . 0.0 111.442 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.454 HG22 ' CZ ' ' A' ' 41' ' ' PHE 0.415 0.1 OUTLIER -71.47 -29.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 CA-C-O 124.472 2.082 . . . . 0.0 112.203 171.89 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.502 ' HA ' HD22 ' A' ' 78' ' ' ASN . 0.9 OUTLIER -70.01 -46.79 64.37 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 127.706 2.402 . . . . 0.0 116.782 168.407 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.333 0.8 OUTLIER -66.94 -29.51 69.4 Favored 'General case' 0 C--N 1.371 1.517 0 C-N-CA 127.332 2.253 . . . . 0.0 110.288 176.785 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -60.31 -45.66 92.61 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.02 2.528 . . . . 0.0 112.07 163.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.561 HD13 HG23 ' A' ' 38' ' ' VAL . 3.3 tt . . . . . 0 N--CA 1.502 2.152 0 CA-C-N 122.524 2.42 . . . . 0.0 115.546 168.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.502 0 N-CA-C 117.345 1.698 . . . . 0.0 117.345 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 ptt85 -140.99 160.04 40.93 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 123.194 1.473 . . . . 0.0 110.163 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.4 131.68 54.84 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 127.375 2.27 . . . . 0.0 104.992 177.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -128.53 116.43 19.65 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 -174.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.687 HD12 ' CE1' ' A' ' 73' ' ' HIS . 28.9 mm -122.33 130.15 74.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.009 1.324 . . . . 0.0 109.5 -172.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . 0.436 10.5 t -139.5 150.84 45.61 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 117.088 -3.508 . . . . 0.0 112.396 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.618 ' HB2' ' HB2' ' A' ' 151' ' ' LYS . 0.3 OUTLIER 173.76 164.75 0.18 Allowed 'General case' 0 C--N 1.362 1.129 0 N-CA-C 103.459 -2.793 . . . . 0.0 103.459 162.905 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' A' ' 110' ' ' ASN . . . 43.39 45.97 6.75 Favored Glycine 0 CA--C 1.454 -3.751 0 C-N-CA 129.547 3.451 . . . . 0.0 120.097 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 3.4 m-80 88.43 -9.66 0.49 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 130.057 3.343 . . . . 0.0 114.292 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.557 HD22 ' HA ' ' A' ' 63' ' ' VAL . 18.2 tp -102.19 133.52 46.91 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 126.87 2.068 . . . . 0.0 114.819 -177.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -111.78 100.07 8.64 Favored 'General case' 0 C--N 1.366 1.307 0 N-CA-C 101.256 -3.609 . . . . 0.0 101.256 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.486 HD21 HG21 ' A' ' 70' ' ' ILE 0.252 0.0 OUTLIER -115.36 119.85 37.64 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 119.83 -1.793 . . . . 0.0 106.578 -178.765 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -124.49 154.7 18.03 Favored Glycine 0 C--N 1.355 1.602 0 O-C-N 117.299 -3.376 . . . . 0.0 109.226 -174.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -132.44 134.11 44.68 Favored 'General case' 0 C--N 1.368 1.377 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 35.8 m -124.73 135.83 53.34 Favored 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 103.165 -2.902 . . . . 0.0 103.165 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 53.3 t -54.82 159.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 C-N-CA 129.167 2.987 . . . . 0.0 112.158 173.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 130' ' ' GLN 0.335 91.5 m -64.01 98.65 0.22 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 116.918 -1.913 . . . . 0.0 113.183 167.718 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -64.16 -36.67 20.9 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -175.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -85.14 72.71 4.47 Favored 'Trans proline' 0 CA--C 1.56 1.814 0 CA-C-N 126.005 3.18 . . . . 0.0 112.598 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.426 8.7 p30 -163.43 -136.6 0.03 OUTLIER 'General case' 0 C--N 1.377 1.796 0 N-CA-C 116.697 2.11 . . . . 0.0 116.697 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -95.84 -27.2 15.32 Favored 'General case' 0 C--N 1.376 1.732 0 C-N-CA 131.003 3.721 . . . . 0.0 113.919 174.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.452 0.0 OUTLIER 56.72 71.54 0.56 Allowed 'General case' 0 N--CA 1.423 -1.796 1 C-N-CA 134.745 5.218 . . . . 0.0 115.191 -176.243 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -63.52 52.5 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 130.116 3.367 . . . . 0.0 116.098 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.467 4.7 mptt 82.03 -68.38 0.08 Allowed 'General case' 0 N--CA 1.438 -1.045 1 C-N-CA 131.719 4.007 . . . . 0.0 110.498 176.977 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -172.3 82.6 0.45 Allowed Pre-proline 0 C--N 1.353 0.739 0 CA-C-O 115.779 -2.057 . . . . 0.0 111.314 168.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.403 ' HA ' ' HB3' ' A' ' 41' ' ' PHE . 1.6 Cg_endo -123.85 16.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.369 1.612 0 CA-C-N 127.056 3.556 . . . . 0.0 118.848 177.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.319 4.2 p -147.71 159.2 44.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 111.959 -2.382 . . . . 0.0 109.063 162.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.428 HD22 HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -116.3 140.72 49.03 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 103.405 -2.813 . . . . 0.0 103.405 168.094 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.443 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 49.9 tp60 -130.41 72.02 1.48 Allowed 'General case' 0 C--N 1.361 1.082 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . 0.537 ' SG ' HD22 ' A' ' 49' ' ' LEU . 49.4 t 128.99 115.73 0.0 OUTLIER 'General case' 0 C--N 1.362 1.13 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 -174.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.553 ' O ' HD21 ' A' ' 49' ' ' LEU . 8.1 mmm180 -115.81 108.98 17.01 Favored 'General case' 0 N--CA 1.446 -0.672 1 N-CA-C 99.707 -4.183 . . . . 0.0 99.707 164.038 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.709 ' HA ' HD11 ' A' ' 49' ' ' LEU . 3.4 ttp -92.69 108.91 20.35 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 128.284 2.634 . . . . 0.0 109.15 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.482 ' O ' HD13 ' A' ' 135' ' ' ILE . . . -116.9 113.98 23.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . 0.482 HD13 ' O ' ' A' ' 134' ' ' ALA . 47.3 mm -145.16 132.61 15.93 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.482 HD12 HD13 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -117.08 -175.83 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-O 125.326 2.488 . . . . 0.0 108.882 -174.379 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.317 0.4 OUTLIER -134.42 132.41 39.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 108.955 -3.748 . . . . 0.0 106.713 160.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.672 ' HB2' ' HB2' ' A' ' 141' ' ' LEU 0.286 25.2 m -145.01 -119.85 0.08 Allowed 'General case' 0 N--CA 1.485 1.288 0 O-C-N 118.615 -2.553 . . . . 0.0 116.942 -174.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.741 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.1 OUTLIER -108.57 -75.66 0.63 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 130.879 3.672 . . . . 0.0 110.71 -167.852 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.741 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 14.5 ptp180 -79.66 -9.33 59.62 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 130.704 3.601 . . . . 0.0 111.685 170.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.672 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.415 -2.179 0 CA-C-N 112.744 -2.026 . . . . 0.0 116.445 -159.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.817 HD13 ' O ' ' A' ' 151' ' ' LYS 0.409 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.919 0 N-CA-C 120.82 3.637 . . . . 0.0 120.82 . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.817 ' O ' HD13 ' A' ' 150' ' ' ILE 0.515 4.5 tptp -71.13 160.79 32.23 Favored 'General case' 0 CA--C 1.461 -2.463 1 C-N-CA 153.109 12.563 . . . . 0.0 103.913 -175.689 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.716 ' HA ' ' CD2' ' A' ' 73' ' ' HIS 0.398 9.8 t -71.44 97.23 1.6 Allowed 'General case' 0 CA--C 1.571 1.766 1 CA-C-O 130.546 4.974 . . . . 0.0 121.11 -173.12 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.686 2 CA-C-N 100.419 -7.628 . . . . 0.0 112.741 162.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.451 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 5.5 t-20 . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.61 -62.74 1.27 Allowed 'General case' 0 C--N 1.352 0.698 1 C-N-CA 133.866 4.867 . . . . 0.0 112.395 172.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -72.92 -20.04 61.15 Favored 'General case' 0 C--N 1.374 1.668 0 O-C-N 120.146 -1.596 . . . . 0.0 112.847 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.451 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.3 m -76.27 -34.81 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 129.789 3.235 . . . . 0.0 111.215 173.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -66.99 -41.56 86.55 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 127.769 2.428 . . . . 0.0 108.513 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.7 mt -59.29 -43.91 91.0 Favored 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 124.538 1.135 . . . . 0.0 112.862 167.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.268 77.0 mtp85 -63.45 -49.11 74.94 Favored 'General case' 0 C--N 1.373 1.606 0 O-C-N 120.236 -1.54 . . . . 0.0 115.033 170.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -60.29 -27.31 67.19 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 171.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -76.99 -50.67 12.64 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 127.856 2.462 . . . . 0.0 110.678 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -57.3 -29.08 63.6 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 127.623 2.369 . . . . 0.0 110.856 171.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.485 HD22 ' C ' ' A' ' 58' ' ' ILE . 12.0 tp -68.5 -49.09 62.28 Favored 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 125.637 1.575 . . . . 0.0 112.295 168.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -55.34 -39.21 69.73 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.353 -1.467 . . . . 0.0 112.213 172.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 64.8 mmt-85 -62.4 -48.71 78.52 Favored 'General case' 0 C--N 1.372 1.575 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 163.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.498 ' HB3' HG22 ' A' ' 61' ' ' THR . 48.1 m80 -56.35 -46.49 79.95 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 129.644 3.178 . . . . 0.0 111.577 174.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.524 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.43 -53.05 62.57 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 131.472 3.909 . . . . 0.0 111.011 173.565 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -74.33 -43.98 54.37 Favored 'General case' 0 C--N 1.377 1.79 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 t -66.98 -38.03 85.31 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.515 2.326 . . . . 0.0 112.231 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.583 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.34 41.7 mt-10 -76.91 -29.17 55.58 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 125.369 1.468 . . . . 0.0 112.145 170.525 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -33.97 72.88 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 121.415 1.916 . . . . 0.0 113.037 167.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -66.38 -44.69 82.42 Favored 'General case' 0 C--N 1.377 1.797 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.894 164.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.5 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 17.5 tt0 -57.69 -40.25 79.04 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.805 2.15 . . . . 0.0 116.805 170.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.649 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -69.24 -45.64 78.96 Favored 'Isoleucine or valine' 0 C--N 1.366 1.317 0 C-N-CA 125.683 1.593 . . . . 0.0 111.106 178.043 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.758 0.0 OUTLIER -73.54 -23.26 59.96 Favored 'General case' 0 C--N 1.369 1.452 0 O-C-N 121.296 -0.878 . . . . 0.0 112.929 177.129 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.53 -41.15 66.17 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.945 1.698 . . . . 0.0 111.592 168.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.587 0.8 OUTLIER -63.65 -29.32 70.57 Favored 'General case' 0 C--N 1.403 2.908 0 O-C-N 119.507 -1.996 . . . . 0.0 113.426 169.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.497 ' HA ' HG21 ' A' ' 74' ' ' VAL . 7.2 mt -68.78 -50.5 54.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.416 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 166.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.1 mtm180 -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 121.152 1.796 . . . . 0.0 114.743 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.21 -45.23 27.23 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 125.228 1.411 . . . . 0.0 111.417 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.446 ' HB3' HG11 ' A' ' 74' ' ' VAL . . . -75.53 -31.91 60.27 Favored 'General case' 0 C--N 1.359 1.019 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -178.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.4 t -78.71 -34.18 46.21 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 127.138 2.175 . . . . 0.0 108.847 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -72.42 -43.25 64.13 Favored 'General case' 0 C--N 1.384 2.076 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 165.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.42 73.14 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 126.399 1.879 . . . . 0.0 114.601 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.28 -16.86 60.92 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 119.082 0.855 . . . . 0.0 112.495 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.83 17.75 40.08 Favored Glycine 0 C--N 1.376 2.764 0 C-N-CA 124.413 1.006 . . . . 0.0 114.12 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.649 HG21 ' HB3' ' A' ' 78' ' ' ASN . 2.3 t -102.16 179.76 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.239 0 C-N-CA 128.113 2.565 . . . . 0.0 111.106 -172.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.592 ' H ' HG12 ' A' ' 38' ' ' VAL 0.397 3.1 t -75.09 -144.93 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.436 2.294 . . . . 0.0 113.834 178.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.2 m -150.6 157.66 43.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 119.122 -2.236 . . . . 0.0 107.588 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.491 ' CE1' HD13 ' A' ' 29' ' ' ILE . 19.9 p90 -128.63 154.64 46.04 Favored 'General case' 0 C--N 1.349 0.554 0 C-N-CA 124.559 1.144 . . . . 0.0 109.727 -177.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -100.92 114.62 28.66 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 101.847 -3.39 . . . . 0.0 101.847 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.345 0.0 OUTLIER -115.4 128.75 56.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.256 -1.528 . . . . 0.0 107.572 -170.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -130.83 146.04 52.16 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 121.076 -1.015 . . . . 0.0 109.295 -178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.498 ' CE1' HD13 ' A' ' 50' ' ' LEU . 21.0 p90 -99.97 159.3 15.19 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 124.983 1.313 . . . . 0.0 110.588 177.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.1 p -108.72 118.83 37.81 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 124.46 1.104 . . . . 0.0 108.562 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.468 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.439 0.0 OUTLIER -74.8 -10.8 59.85 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 119.458 3.133 . . . . 0.0 119.458 -170.435 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.74 -48.6 24.84 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 122.161 2.255 . . . . 0.0 113.049 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.585 HD13 ' HA ' ' A' ' 133' ' ' MET . 3.7 pp -67.14 -31.46 71.91 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 128.726 2.811 . . . . 0.0 112.93 173.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.53 ' CD2' HD12 ' A' ' 54' ' ' ILE 0.306 6.2 tt -75.56 -42.72 51.52 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 128.593 2.757 . . . . 0.0 109.848 173.408 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.54 -30.32 67.01 Favored 'General case' 0 C--N 1.378 1.831 0 C-N-CA 128.471 2.708 . . . . 0.0 111.246 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -77.96 -41.32 36.53 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 119.87 -1.769 . . . . 0.0 114.508 164.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.44 -34.36 78.11 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.53 HD12 ' CD2' ' A' ' 50' ' ' LEU . 4.0 tt -66.73 -39.02 82.73 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 C-N-CA 130.421 3.489 . . . . 0.0 112.793 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -104.56 -23.79 13.08 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 174.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.77 -22.71 39.9 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 119.023 -2.298 . . . . 0.0 112.894 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.544 ' HB3' ' HB3' ' A' ' 60' ' ' GLU . 3.1 mm-40 -127.91 14.37 6.86 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -177.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.485 ' C ' HD22 ' A' ' 14' ' ' LEU 0.478 0.3 OUTLIER 20.64 -28.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.985 2 C-N-CA 136.678 5.991 . . . . 0.0 126.621 177.628 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -155.3 64.68 0.62 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.564 ' O ' HG12 ' A' ' 63' ' ' VAL 0.452 6.7 pt-20 -87.44 61.93 6.87 Favored 'General case' 0 CA--C 1.469 -2.143 0 CA-C-O 125.53 2.586 . . . . 0.0 110.71 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.498 HG22 ' HB3' ' A' ' 17' ' ' HIS 0.319 59.6 p -78.96 -11.79 60.02 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 129.154 2.982 . . . . 0.0 112.492 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -65.68 -34.29 77.86 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 130.464 3.506 . . . . 0.0 111.185 164.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.564 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -66.89 -38.04 80.63 Favored 'Isoleucine or valine' 0 C--N 1.359 1.005 0 C-N-CA 126.363 1.865 . . . . 0.0 110.582 -174.505 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 37.6 m-85 -66.52 -46.66 75.45 Favored 'General case' 0 CA--C 1.47 -2.125 1 C-N-CA 133.224 4.61 . . . . 0.0 111.396 169.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -60.46 -38.28 83.7 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.815 1.643 . . . . 0.0 114.875 176.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 1.015 HD12 HD12 ' A' ' 111' ' ' LEU . 2.1 tm? -75.24 -47.98 25.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.97 3.308 . . . . 0.0 114.414 173.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.429 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.623 0.0 OUTLIER -77.31 -17.68 58.11 Favored 'General case' 0 C--N 1.377 1.763 0 O-C-N 118.304 -2.748 . . . . 0.0 112.001 174.278 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.649 ' CE1' HG12 ' A' ' 25' ' ' ILE . 41.3 m-70 -67.91 -38.11 82.52 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 127.288 2.235 . . . . 0.0 109.516 162.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.493 8.9 mttt -77.22 -16.7 58.94 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 122.135 2.243 . . . . 0.0 112.968 168.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.771 HD12 ' HE2' ' A' ' 151' ' ' LYS 0.331 0.8 OUTLIER -71.75 -40.03 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 C-N-CA 126.044 1.738 . . . . 0.0 113.47 172.914 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.517 ' O ' HG23 ' A' ' 74' ' ' VAL 0.866 11.5 mptt -67.44 -2.4 6.29 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 131.013 3.725 . . . . 0.0 118.683 176.06 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -87.43 -16.52 34.63 Favored 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 167.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.768 ' CD2' ' HG3' ' A' ' 151' ' ' LYS 0.288 3.0 m-70 -90.65 10.25 26.49 Favored 'General case' 0 C--N 1.379 1.873 0 C-N-CA 129.768 3.227 . . . . 0.0 111.103 174.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 71' ' ' LYS 0.29 24.4 t -41.14 -40.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.414 3.396 0 C-N-CA 130.334 3.454 . . . . 0.0 111.096 160.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.64 -37.95 74.19 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.633 3.173 . . . . 0.0 115.565 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -75.58 -38.24 59.27 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 128.47 2.708 . . . . 0.0 109.904 172.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.385 1.9 m -69.99 -30.42 44.03 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 CA-C-O 124.188 1.946 . . . . 0.0 113.856 173.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.649 ' HB3' HG21 ' A' ' 38' ' ' VAL . 3.7 m120 -73.81 -34.11 64.47 Favored 'General case' 0 C--N 1.345 0.382 1 C-N-CA 132.45 4.3 . . . . 0.0 111.865 172.397 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -67.41 -30.46 70.23 Favored 'General case' 0 C--N 1.367 1.327 0 C-N-CA 125.957 1.703 . . . . 0.0 111.067 165.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.566 13.4 p90 -75.11 -29.92 60.71 Favored 'General case' 0 C--N 1.379 1.864 0 N-CA-C 116.264 1.95 . . . . 0.0 116.264 162.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.442 ' O ' HD12 ' A' ' 81' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.368 1.4 0 C-N-CA 128.05 2.54 . . . . 0.0 114.531 174.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.4 ' HA3' HG22 ' A' ' 117' ' ' VAL . . . . . . . . 0 N--CA 1.465 0.612 1 N-CA-C 124.371 4.508 . . . . 0.0 124.371 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -129.97 138.53 50.89 Favored 'General case' 0 N--CA 1.431 -1.423 1 N-CA-C 98.2 -4.741 . . . . 0.0 98.2 167.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.41 144.61 49.96 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -129.46 130.29 45.7 Favored 'General case' 0 C--N 1.361 1.108 0 N-CA-C 105.596 -2.001 . . . . 0.0 105.596 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.807 HG23 HD12 ' A' ' 150' ' ' ILE . 1.0 OUTLIER -126.01 137.11 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 175.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.469 ' O ' HG22 ' A' ' 150' ' ' ILE . 1.0 OUTLIER -136.49 107.35 6.64 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 172.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.482 ' HB2' ' HG2' ' A' ' 153' ' ' GLN . 0.4 OUTLIER -162.98 -117.76 0.01 OUTLIER 'General case' 0 CA--C 1.448 -2.97 0 N-CA-C 103.131 -2.914 . . . . 0.0 103.131 -178.429 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.569 ' H ' ' HG3' ' A' ' 153' ' ' GLN . . . -52.04 75.4 0.01 OUTLIER Glycine 0 C--N 1.384 3.231 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -160.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.623 ' O ' HG22 ' A' ' 136' ' ' ILE . 1.1 m-80 63.13 7.35 2.72 Favored 'General case' 0 C--N 1.369 1.437 1 C-N-CA 132.358 4.263 . . . . 0.0 113.192 179.063 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 1.015 HD12 HD12 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -117.32 133.12 56.35 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 129.987 3.315 . . . . 0.0 112.683 -160.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -111.4 98.54 7.55 Favored 'General case' 0 C--N 1.363 1.163 1 N-CA-C 98.979 -4.452 . . . . 0.0 98.979 174.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.638 HD23 HD13 ' A' ' 111' ' ' LEU 0.287 0.8 OUTLIER -115.91 121.11 41.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.453 1.501 . . . . 0.0 107.205 -167.623 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.25 132.1 7.22 Favored Glycine 0 C--N 1.364 2.117 0 O-C-N 119.938 -1.726 . . . . 0.0 109.605 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 152.85 50.56 Favored 'General case' 0 C--N 1.372 1.548 0 CA-C-N 120.848 2.324 . . . . 0.0 107.744 174.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 m -130.1 142.17 50.63 Favored 'General case' 0 C--N 1.371 1.506 0 C-N-CA 125.797 1.639 . . . . 0.0 106.709 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.4 HG22 ' HA3' ' A' ' 102' ' ' GLY . 12.5 m -77.47 179.18 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.999 0 C-N-CA 125.566 1.546 . . . . 0.0 110.289 169.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.526 ' HA ' ' HG3' ' A' ' 130' ' ' GLN 0.267 0.5 OUTLIER -56.66 92.56 0.01 OUTLIER 'General case' 0 C--N 1.359 1.014 0 CA-C-O 124.194 1.949 . . . . 0.0 115.698 168.029 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.354 9.1 pttp -71.6 -40.21 8.32 Favored Pre-proline 0 C--N 1.345 0.383 1 C-N-CA 133.09 4.556 . . . . 0.0 114.028 -178.711 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -75.74 60.3 5.92 Favored 'Trans proline' 0 CA--C 1.568 2.176 0 C-N-CA 124.29 3.327 . . . . 0.0 108.205 160.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.561 0.6 OUTLIER 2.3 -3.24 0.0 OUTLIER 'General case' 0 C--N 1.354 0.764 2 N-CA-C 129.217 6.747 . . . . 0.0 129.217 -168.178 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 56.38 -16.21 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.984 1 N-CA-C 123.224 4.528 . . . . 0.0 123.224 167.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.371 10.0 mptt 72.19 18.66 4.7 Favored 'General case' 0 N--CA 1.421 -1.877 1 C-N-CA 134.821 5.248 . . . . 0.0 114.03 177.58 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -145.71 177.78 8.64 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 128.373 2.669 . . . . 0.0 107.36 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.422 ' H ' ' HE3' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -63.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.354 0.771 1 C-N-CA 132.14 4.176 . . . . 0.0 118.838 -170.466 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -109.8 -4.4 0.11 Allowed Pre-proline 0 N--CA 1.446 -0.636 1 CA-C-O 111.538 -4.077 . . . . 0.0 115.874 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.258 31.1 Cg_exo -69.0 23.61 0.15 Allowed 'Trans proline' 0 C--N 1.371 1.719 2 CA-C-N 133.963 6.022 . . . . 0.0 124.665 -166.898 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.292 19.3 m -145.41 149.55 34.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 C-N-CA 124.514 1.125 . . . . 0.0 108.916 158.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.25 130.42 55.94 Favored 'General case' 0 C--N 1.36 1.026 1 N-CA-C 98.903 -4.48 . . . . 0.0 98.903 159.675 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.526 ' HG3' ' HA ' ' A' ' 118' ' ' CYS . 61.0 mm-40 -125.08 71.99 1.22 Allowed 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -164.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.262 64.0 m 98.15 106.57 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 125.059 1.475 . . . . 0.0 110.405 178.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -115.32 140.78 48.82 Favored 'General case' 0 C--N 1.359 1.002 0 CA-C-N 113.983 -1.462 . . . . 0.0 110.423 171.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.585 ' HA ' HD13 ' A' ' 49' ' ' LEU . 10.1 ttt -107.38 123.51 48.47 Favored 'General case' 0 N--CA 1.436 -1.144 1 C-N-CA 133.815 4.846 . . . . 0.0 110.002 178.566 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.66 114.76 17.06 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 169.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.7 mm -136.7 135.16 48.82 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.623 HG22 ' O ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -112.35 176.46 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.662 0 CA-C-O 124.423 2.058 . . . . 0.0 107.759 -177.389 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -72.19 103.87 3.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 130.242 3.417 . . . . 0.0 106.024 161.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.42 87.3 p -74.73 77.46 2.06 Favored 'General case' 0 C--N 1.357 0.892 0 N-CA-C 116.155 1.909 . . . . 0.0 116.155 -171.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -79.97 -57.67 3.53 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.31 167.796 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 139' ' ' ARG 0.293 32.7 mtt180 109.56 66.16 0.0 OUTLIER 'General case' 0 C--N 1.365 1.272 1 C-N-CA 143.299 8.64 . . . . 0.0 102.788 -173.741 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.469 HD21 HG21 ' A' ' 136' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.355 0.836 1 N-CA-C 126.158 5.614 . . . . 0.0 126.158 -145.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 1.05 HD13 ' HB3' ' A' ' 151' ' ' LYS 0.442 0.3 OUTLIER . . . . . 0 N--CA 1.417 -2.077 0 CA-C-O 122.913 1.34 . . . . 0.0 111.156 . . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 1.05 ' HB3' HD13 ' A' ' 150' ' ' ILE 0.564 0.0 OUTLIER -71.48 147.18 48.06 Favored 'General case' 0 CA--C 1.502 -0.899 1 C-N-CA 140.219 7.408 . . . . 0.0 105.498 -177.464 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.627 ' O ' HG23 ' A' ' 152' ' ' THR 0.473 12.4 t -78.31 93.03 4.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 128.318 3.913 . . . . 0.0 117.882 -163.198 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.704 HE21 HD13 ' A' ' 70' ' ' ILE 0.251 2.0 pt20 . . . . . 0 N--CA 1.418 -2.026 0 N-CA-C 102.122 -3.288 . . . . 0.0 102.122 177.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.45 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.442 -0.851 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -61.17 2.23 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 130.151 3.381 . . . . 0.0 114.764 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -75.6 -19.58 59.15 Favored 'General case' 0 C--N 1.376 1.734 0 CA-C-O 122.192 0.996 . . . . 0.0 112.227 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.45 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -74.32 -37.25 44.92 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 C-N-CA 129.912 3.285 . . . . 0.0 111.578 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.61 -44.26 82.57 Favored 'General case' 0 C--N 1.373 1.615 0 C-N-CA 128.731 2.812 . . . . 0.0 108.576 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.43 -43.52 77.91 Favored 'Isoleucine or valine' 0 C--N 1.368 1.381 0 C-N-CA 125.1 1.36 . . . . 0.0 112.847 167.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HB3' HD13 ' A' ' 58' ' ' ILE 0.27 0.9 OUTLIER -62.73 -50.86 69.41 Favored 'General case' 0 CA--C 1.564 1.507 0 C-N-CA 126.39 1.876 . . . . 0.0 115.123 173.184 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.547 ' CD ' HE22 ' A' ' 55' ' ' GLN . 32.6 mtp180 -59.29 -27.63 66.02 Favored 'General case' 0 C--N 1.372 1.546 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 163.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -77.08 -47.76 19.64 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 128.676 2.79 . . . . 0.0 110.563 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.54 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 9.5 mmpt? -58.77 -29.63 66.94 Favored 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.161 2.184 . . . . 0.0 109.571 169.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.683 HD13 HG13 ' A' ' 54' ' ' ILE . 0.4 OUTLIER -67.07 -44.49 79.96 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 163.145 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 -60.87 -32.6 72.03 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 122.726 2.512 . . . . 0.0 113.837 171.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.54 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.29 0.5 OUTLIER -72.07 -38.46 69.44 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.498 -1.376 . . . . 0.0 112.289 171.728 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -65.23 -46.14 81.8 Favored 'General case' 0 C--N 1.386 2.154 0 C-N-CA 128.316 2.646 . . . . 0.0 111.06 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.607 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -63.2 -51.1 67.67 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 129.964 3.306 . . . . 0.0 112.201 -177.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -74.31 -42.96 58.64 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 126.983 2.113 . . . . 0.0 115.905 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.7 m -64.93 -42.88 94.28 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 124.428 2.061 . . . . 0.0 112.068 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.563 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.279 41.2 mt-10 -76.41 -29.79 57.2 Favored 'General case' 0 N--CA 1.439 -1.023 0 O-C-N 120.135 -1.603 . . . . 0.0 112.495 172.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -59.55 -31.39 69.38 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 122.348 2.34 . . . . 0.0 112.471 166.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -63.0 -46.26 88.5 Favored 'General case' 0 C--N 1.385 2.116 0 C-N-CA 124.585 1.154 . . . . 0.0 111.126 163.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 43.8 tt0 -56.08 -43.24 77.8 Favored 'General case' 0 C--N 1.371 1.53 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 169.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.7 mt -68.57 -45.79 81.12 Favored 'Isoleucine or valine' 0 C--N 1.357 0.93 0 C-N-CA 125.519 1.528 . . . . 0.0 113.888 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.726 0.1 OUTLIER -73.45 -22.93 60.06 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 174.46 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -67.73 -47.19 70.03 Favored 'General case' 0 C--N 1.377 1.78 0 CA-C-O 116.989 -1.482 . . . . 0.0 112.457 168.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG2' ' CD ' ' A' ' 71' ' ' LYS 0.774 0.2 OUTLIER -69.77 -30.54 68.14 Favored 'General case' 0 C--N 1.406 3.028 0 CA-C-N 124.259 3.209 . . . . 0.0 113.92 171.739 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.47 -37.15 79.35 Favored 'Isoleucine or valine' 0 C--N 1.372 1.578 0 CA-C-N 121.85 2.114 . . . . 0.0 115.274 170.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 ttt-85 -70.59 -38.08 73.98 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 118.745 -2.472 . . . . 0.0 114.241 175.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -76.3 -41.2 49.43 Favored 'General case' 0 CA--C 1.485 -1.53 0 C-N-CA 126.493 1.917 . . . . 0.0 111.732 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.0 -32.09 45.01 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.369 11.3 p -78.51 -27.98 46.2 Favored 'General case' 0 C--N 1.359 0.987 0 O-C-N 120.823 -1.173 . . . . 0.0 110.125 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -71.36 -52.1 20.55 Favored 'General case' 0 C--N 1.371 1.522 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 158.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.03 -30.16 71.25 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.88 -11.97 60.01 Favored 'General case' 0 C--N 1.375 1.685 0 O-C-N 120.901 -1.124 . . . . 0.0 111.591 170.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.85 17.18 62.0 Favored Glycine 0 C--N 1.383 3.189 0 O-C-N 121.016 -1.052 . . . . 0.0 115.056 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.67 HG22 ' H ' ' A' ' 39' ' ' SER . 7.9 p -96.58 178.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.36 0 CA-C-O 125.035 2.35 . . . . 0.0 112.754 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.67 ' H ' HG22 ' A' ' 38' ' ' VAL . 41.9 t -23.88 -69.11 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 1 C-N-CA 136.859 6.064 . . . . 0.0 117.522 178.188 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.256 90.9 p 102.57 142.39 0.01 OUTLIER 'General case' 0 C--N 1.357 0.903 0 C-N-CA 131.007 3.723 . . . . 0.0 104.238 -166.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . 0.266 50.4 p90 -141.53 161.9 36.8 Favored 'General case' 0 C--N 1.345 0.399 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -111.12 149.58 30.65 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.847 1.659 . . . . 0.0 112.863 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.353 1.7 pp -126.84 158.38 36.82 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 119.44 -2.038 . . . . 0.0 112.861 167.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -140.41 150.25 43.63 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.347 3.059 . . . . 0.0 103.196 172.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.467 ' CD1' HD13 ' A' ' 50' ' ' LEU . 4.0 p90 -125.2 134.08 52.5 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 105.72 -1.956 . . . . 0.0 105.72 170.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.3 m -105.18 128.16 53.27 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 120.99 -1.069 . . . . 0.0 108.516 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.597 0.0 OUTLIER -73.68 -10.54 59.8 Favored 'General case' 0 C--N 1.363 1.187 1 N-CA-C 122.541 4.274 . . . . 0.0 122.541 -169.921 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.27 -45.3 60.7 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 122.966 2.621 . . . . 0.0 111.762 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.0 tp -53.78 -48.61 69.62 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 131.138 3.775 . . . . 0.0 111.977 166.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.607 HD11 ' CE1' ' A' ' 18' ' ' PHE . 8.3 tt -74.83 -28.65 60.78 Favored 'General case' 0 CA--C 1.487 -1.444 0 C-N-CA 125.837 1.655 . . . . 0.0 112.708 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.515 ' HA ' HG22 ' A' ' 54' ' ' ILE . 16.3 t70 -66.72 -30.64 70.92 Favored 'General case' 0 C--N 1.365 1.239 0 CA-C-N 120.177 1.353 . . . . 0.0 108.729 169.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -73.82 -28.69 61.75 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 167.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.82 -50.18 25.74 Favored 'General case' 0 C--O 1.207 -1.179 0 O-C-N 119.979 -1.7 . . . . 0.0 113.373 165.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.683 HG13 HD13 ' A' ' 14' ' ' LEU 0.282 0.3 OUTLIER -50.95 -43.35 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 1 C-N-CA 132.939 4.496 . . . . 0.0 113.884 -177.297 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.547 HE22 ' CD ' ' A' ' 11' ' ' ARG 0.26 5.3 mm100 -84.18 -31.67 25.01 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 171.828 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -99.53 39.1 1.34 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 124.201 1.953 . . . . 0.0 109.456 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . 0.295 2.7 pt-20 -160.71 -52.07 0.05 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 127.946 2.498 . . . . 0.0 110.395 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.605 ' HA ' HD12 ' A' ' 14' ' ' LEU 0.64 0.1 OUTLIER 19.83 108.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.524 3.241 0 C-N-CA 131.518 3.927 . . . . 0.0 113.249 -169.171 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.422 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 69.1 m-20 53.23 44.3 30.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 131.59 3.956 . . . . 0.0 112.089 -173.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.663 ' O ' HG12 ' A' ' 63' ' ' VAL 0.652 3.8 tp10 -78.29 79.64 4.72 Favored 'General case' 0 C--N 1.372 1.577 0 CA-C-O 127.22 3.391 . . . . 0.0 110.666 175.024 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.313 62.2 p -78.23 -15.87 58.38 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 127.616 2.366 . . . . 0.0 112.569 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -67.59 -33.29 74.7 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 129.859 3.264 . . . . 0.0 109.33 165.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -58.57 -44.33 89.15 Favored 'Isoleucine or valine' 0 C--N 1.372 1.551 0 C-N-CA 128.978 2.911 . . . . 0.0 110.332 179.892 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.563 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 41.1 m-85 -64.98 -45.46 85.54 Favored 'General case' 0 CA--C 1.488 -1.434 1 C-N-CA 133.332 4.653 . . . . 0.0 111.229 170.612 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.39 -34.17 77.15 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-N 122.408 2.367 . . . . 0.0 114.187 178.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.961 HD12 HD23 ' A' ' 111' ' ' LEU . 2.9 tm? -76.35 -45.39 32.3 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 127.43 2.292 . . . . 0.0 116.522 168.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.47 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.87 0.1 OUTLIER -75.49 -16.36 60.31 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 122.334 2.333 . . . . 0.0 113.514 176.526 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.415 ' CE1' ' HB3' ' A' ' 24' ' ' GLN 0.253 24.9 m-70 -76.81 -36.34 56.99 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 128.669 2.788 . . . . 0.0 110.296 161.637 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -73.88 -18.17 60.95 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 122.335 2.334 . . . . 0.0 114.569 169.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.482 HG21 HH22 ' A' ' 132' ' ' ARG . 26.4 mm -57.8 -70.26 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.379 1.876 0 C-N-CA 129.067 2.947 . . . . 0.0 113.013 173.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.435 ' CD ' ' HG2' ' A' ' 28' ' ' GLU 0.846 0.0 OUTLIER -52.13 -2.1 0.02 OUTLIER 'General case' 0 CA--C 1.48 -1.726 1 C-N-CA 133.015 4.526 . . . . 0.0 120.996 179.163 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -84.26 -18.77 35.34 Favored 'General case' 0 CA--C 1.564 1.483 0 O-C-N 119.944 -1.722 . . . . 0.0 107.409 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -99.16 21.23 12.13 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 130.118 3.367 . . . . 0.0 113.993 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.3 t -38.62 -43.73 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.397 2.652 0 C-N-CA 129.588 3.155 . . . . 0.0 112.99 163.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.93 -39.69 74.97 Favored 'General case' 0 C--O 1.214 -0.8 1 C-N-CA 132.546 4.339 . . . . 0.0 114.096 177.099 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.488 ' HA ' ' HG3' ' A' ' 79' ' ' GLU 0.254 30.8 mt-10 -75.93 -32.11 59.42 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 126.315 1.846 . . . . 0.0 112.594 169.02 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.417 ' HB ' ' CE2' ' A' ' 80' ' ' PHE 0.422 1.8 m -66.98 -31.12 52.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.505 0 CA-C-O 127.805 3.669 . . . . 0.0 112.379 168.15 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.521 ' HB2' HG21 ' A' ' 38' ' ' VAL 0.451 0.0 OUTLIER -71.93 -29.56 64.42 Favored 'General case' 0 C--N 1.351 0.67 1 C-N-CA 132.593 4.357 . . . . 0.0 112.067 168.718 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.298 17.7 mt-10 -69.94 -30.11 67.41 Favored 'General case' 0 C--N 1.373 1.602 0 C-N-CA 129.248 3.019 . . . . 0.0 109.574 166.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.417 ' CE2' ' HB ' ' A' ' 77' ' ' VAL . 2.8 m-85 -61.58 -47.26 86.31 Favored 'General case' 0 C--N 1.386 2.157 0 CA-C-N 119.295 0.952 . . . . 0.0 110.553 165.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 125' ' ' LYS 0.53 1.1 tm? . . . . . 0 N--CA 1.501 2.113 0 N-CA-C 119.612 3.19 . . . . 0.0 119.612 173.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.138 0 N-CA-C 118.112 2.005 . . . . 0.0 118.112 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -124.83 139.41 53.87 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 103.822 -2.659 . . . . 0.0 103.822 176.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.51 139.1 45.2 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -174.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -128.26 130.82 48.49 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 102.564 -3.124 . . . . 0.0 102.564 178.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.407 ' CG2' ' HB3' ' A' ' 151' ' ' LYS . 0.0 OUTLIER -134.33 138.71 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 124.477 1.111 . . . . 0.0 108.115 -171.761 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -137.6 114.4 10.55 Favored 'General case' 0 C--N 1.38 1.928 0 N-CA-C 116.412 2.005 . . . . 0.0 116.412 -167.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.803 ' HB3' ' H ' ' A' ' 151' ' ' LYS 0.329 0.9 OUTLIER -132.32 -157.99 0.86 Allowed 'General case' 0 C--N 1.386 2.16 0 CA-C-N 122.576 2.444 . . . . 0.0 108.064 177.853 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -47.2 67.06 0.0 OUTLIER Glycine 0 CA--C 1.453 -3.84 1 C-N-CA 134.494 5.807 . . . . 0.0 118.771 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 93.41 5.01 0.05 OUTLIER 'General case' 0 CA--C 1.492 -1.277 1 C-N-CA 134.568 5.147 . . . . 0.0 111.825 169.288 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.961 HD23 HD12 ' A' ' 66' ' ' LEU . 16.0 tp -106.96 133.99 50.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.727 1.211 . . . . 0.0 111.383 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -110.59 99.63 8.57 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 102.13 -3.285 . . . . 0.0 102.13 171.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.402 ' HB2' ' HZ1' ' A' ' 151' ' ' LYS . 0.7 OUTLIER -106.76 131.68 53.6 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 124.625 1.17 . . . . 0.0 108.12 -177.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -135.27 138.43 9.98 Favored Glycine 0 C--N 1.348 1.25 0 O-C-N 118.938 -2.351 . . . . 0.0 108.133 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.89 152.81 50.8 Favored 'General case' 0 C--N 1.364 1.203 0 CA-C-N 120.876 2.338 . . . . 0.0 107.182 174.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 p -127.32 140.79 51.96 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 106.33 -1.729 . . . . 0.0 106.33 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.5 t -85.84 134.86 26.24 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 102.411 -3.181 . . . . 0.0 102.411 169.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.418 14.2 p -14.64 64.41 0.0 OUTLIER 'General case' 0 C--N 1.375 1.705 0 C-N-CA 131.674 3.99 . . . . 0.0 120.29 -171.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.436 2.0 ptmt -15.77 -56.75 0.04 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 137.796 6.439 . . . . 0.0 117.215 -172.201 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -68.94 48.18 0.48 Allowed 'Trans proline' 0 CA--C 1.574 2.508 0 C-N-CA 123.143 2.562 . . . . 0.0 115.174 166.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.402 0.0 OUTLIER 156.45 -171.89 0.0 OUTLIER 'General case' 0 C--N 1.376 1.75 0 C-N-CA 131.356 3.863 . . . . 0.0 110.576 176.159 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -152.35 -77.41 0.12 Allowed 'General case' 0 N--CA 1.423 -1.779 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 157.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.502 0.0 OUTLIER 19.35 59.53 0.02 OUTLIER 'General case' 0 C--N 1.356 0.855 1 C-N-CA 135.417 5.487 . . . . 0.0 119.176 -170.496 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 171.14 -168.7 0.02 OUTLIER 'General case' 0 CA--C 1.507 -0.698 1 C-N-CA 132.322 4.249 . . . . 0.0 104.299 -172.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 81' ' ' LEU 0.489 0.0 OUTLIER -125.22 -71.41 0.71 Allowed 'General case' 0 C--N 1.358 0.944 0 CA-C-N 119.457 1.026 . . . . 0.0 113.631 -179.763 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.517 ' H ' HD23 ' A' ' 81' ' ' LEU . 9.3 p-10 -43.71 -59.57 3.37 Favored Pre-proline 0 C--N 1.355 0.831 0 N-CA-C 121.78 3.993 . . . . 0.0 121.78 172.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.619 0.0 OUTLIER 55.49 -178.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.392 2.82 1 N-CA-C 123.061 4.216 . . . . 0.0 123.061 163.648 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 24.6 t -105.26 140.61 38.15 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 102.053 -3.314 . . . . 0.0 102.053 171.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mp -100.29 130.15 46.37 Favored 'General case' 0 C--N 1.347 0.486 1 N-CA-C 99.157 -4.386 . . . . 0.0 99.157 -177.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -123.3 74.29 1.23 Allowed 'General case' 0 CA--C 1.479 -1.756 0 N-CA-C 105.655 -1.979 . . . . 0.0 105.655 -161.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.365 0.5 OUTLIER 95.35 115.65 0.02 OUTLIER 'General case' 0 C--N 1.368 1.389 0 CA-C-O 123.482 1.611 . . . . 0.0 110.598 -176.487 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.482 HH22 HG21 ' A' ' 70' ' ' ILE . 14.3 ptm180 -114.75 129.93 56.76 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 171.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.9 ttt -93.73 122.02 35.76 Favored 'General case' 0 N--CA 1.439 -0.986 1 C-N-CA 132.998 4.519 . . . . 0.0 107.729 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.274 . . -127.91 114.44 17.17 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -144.4 122.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 O-C-N 119.849 -1.782 . . . . 0.0 108.634 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.546 HD12 HG23 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -118.14 -179.67 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 C-N-CA 127.67 2.388 . . . . 0.0 112.72 -166.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.326 0.2 OUTLIER -140.23 153.13 46.46 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 111.314 -2.676 . . . . 0.0 109.169 162.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.56 ' HB2' ' HD2' ' A' ' 139' ' ' ARG . 68.0 m -162.5 -122.35 0.02 OUTLIER 'General case' 0 C--N 1.354 0.789 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -169.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.581 ' CG ' ' H ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -84.76 -81.52 0.19 Allowed 'General case' 0 C--N 1.362 1.138 1 C-N-CA 136.118 5.767 . . . . 0.0 114.661 -171.677 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.581 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 0.5 OUTLIER -87.71 -1.16 57.78 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 129.521 3.128 . . . . 0.0 110.428 171.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.7 OUTLIER . . . . . 0 N--CA 1.42 -1.94 0 C-N-CA 125.951 1.7 . . . . 0.0 111.004 -170.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.733 ' CD1' ' H ' ' A' ' 152' ' ' THR . 5.0 tp . . . . . 0 CA--C 1.513 -0.472 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.827 ' HE3' HD11 ' A' ' 66' ' ' LEU 0.292 0.0 OUTLIER -127.92 111.24 13.36 Favored 'General case' 0 CA--C 1.459 -2.536 1 O-C-N 115.916 -4.24 . . . . 0.0 115.568 118.886 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.733 ' H ' ' CD1' ' A' ' 150' ' ' ILE 0.28 74.5 p -118.71 99.11 6.57 Favored 'General case' 0 N--CA 1.435 -1.196 1 N-CA-C 97.58 -4.97 . . . . 0.0 97.58 130.755 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.681 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -175.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.631 ' HA ' HG13 ' A' ' 7' ' ' VAL . 15.3 m-80 . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 115.964 1.838 . . . . 0.0 115.964 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.5 m -61.22 -55.47 31.72 Favored 'General case' 0 C--N 1.349 0.581 0 C-N-CA 130.458 3.503 . . . . 0.0 112.104 174.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -72.74 -21.16 61.07 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 128.222 2.609 . . . . 0.0 112.656 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.631 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.267 0.7 OUTLIER -82.41 -38.13 15.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.074 0 C-N-CA 126.798 2.039 . . . . 0.0 111.049 178.156 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.82 -44.47 85.53 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 129.857 3.263 . . . . 0.0 108.885 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.88 -43.84 89.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 C-N-CA 126.048 1.739 . . . . 0.0 110.765 168.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.266 2.7 tpt85 -62.33 -50.29 72.22 Favored 'General case' 0 C--N 1.371 1.511 0 N-CA-C 116.153 1.909 . . . . 0.0 116.153 170.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -59.11 -29.18 67.18 Favored 'General case' 0 C--N 1.373 1.596 0 N-CA-C 118.486 2.773 . . . . 0.0 118.486 170.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -77.21 -51.45 10.93 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.13 3.372 . . . . 0.0 110.719 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -57.44 -29.21 64.0 Favored 'General case' 0 C--N 1.382 1.993 0 C-N-CA 128.271 2.628 . . . . 0.0 111.042 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.747 HD23 ' HA ' ' A' ' 54' ' ' ILE . 7.9 tp -71.22 -46.68 60.63 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 114.878 -1.056 . . . . 0.0 112.569 167.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.582 ' HA ' HD11 ' A' ' 54' ' ' ILE . 3.3 tmm_? -55.32 -43.43 74.89 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 120.18 1.354 . . . . 0.0 112.722 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -57.91 -47.75 81.91 Favored 'General case' 0 C--N 1.371 1.543 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 165.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -50.15 74.53 Favored 'General case' 0 C--N 1.38 1.912 0 C-N-CA 128.28 2.632 . . . . 0.0 115.113 175.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.544 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -65.33 -51.44 60.55 Favored 'General case' 0 C--N 1.357 0.91 1 C-N-CA 131.942 4.097 . . . . 0.0 110.226 177.46 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -72.95 -44.84 60.68 Favored 'General case' 0 C--N 1.381 1.952 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 176.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.4 m -63.71 -42.93 97.87 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.352 1.861 . . . . 0.0 112.792 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.491 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.453 4.9 mp0 -76.75 -28.41 55.74 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 120.073 -1.642 . . . . 0.0 111.029 174.163 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.45 -32.53 71.47 Favored 'General case' 0 C--N 1.386 2.156 0 CA-C-N 122.467 2.394 . . . . 0.0 113.023 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -65.12 -45.33 85.54 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 124.347 1.059 . . . . 0.0 111.761 163.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -56.63 -47.04 80.56 Favored 'General case' 0 C--N 1.378 1.806 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 171.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.448 ' CD1' ' CD1' ' A' ' 67' ' ' PHE . 1.2 mt -68.57 -43.85 83.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 124.929 1.291 . . . . 0.0 112.767 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.58 1.4 p30 -73.41 -23.95 60.21 Favored 'General case' 0 C--N 1.376 1.75 0 CA-C-N 121.631 2.014 . . . . 0.0 114.001 173.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -70.61 -41.32 72.41 Favored 'General case' 0 C--N 1.382 1.979 0 C-N-CA 125.059 1.343 . . . . 0.0 111.086 169.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -66.01 -37.68 86.54 Favored 'General case' 0 C--N 1.373 1.614 0 O-C-N 119.439 -2.038 . . . . 0.0 112.429 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -40.15 87.79 Favored 'Isoleucine or valine' 0 C--N 1.363 1.17 0 C-N-CA 124.619 1.168 . . . . 0.0 113.807 174.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -67.21 -39.96 86.39 Favored 'General case' 0 C--N 1.37 1.469 0 O-C-N 120.604 -1.31 . . . . 0.0 113.265 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -75.7 -38.57 58.51 Favored 'General case' 0 CA--C 1.484 -1.575 0 C-N-CA 126.37 1.868 . . . . 0.0 111.642 -176.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.35 -44.96 67.07 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 124.055 0.942 . . . . 0.0 113.175 174.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.54 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.362 96.5 p -71.41 -31.38 67.18 Favored 'General case' 0 C--N 1.355 0.824 0 O-C-N 121.214 -0.929 . . . . 0.0 113.159 177.1 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -69.69 -48.49 59.47 Favored 'General case' 0 C--N 1.367 1.355 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 164.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.1 67.69 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 126.48 1.912 . . . . 0.0 114.612 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.9 -13.67 62.36 Favored 'General case' 0 C--N 1.378 1.805 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 164.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.22 18.05 30.03 Favored Glycine 0 C--N 1.375 2.731 0 O-C-N 120.823 -1.173 . . . . 0.0 113.576 171.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.674 HG23 HD23 ' A' ' 81' ' ' LEU 0.256 0.8 OUTLIER -113.25 169.08 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -174.603 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.5 t -30.37 -78.3 0.02 OUTLIER 'General case' 0 C--N 1.357 0.919 1 C-N-CA 132.825 4.45 . . . . 0.0 117.242 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.5 m 122.73 146.86 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 131.483 3.913 . . . . 0.0 102.521 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.415 ' CE1' HG23 ' A' ' 74' ' ' VAL . 30.5 p90 -122.98 154.6 38.21 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 124.713 1.205 . . . . 0.0 109.012 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -101.3 144.66 29.87 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.289 2.5 pp -125.86 159.6 32.07 Favored 'General case' 0 CA--C 1.49 -1.349 0 O-C-N 119.207 -2.183 . . . . 0.0 111.066 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -133.79 165.98 23.72 Favored 'General case' 0 CA--C 1.485 -1.537 0 N-CA-C 102.059 -3.311 . . . . 0.0 102.059 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 131' ' ' CYS . 0.1 OUTLIER -152.98 147.2 25.66 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -179.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -95.24 124.94 39.54 Favored 'General case' 0 C--N 1.359 0.994 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 176.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.464 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.325 0.4 OUTLIER -79.51 -11.03 59.9 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 117.975 -1.012 . . . . 0.0 113.342 -179.439 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.73 -37.98 48.11 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 127.639 2.375 . . . . 0.0 112.34 176.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.3 tp -62.79 -41.02 99.09 Favored 'General case' 0 C--N 1.359 1.007 0 CA-C-O 126.536 3.065 . . . . 0.0 111.544 168.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.544 HD11 ' CD1' ' A' ' 18' ' ' PHE 0.401 6.8 tt -76.62 -41.43 45.98 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 110.299 -3.137 . . . . 0.0 109.231 -172.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.412 ' HA ' HG22 ' A' ' 54' ' ' ILE . 29.9 t70 -54.65 -38.24 66.66 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 129.147 2.979 . . . . 0.0 111.746 165.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -66.23 -42.29 88.85 Favored 'General case' 0 C--N 1.376 1.724 0 O-C-N 119.735 -1.853 . . . . 0.0 112.136 169.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.69 67.05 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 118.693 -2.504 . . . . 0.0 116.959 170.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.747 ' HA ' HD23 ' A' ' 14' ' ' LEU 0.401 0.2 OUTLIER -69.29 -41.81 81.15 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 C-N-CA 131.582 3.953 . . . . 0.0 111.972 179.61 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.05 -28.86 10.79 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 171.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -83.54 -27.31 29.41 Favored 'General case' 0 C--N 1.371 1.517 0 CA-C-N 122.277 2.308 . . . . 0.0 111.422 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -103.55 -70.11 0.77 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.931 1.693 . . . . 0.0 111.384 173.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.566 0.0 OUTLIER 83.78 155.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 127.082 2.153 . . . . 0.0 111.568 -179.419 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.514 ' N ' HD22 ' A' ' 14' ' ' LEU 0.257 47.0 p30 31.83 47.43 0.07 Allowed 'General case' 0 N--CA 1.519 3.011 1 C-N-CA 132.483 4.313 . . . . 0.0 116.675 -177.296 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.404 11.3 pt-20 -82.03 69.88 8.83 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-O 125.005 2.336 . . . . 0.0 113.358 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 64' ' ' PHE 0.414 1.2 p -81.67 -19.09 42.35 Favored 'General case' 0 N--CA 1.426 -1.637 0 C-N-CA 131.687 3.995 . . . . 0.0 113.819 164.828 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.601 ' CD2' HD13 ' A' ' 141' ' ' LEU . 0.0 OUTLIER -65.42 -35.53 81.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 130.322 3.449 . . . . 0.0 109.157 171.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.654 ' HA ' HD11 ' A' ' 111' ' ' LEU . 3.0 t -58.71 -46.1 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.845 0 C-N-CA 129.668 3.187 . . . . 0.0 110.442 176.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.491 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.254 60.3 m-85 -60.55 -45.18 94.86 Favored 'General case' 0 C--O 1.212 -0.875 1 C-N-CA 131.812 4.045 . . . . 0.0 114.065 166.91 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -68.32 -37.98 81.1 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 121.507 1.958 . . . . 0.0 114.049 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.597 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.3 tm? -65.1 -52.4 55.69 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 125.116 1.366 . . . . 0.0 112.087 168.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.457 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.677 0.0 OUTLIER -78.44 -17.76 55.89 Favored 'General case' 0 C--N 1.38 1.896 0 CA-C-N 121.967 2.167 . . . . 0.0 116.158 -177.299 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -78.08 -22.97 48.22 Favored 'General case' 0 C--N 1.355 0.826 0 C-N-CA 128.0 2.52 . . . . 0.0 109.576 165.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -76.91 -36.93 56.28 Favored 'General case' 0 C--N 1.381 1.96 0 O-C-N 120.379 -1.451 . . . . 0.0 110.46 170.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 66' ' ' LEU 0.356 0.0 OUTLIER -92.92 -7.55 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.295 0 N-CA-C 120.74 3.608 . . . . 0.0 120.74 -178.777 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -47.69 -1.45 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 1 C-N-CA 133.725 4.81 . . . . 0.0 116.998 -175.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -83.67 -43.23 15.79 Favored 'General case' 0 C--N 1.362 1.116 1 C-N-CA 139.079 6.952 . . . . 0.0 110.353 172.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.632 ' CG ' ' HA ' ' A' ' 153' ' ' GLN . 0.2 OUTLIER -62.57 -9.76 9.87 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 131.343 3.857 . . . . 0.0 115.895 -174.001 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.415 HG23 ' CE1' ' A' ' 41' ' ' PHE . 10.6 p -60.49 -20.73 21.47 Favored 'Isoleucine or valine' 0 C--N 1.375 1.702 0 C-N-CA 127.937 2.495 . . . . 0.0 110.959 166.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.99 -35.15 66.8 Favored 'General case' 0 C--N 1.378 1.812 0 C-N-CA 130.339 3.456 . . . . 0.0 111.362 171.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.334 36.2 mt-10 -76.85 -32.61 57.66 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.229 -1.544 . . . . 0.0 113.118 170.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.452 HG13 ' O ' ' A' ' 73' ' ' HIS 0.383 0.8 OUTLIER -68.95 -29.94 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 CA-C-O 126.66 3.124 . . . . 0.0 110.12 167.867 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.55 ' HB3' HG11 ' A' ' 38' ' ' VAL . 11.8 m120 -68.04 -32.5 72.91 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 117.921 -2.987 . . . . 0.0 113.583 165.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.56 -30.03 71.2 Favored 'General case' 0 C--N 1.378 1.82 0 C-N-CA 125.882 1.673 . . . . 0.0 111.534 165.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.458 ' CE2' HG21 ' A' ' 117' ' ' VAL 0.389 6.6 t80 -65.35 -32.05 73.5 Favored 'General case' 0 CA--C 1.583 2.226 0 C-N-CA 126.864 2.066 . . . . 0.0 112.733 164.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.674 HD23 HG23 ' A' ' 38' ' ' VAL . 10.9 tp . . . . . 0 N--CA 1.523 3.214 0 CA-C-O 125.09 2.376 . . . . 0.0 114.071 162.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.124 0 CA-C-O 123.35 1.528 . . . . 0.0 115.155 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -141.06 151.7 44.23 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.286 -1.714 . . . . 0.0 107.902 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.0 mt -109.61 114.11 27.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -128.81 109.42 11.26 Favored 'General case' 0 CA--C 1.496 -1.107 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 -173.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.762 HD12 HD23 ' A' ' 113' ' ' LEU . 1.3 pp -136.63 141.01 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.075 0 C-N-CA 125.752 1.621 . . . . 0.0 111.837 -171.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.5 m -117.9 118.47 32.09 Favored 'General case' 0 C--N 1.351 0.641 0 O-C-N 119.652 -1.905 . . . . 0.0 111.873 177.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.263 0.4 OUTLIER -176.6 170.36 2.45 Favored 'General case' 0 CA--C 1.479 -1.762 0 N-CA-C 102.724 -3.065 . . . . 0.0 102.724 172.727 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.597 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 94.0 -34.15 4.83 Favored Glycine 1 CA--C 1.417 -6.074 0 CA-C-O 115.044 -3.087 . . . . 0.0 110.753 -160.863 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 29.9 m-80 100.76 0.71 0.02 OUTLIER 'General case' 0 C--N 1.375 1.684 2 C-N-CA 132.232 4.213 . . . . 0.0 106.381 -157.448 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.654 HD11 ' HA ' ' A' ' 63' ' ' VAL 0.308 1.0 OUTLIER -86.72 137.03 32.79 Favored 'General case' 0 C--N 1.354 0.787 1 C-N-CA 138.103 6.561 . . . . 0.0 114.216 -178.681 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.71 100.64 13.32 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 164.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.762 HD23 HD12 ' A' ' 106' ' ' ILE . 0.3 OUTLIER -96.22 126.82 41.7 Favored 'General case' 0 C--N 1.382 1.981 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 175.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.66 123.71 5.32 Favored Glycine 0 C--N 1.351 1.391 0 N-CA-C 105.899 -2.881 . . . . 0.0 105.899 174.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -122.97 127.3 48.66 Favored 'General case' 0 C--N 1.369 1.446 1 N-CA-C 99.648 -4.204 . . . . 0.0 99.648 174.713 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.1 m -121.18 127.88 51.93 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 -171.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.459 HG13 ' HB3' ' A' ' 127' ' ' PRO . 13.4 t -80.24 138.73 19.31 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.425 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.558 10.9 p -54.41 67.7 0.0 OUTLIER 'General case' 0 C--N 1.378 1.84 0 N-CA-C 120.845 3.646 . . . . 0.0 120.845 -162.06 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.465 11.8 ttmm -22.48 -45.81 0.05 OUTLIER Pre-proline 0 C--N 1.359 0.997 1 C-N-CA 133.999 4.92 . . . . 0.0 121.795 -170.251 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -70.63 60.18 2.12 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 CA-C-N 125.647 3.053 . . . . 0.0 113.595 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 170.07 161.99 0.07 Allowed 'General case' 0 C--N 1.367 1.335 0 C-N-CA 128.038 2.535 . . . . 0.0 113.521 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.542 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 2.5 tt0 -85.28 -69.63 0.64 Allowed 'General case' 0 C--N 1.376 1.744 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 152.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 44.37 -10.76 0.0 OUTLIER 'General case' 0 C--N 1.363 1.173 1 C-N-CA 139.648 7.179 . . . . 0.0 118.018 -170.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.542 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 56.4 m-85 -138.9 -163.01 1.4 Allowed 'General case' 0 N--CA 1.414 -2.245 0 N-CA-C 121.212 3.782 . . . . 0.0 121.212 -161.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HB2' HD12 ' A' ' 81' ' ' LEU 0.364 0.0 OUTLIER -167.84 -56.4 0.02 OUTLIER 'General case' 0 C--N 1.359 1.019 2 C-N-CA 139.725 7.21 . . . . 0.0 105.484 179.051 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.581 ' HB3' HD22 ' A' ' 81' ' ' LEU . 1.4 p30 -89.31 85.26 0.13 Allowed Pre-proline 0 C--N 1.357 0.894 1 C-N-CA 131.999 4.119 . . . . 0.0 111.912 171.969 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.459 ' HB3' HG13 ' A' ' 117' ' ' VAL . 2.8 Cg_exo -90.72 -176.08 0.94 Allowed 'Trans proline' 0 CA--C 1.488 -1.782 0 C-N-CA 124.136 3.224 . . . . 0.0 117.297 -161.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 16.6 m -112.41 136.07 52.34 Favored 'General case' 0 N--CA 1.439 -1.006 1 N-CA-C 100.192 -4.003 . . . . 0.0 100.192 162.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.5 mp -100.73 140.83 34.46 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 102.415 -3.18 . . . . 0.0 102.415 -175.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -100.28 -0.58 38.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.889 -1.132 . . . . 0.0 110.412 -166.592 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 45' ' ' TYR . 8.4 t 174.21 128.92 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -170.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -115.59 109.79 18.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 101.309 -3.589 . . . . 0.0 101.309 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 10.3 ttt -104.28 122.66 45.87 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.191 2.196 . . . . 0.0 107.423 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.301 . . -129.07 113.74 15.51 Favored 'General case' 0 N--CA 1.435 -1.213 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 173.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -144.24 159.98 15.37 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 C-N-CA 125.378 1.471 . . . . 0.0 111.836 -176.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.945 HD13 HD11 ' A' ' 141' ' ' LEU . 0.2 OUTLIER -140.11 -179.08 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 128.236 2.614 . . . . 0.0 108.989 -175.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.409 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -138.12 122.98 18.88 Favored 'General case' 0 CA--C 1.56 1.331 0 N-CA-C 117.938 2.57 . . . . 0.0 117.938 179.168 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.326 46.5 m 172.72 -76.01 0.0 OUTLIER 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.989 2.915 . . . . 0.0 105.486 177.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.459 ' HG2' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER 168.45 -123.78 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.156 1 N-CA-C 95.722 -5.659 . . . . 0.0 95.722 -172.363 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.459 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 -58.94 -24.72 62.82 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 130.979 3.711 . . . . 0.0 119.682 173.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.945 HD11 HD13 ' A' ' 136' ' ' ILE 0.359 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.125 2 C-N-CA 135.802 5.641 . . . . 0.0 124.276 178.991 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.411 HG21 HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.466 -2.251 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -77.82 115.24 17.41 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 105.433 -2.062 . . . . 0.0 105.433 176.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 11.0 t -75.38 143.84 42.57 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -124.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.632 ' HA ' ' CG ' ' A' ' 73' ' ' HIS . 3.1 tp60 . . . . . 0 C--O 1.263 1.764 0 C-N-CA 129.235 3.014 . . . . 0.0 109.841 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.462 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.452 2.5 m120 . . . . . 0 C--O 1.225 -0.202 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 -58.21 1.92 Allowed 'General case' 0 C--O 1.246 0.906 1 C-N-CA 132.504 4.321 . . . . 0.0 105.465 160.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.436 6.7 mt-10 -63.99 -8.74 12.47 Favored 'General case' 0 C--O 1.205 -1.243 0 O-C-N 119.49 -2.006 . . . . 0.0 115.358 177.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.5 p -67.93 -35.65 72.82 Favored 'Isoleucine or valine' 0 C--N 1.365 1.262 0 C-N-CA 131.488 3.915 . . . . 0.0 113.339 171.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -78.64 -43.81 25.32 Favored 'General case' 0 CA--C 1.497 -1.095 1 C-N-CA 133.062 4.545 . . . . 0.0 107.721 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.7 mt -64.39 -44.1 97.11 Favored 'Isoleucine or valine' 0 C--N 1.374 1.658 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.423 166.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.47 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.267 26.5 mmm-85 -54.8 -50.34 68.76 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 130.576 3.55 . . . . 0.0 111.536 174.259 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -57.89 -36.72 72.8 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 118.596 2.813 . . . . 0.0 118.596 163.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -76.64 -44.43 34.09 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 118.17 -2.831 . . . . 0.0 113.259 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 30.6 mmmt -63.67 -30.43 71.54 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 131.075 3.75 . . . . 0.0 106.95 172.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.533 HD22 ' CD2' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -67.87 -41.02 83.47 Favored 'General case' 0 C--N 1.373 1.619 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 162.334 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.4 mtp180 -60.15 -38.06 82.01 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.404 2.82 . . . . 0.0 112.425 171.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.8 mmt-85 -63.23 -53.25 55.97 Favored 'General case' 0 C--N 1.374 1.641 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB2' HD23 ' A' ' 14' ' ' LEU . 8.4 m-70 -59.07 -50.37 74.33 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 130.226 3.41 . . . . 0.0 112.343 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.546 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.62 -54.1 49.39 Favored 'General case' 0 C--N 1.378 1.819 0 C-N-CA 130.176 3.391 . . . . 0.0 111.165 176.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -73.57 -38.75 65.08 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -65.59 -43.73 88.8 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 125.438 1.495 . . . . 0.0 112.826 177.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.626 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.257 44.2 mt-10 -75.26 -28.99 60.03 Favored 'General case' 0 C--N 1.361 1.096 0 O-C-N 121.08 -1.012 . . . . 0.0 111.732 171.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.409 ' CE2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -67.89 -28.65 67.69 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 117.883 -3.011 . . . . 0.0 114.827 171.103 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -69.16 -37.04 78.02 Favored 'General case' 0 C--N 1.372 1.567 0 C-N-CA 125.629 1.572 . . . . 0.0 109.393 165.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.577 HE21 ' CE1' ' A' ' 68' ' ' HIS . 27.8 tt0 -58.9 -43.15 90.97 Favored 'General case' 0 C--N 1.369 1.451 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 169.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.528 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -72.42 -46.23 57.01 Favored 'Isoleucine or valine' 0 C--N 1.366 1.32 0 O-C-N 121.267 -0.896 . . . . 0.0 111.626 176.288 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.448 ' HA ' ' CG1' ' A' ' 29' ' ' ILE 0.634 17.7 p30 -71.98 -22.62 61.41 Favored 'General case' 0 C--N 1.372 1.586 0 O-C-N 119.733 -1.855 . . . . 0.0 115.447 175.837 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -74.37 -43.11 57.92 Favored 'General case' 0 C--N 1.373 1.591 0 O-C-N 119.754 -1.841 . . . . 0.0 110.508 166.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.5 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.312 0.3 OUTLIER -64.86 -32.73 74.57 Favored 'General case' 0 C--N 1.395 2.576 0 O-C-N 118.756 -2.465 . . . . 0.0 113.526 173.196 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.549 HG21 HD23 ' A' ' 43' ' ' LEU 0.262 1.5 pp -67.84 -43.45 86.11 Favored 'Isoleucine or valine' 0 C--N 1.375 1.681 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 174.03 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.0 ttm105 -62.84 -37.67 87.72 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 119.748 -1.845 . . . . 0.0 115.853 174.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -76.59 -48.66 18.48 Favored 'General case' 0 CA--C 1.478 -1.793 0 C-N-CA 127.756 2.423 . . . . 0.0 111.27 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.473 ' CB ' HG11 ' A' ' 74' ' ' VAL . . . -68.52 -34.74 76.41 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 t -73.45 -43.33 60.53 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.281 1.432 . . . . 0.0 110.73 175.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -70.74 -35.72 72.82 Favored 'General case' 0 C--N 1.375 1.711 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.75 -32.7 62.17 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 126.194 1.798 . . . . 0.0 113.748 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -16.54 60.54 Favored 'General case' 0 C--N 1.385 2.125 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.56 18.38 28.25 Favored Glycine 0 C--N 1.37 2.426 0 O-C-N 121.123 -0.985 . . . . 0.0 115.289 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.52 HG21 ' CB ' ' A' ' 78' ' ' ASN . 0.6 OUTLIER -104.1 166.93 2.85 Favored 'Isoleucine or valine' 0 C--N 1.357 0.917 0 N-CA-C 101.722 -3.436 . . . . 0.0 101.722 176.03 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.442 ' N ' ' CG2' ' A' ' 38' ' ' VAL 0.298 0.0 OUTLIER -39.18 160.87 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.115 1 C-N-CA 134.417 5.087 . . . . 0.0 118.011 159.925 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.9 p -103.89 117.76 35.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 118.808 -2.433 . . . . 0.0 110.034 -173.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -118.28 153.24 34.28 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-O 122.034 0.921 . . . . 0.0 110.372 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -113.83 105.8 13.7 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 129' ' ' LEU 0.356 0.1 OUTLIER -94.58 120.71 35.24 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 118.845 -2.409 . . . . 0.0 111.671 -169.347 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -132.55 145.23 50.97 Favored 'General case' 0 C--N 1.4 2.801 0 CA-C-N 120.64 1.564 . . . . 0.0 109.426 -170.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.547 ' HA ' ' H ' ' A' ' 132' ' ' ARG . 0.0 OUTLIER -92.65 147.32 22.97 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.582 3.153 . . . . 0.0 114.897 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.4 p -108.45 96.81 6.6 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 128.625 2.77 . . . . 0.0 105.543 175.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.429 ' HG2' ' H ' ' A' ' 47' ' ' GLN . 29.7 mm-40 -48.03 -8.43 0.02 OUTLIER 'General case' 0 C--O 1.2 -1.508 1 C-N-CA 132.056 4.142 . . . . 0.0 119.773 -174.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.34 81.43 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 125.383 3.72 . . . . 0.0 116.695 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.657 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.2 -38.96 92.93 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 129.726 3.21 . . . . 0.0 112.997 171.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.657 ' H ' HD22 ' A' ' 49' ' ' LEU . 5.9 tt -72.01 -36.59 69.76 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 127.456 2.303 . . . . 0.0 111.062 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.58 -30.41 71.13 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 129.642 3.177 . . . . 0.0 108.82 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -69.4 -45.68 68.67 Favored 'General case' 0 C--N 1.37 1.499 0 CA-C-O 124.306 2.003 . . . . 0.0 115.315 164.325 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.518 ' HB1' ' CD ' ' A' ' 60' ' ' GLU . . . -75.52 -27.83 58.89 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 117.574 2.435 . . . . 0.0 117.574 -172.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.496 HD12 ' CD2' ' A' ' 50' ' ' LEU . 5.2 tt -74.35 -37.61 45.48 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.845 1 C-N-CA 132.941 4.496 . . . . 0.0 110.587 176.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -107.94 -29.17 9.18 Favored 'General case' 0 C--N 1.38 1.904 0 N-CA-C 117.862 2.541 . . . . 0.0 117.862 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.81 -45.32 17.12 Favored 'General case' 0 C--N 1.357 0.933 0 CA-C-N 121.663 2.029 . . . . 0.0 114.35 -172.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.642 ' CG ' HD23 ' A' ' 141' ' ' LEU 0.276 0.0 OUTLIER -103.35 -44.05 5.26 Favored 'General case' 0 CA--C 1.48 -1.749 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 171.423 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.474 HG22 ' O ' ' A' ' 54' ' ' ILE 0.488 0.0 OUTLIER 74.82 -168.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.854 1 C-N-CA 131.984 4.114 . . . . 0.0 112.638 179.132 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.434 ' HA ' ' HG ' ' A' ' 14' ' ' LEU 0.252 50.2 p30 21.94 49.54 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 1 C-N-CA 131.909 4.083 . . . . 0.0 117.786 179.002 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.518 ' CD ' ' HB1' ' A' ' 53' ' ' ALA 0.5 11.4 pt-20 -80.76 62.99 5.0 Favored 'General case' 0 C--N 1.362 1.12 0 CA-C-O 127.308 3.432 . . . . 0.0 112.227 -172.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.448 ' HA ' ' HB2' ' A' ' 64' ' ' PHE 0.561 1.4 p -80.64 -15.67 56.0 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.223 2.609 . . . . 0.0 116.994 176.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -71.44 -33.28 69.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.823 2.449 . . . . 0.0 107.871 167.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 136' ' ' ILE . 94.0 t -69.61 -36.21 69.66 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 128.059 2.544 . . . . 0.0 108.945 175.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 31.5 m-85 -66.92 -34.91 78.82 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.498 1.919 . . . . 0.0 115.826 164.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -83.01 -36.72 24.79 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-N 122.032 2.196 . . . . 0.0 112.086 -176.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.836 HD13 HD13 ' A' ' 111' ' ' LEU . 2.8 tt -65.41 -42.61 92.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.648 1.579 . . . . 0.0 110.934 167.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.926 0.0 OUTLIER -77.84 -15.15 59.27 Favored 'General case' 0 C--N 1.368 1.387 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 173.596 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.577 ' CE1' HE21 ' A' ' 24' ' ' GLN 0.283 41.6 m-70 -83.77 -15.83 47.03 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 127.221 2.209 . . . . 0.0 112.042 166.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.489 0.0 OUTLIER -82.91 -27.49 30.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 119.973 -1.705 . . . . 0.0 109.107 155.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.653 HD12 ' CE1' ' A' ' 73' ' ' HIS . 18.7 mm -67.57 -9.55 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 C-N-CA 127.502 2.321 . . . . 0.0 113.537 170.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.5 ' HB2' ' CD ' ' A' ' 28' ' ' GLU . 62.2 pttt -49.98 -33.84 19.1 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 120.609 3.559 . . . . 0.0 120.609 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.497 ' HA ' HG12 ' A' ' 74' ' ' VAL . 31.4 t70 -101.62 8.41 41.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.517 -1.364 . . . . 0.0 107.454 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.762 ' HE1' HD11 ' A' ' 150' ' ' ILE . 10.7 m170 -66.87 -8.88 32.32 Favored 'General case' 0 C--N 1.395 2.569 0 C-N-CA 129.125 2.97 . . . . 0.0 110.988 171.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.497 HG12 ' HA ' ' A' ' 72' ' ' ASP . 9.9 p -41.38 -46.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 128.968 2.907 . . . . 0.0 112.02 157.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 71.5 mt -68.46 -23.88 64.65 Favored 'General case' 0 C--N 1.36 1.045 0 N-CA-C 117.563 2.431 . . . . 0.0 117.563 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -75.47 -46.63 31.34 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.541 1.536 . . . . 0.0 111.686 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.39 14.7 p -66.3 -29.0 45.25 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.4 0 C-N-CA 127.474 2.31 . . . . 0.0 110.206 172.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 75' ' ' LEU . 73.0 m-20 -74.19 -38.69 63.55 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 128.285 2.634 . . . . 0.0 116.67 169.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -30.42 71.16 Favored 'General case' 0 C--N 1.372 1.555 0 C-N-CA 126.156 1.782 . . . . 0.0 110.896 172.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.22 -38.96 82.42 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 128.577 2.751 . . . . 0.0 112.283 166.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.513 HD11 ' HD2' ' A' ' 127' ' ' PRO . 2.5 tp . . . . . 0 C--N 1.368 1.393 0 C-N-CA 128.551 2.74 . . . . 0.0 118.134 171.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.729 0 CA-C-O 122.408 1.005 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.54 147.63 34.97 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 127.193 2.197 . . . . 0.0 113.975 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.7 tt -135.38 123.74 23.27 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -129.54 130.25 45.52 Favored 'General case' 0 C--N 1.365 1.279 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.41 HG22 HG12 ' A' ' 150' ' ' ILE 0.493 0.0 OUTLIER -135.27 140.72 44.4 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.294 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.9 t -124.71 143.6 50.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 119.223 -2.173 . . . . 0.0 113.213 -173.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.588 ' HB3' HD21 ' A' ' 66' ' ' LEU . 27.0 t70 -124.64 82.77 2.08 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 120.018 -1.677 . . . . 0.0 108.322 174.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.52 -47.0 0.05 OUTLIER Glycine 0 C--N 1.368 2.339 0 C-N-CA 129.78 3.562 . . . . 0.0 119.419 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -119.24 -49.17 2.4 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 128.219 2.608 . . . . 0.0 107.421 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.836 HD13 HD13 ' A' ' 66' ' ' LEU 0.318 5.6 mp -80.05 134.45 36.21 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 122.382 2.355 . . . . 0.0 117.062 179.234 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -104.81 101.64 11.23 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 104.987 -2.227 . . . . 0.0 104.987 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.453 ' HG ' HG13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -102.87 122.01 43.67 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 177.616 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.79 135.38 12.49 Favored Glycine 0 C--N 1.356 1.671 0 N-CA-C 106.76 -2.536 . . . . 0.0 106.76 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.9 135.58 48.52 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 48.5 m -135.5 134.62 39.69 Favored 'General case' 0 C--N 1.371 1.523 0 O-C-N 119.049 -2.282 . . . . 0.0 105.248 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.485 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 14.9 m -66.48 166.46 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.572 0 C-N-CA 125.385 1.474 . . . . 0.0 111.936 177.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.371 24.4 p -67.45 63.19 0.07 Allowed 'General case' 0 C--N 1.35 0.63 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -24.43 -47.0 0.09 OUTLIER Pre-proline 0 C--N 1.353 0.756 1 C-N-CA 137.356 6.262 . . . . 0.0 118.988 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -73.72 53.06 2.66 Favored 'Trans proline' 0 CA--C 1.566 2.109 0 C-N-CA 123.718 2.945 . . . . 0.0 113.364 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -159.23 152.34 22.22 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.914 2.086 . . . . 0.0 110.706 -175.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -126.09 11.25 7.61 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 120.472 1.487 . . . . 0.0 112.465 170.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.314 0.0 OUTLIER -95.34 2.83 54.81 Favored 'General case' 0 C--N 1.364 1.215 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 -176.361 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.536 ' HB2' ' HD3' ' A' ' 125' ' ' LYS 0.53 0.0 OUTLIER -45.66 149.75 0.57 Allowed 'General case' 0 C--N 1.353 0.741 1 N-CA-C 122.074 4.101 . . . . 0.0 122.074 178.427 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.708 ' H ' ' HD3' ' A' ' 127' ' ' PRO 0.816 10.8 mmtt 125.01 92.79 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.594 1 C-N-CA 134.606 5.162 . . . . 0.0 103.787 169.766 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.414 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.8 t70 112.51 13.48 0.0 OUTLIER Pre-proline 0 CA--C 1.592 2.572 1 C-N-CA 131.706 4.002 . . . . 0.0 113.49 -156.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.708 ' HD3' ' H ' ' A' ' 125' ' ' LYS . 85.0 Cg_endo -63.88 -175.44 0.29 Allowed 'Trans proline' 0 C--N 1.387 2.556 2 C-N-CA 127.987 5.791 . . . . 0.0 119.364 175.23 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 38.4 m -101.99 164.52 11.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 109.905 -3.316 . . . . 0.0 104.467 170.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 43' ' ' LEU . 5.8 mp -102.48 143.5 32.11 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 102.406 -3.183 . . . . 0.0 102.406 171.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.02 53.99 1.97 Allowed 'General case' 0 CA--C 1.484 -1.583 0 N-CA-C 104.243 -2.503 . . . . 0.0 104.243 -170.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 1.8 m 147.28 104.2 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 104.587 -2.375 . . . . 0.0 104.587 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.547 ' H ' ' HA ' ' A' ' 45' ' ' TYR . 7.9 tpt180 -117.39 112.76 21.12 Favored 'General case' 0 N--CA 1.439 -0.992 1 N-CA-C 99.667 -4.198 . . . . 0.0 99.667 166.953 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.0 ttt -109.07 126.83 53.58 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.28 114.91 17.51 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 171.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . 0.481 HD11 ' CB ' ' A' ' 49' ' ' LEU . 0.5 OUTLIER -137.57 157.58 33.83 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.205 1.802 . . . . 0.0 108.092 178.845 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.662 HD11 HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -142.08 175.08 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 N-CA-C 100.546 -3.872 . . . . 0.0 100.546 173.177 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -115.08 137.86 51.53 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.592 3.157 . . . . 0.0 106.194 168.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.468 ' HB3' ' HG3' ' A' ' 139' ' ' ARG . 17.5 m -140.63 -127.09 0.1 Allowed 'General case' 0 CA--C 1.502 -0.875 0 CA-C-N 121.009 1.731 . . . . 0.0 112.872 -178.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.599 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -92.82 -85.11 0.27 Allowed 'General case' 0 N--CA 1.428 -1.55 1 C-N-CA 134.184 4.994 . . . . 0.0 105.671 179.97 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.599 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 5.5 ptp180 -94.23 -9.06 37.43 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 128.376 2.67 . . . . 0.0 112.907 174.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.642 HD23 ' CG ' ' A' ' 57' ' ' GLU 0.508 0.4 OUTLIER . . . . . 0 C--N 1.382 1.984 0 C-N-CA 129.407 3.083 . . . . 0.0 110.315 -177.688 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.762 HD11 ' HE1' ' A' ' 73' ' ' HIS . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.357 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.406 ' HD3' HG22 ' A' ' 152' ' ' THR 0.5 0.0 OUTLIER -122.69 153.88 38.82 Favored 'General case' 0 CA--C 1.478 -1.818 1 C-N-CA 132.527 4.331 . . . . 0.0 104.652 167.956 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.412 ' HB ' ' CD2' ' A' ' 73' ' ' HIS 0.339 9.2 t -70.65 97.9 1.42 Allowed 'General case' 0 N--CA 1.431 -1.375 1 CA-C-O 131.763 5.554 . . . . 0.0 117.932 -150.787 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.591 HE22 ' CE1' ' A' ' 73' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.42 -1.958 3 C-N-CA 148.359 10.663 . . . . 0.0 121.009 166.411 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.408 ' HA ' HG13 ' A' ' 7' ' ' VAL . 5.1 t-20 . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 118.252 2.686 . . . . 0.0 118.252 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -60.81 2.05 Favored 'General case' 0 C--N 1.353 0.72 1 C-N-CA 133.602 4.761 . . . . 0.0 110.253 171.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -73.17 -17.28 61.39 Favored 'General case' 0 C--N 1.373 1.588 0 C-N-CA 126.815 2.046 . . . . 0.0 112.571 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.408 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.253 0.6 OUTLIER -80.7 -36.61 15.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 127.133 2.173 . . . . 0.0 110.598 175.153 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -64.63 -46.25 83.39 Favored 'General case' 0 C--N 1.375 1.674 0 C-N-CA 128.344 2.657 . . . . 0.0 108.657 175.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.8 mt -54.59 -43.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.362 1.118 0 C-N-CA 126.279 1.831 . . . . 0.0 112.968 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.38 11.0 ttt180 -67.48 -42.91 82.2 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 171.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -60.27 -27.52 67.32 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 165.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -76.91 -50.72 12.66 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 130.315 3.446 . . . . 0.0 109.99 173.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -57.25 -29.22 63.63 Favored 'General case' 0 C--N 1.378 1.814 0 C-N-CA 128.234 2.614 . . . . 0.0 110.666 170.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' A' ' 54' ' ' ILE . 4.0 tp -72.08 -44.14 63.72 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 124.319 1.048 . . . . 0.0 113.664 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -54.9 -43.66 73.46 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.319 -1.488 . . . . 0.0 110.607 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.2 mtp85 -63.39 -46.1 87.99 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 166.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.38 -47.84 82.55 Favored 'General case' 0 C--N 1.384 2.077 0 C-N-CA 130.111 3.364 . . . . 0.0 113.268 175.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.613 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.91 -46.71 83.6 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 130.407 3.483 . . . . 0.0 110.732 176.212 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.93 -42.66 57.29 Favored 'General case' 0 C--N 1.377 1.765 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.7 m -68.31 -43.09 78.4 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 127.023 2.129 . . . . 0.0 112.281 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.63 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.409 43.8 mt-10 -74.55 -28.72 61.07 Favored 'General case' 0 C--N 1.364 1.208 0 O-C-N 120.442 -1.411 . . . . 0.0 112.223 169.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.256 0.6 OUTLIER -60.71 -34.07 73.83 Favored 'General case' 0 C--N 1.38 1.924 0 O-C-N 119.035 -2.291 . . . . 0.0 112.978 165.384 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.7 mtt85 -66.23 -35.81 81.38 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 120.648 -1.283 . . . . 0.0 112.101 166.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.44 ' CG ' ' CE1' ' A' ' 68' ' ' HIS . 8.6 tp-100 -60.8 -46.74 89.32 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 116.879 2.178 . . . . 0.0 116.879 166.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.534 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.2 mt -70.98 -45.07 74.81 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 O-C-N 120.657 -1.277 . . . . 0.0 111.756 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.646 0.5 OUTLIER -71.28 -23.68 62.01 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 119.346 -2.097 . . . . 0.0 114.929 175.203 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -73.11 -35.2 66.53 Favored 'General case' 0 C--N 1.384 2.085 0 O-C-N 121.244 -0.91 . . . . 0.0 110.822 169.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -66.51 -39.74 88.84 Favored 'General case' 0 C--N 1.391 2.408 0 O-C-N 119.127 -2.233 . . . . 0.0 112.002 169.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.469 HG13 HG22 ' A' ' 74' ' ' VAL . 1.4 mp -61.99 -46.32 96.75 Favored 'Isoleucine or valine' 0 C--N 1.37 1.457 0 CA-C-N 119.52 1.055 . . . . 0.0 113.567 172.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 -59.46 -39.96 85.33 Favored 'General case' 0 C--N 1.357 0.92 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 173.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -76.49 -44.71 34.19 Favored 'General case' 0 CA--C 1.487 -1.45 0 O-C-N 119.428 -2.045 . . . . 0.0 111.183 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.88 -44.84 60.83 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 124.764 1.226 . . . . 0.0 114.031 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.2 t -69.38 -28.8 66.49 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 120.106 -1.621 . . . . 0.0 110.899 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -75.75 -41.0 54.45 Favored 'General case' 0 C--N 1.389 2.309 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 165.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.22 -31.93 64.45 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 127.059 2.144 . . . . 0.0 114.809 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.67 -12.34 59.99 Favored 'General case' 0 C--N 1.382 1.99 0 O-C-N 121.107 -0.996 . . . . 0.0 111.691 166.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.66 18.16 60.58 Favored Glycine 0 C--N 1.381 3.065 0 O-C-N 120.813 -1.179 . . . . 0.0 114.813 168.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.523 ' HB ' HD12 ' A' ' 81' ' ' LEU 0.394 0.7 OUTLIER -99.2 178.88 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.168 0 C-N-CA 126.917 2.087 . . . . 0.0 110.344 -172.871 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 t -29.23 -55.11 0.14 Allowed 'General case' 0 N--CA 1.488 1.439 1 C-N-CA 132.127 4.171 . . . . 0.0 116.984 -174.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.29 3.2 t 82.46 111.65 0.06 Allowed 'General case' 0 C--N 1.359 1.009 0 C-N-CA 131.652 3.981 . . . . 0.0 108.638 -174.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 77' ' ' VAL . 3.9 p90 -113.24 158.42 20.51 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 122.347 1.07 . . . . 0.0 111.065 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -100.72 155.66 17.77 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 127.536 2.334 . . . . 0.0 105.371 175.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -119.34 126.02 50.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 O-C-N 120.442 -1.411 . . . . 0.0 108.596 -174.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -115.27 169.92 8.77 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-O 124.298 1.999 . . . . 0.0 108.038 174.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.636 ' CD2' HD13 ' A' ' 50' ' ' LEU 0.293 14.1 m-30 -107.99 172.13 7.01 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.3 2.24 . . . . 0.0 108.623 176.209 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.34 91.36 3.49 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 101.963 -3.347 . . . . 0.0 101.963 153.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.488 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.321 0.0 OUTLIER -56.25 -10.46 0.88 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 127.631 2.373 . . . . 0.0 115.654 179.858 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.67 -38.74 28.47 Favored 'General case' 0 C--N 1.374 1.652 0 C-N-CA 129.031 2.932 . . . . 0.0 111.222 171.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.599 HD13 ' N ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -62.55 -46.07 90.04 Favored 'General case' 0 C--N 1.372 1.552 0 CA-C-O 125.297 2.475 . . . . 0.0 108.377 167.502 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.673 HD23 ' CG1' ' A' ' 54' ' ' ILE 0.298 0.1 OUTLIER -62.9 -37.54 87.35 Favored 'General case' 0 C--O 1.21 -1.017 0 C-N-CA 127.474 2.31 . . . . 0.0 110.192 172.534 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -54.91 -32.74 61.42 Favored 'General case' 0 C--N 1.37 1.472 0 O-C-N 117.603 -3.186 . . . . 0.0 111.876 168.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -74.94 -58.01 3.55 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 158.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.4 -27.47 66.02 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 119.096 2.999 . . . . 0.0 119.096 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.673 ' CG1' HD23 ' A' ' 50' ' ' LEU . 29.8 mt -75.15 -48.62 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.761 0 C-N-CA 129.977 3.311 . . . . 0.0 110.709 172.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.594 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -106.62 -12.12 15.66 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -176.443 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -78.44 -3.5 43.66 Favored 'General case' 0 C--N 1.365 1.261 0 CA-C-N 122.347 2.339 . . . . 0.0 114.305 -174.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -157.86 -48.99 0.06 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.766 1.626 . . . . 0.0 111.346 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.594 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.542 0.2 OUTLIER 83.59 160.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.372 1.587 1 C-N-CA 131.97 4.108 . . . . 0.0 112.036 178.142 . . . . . . . . 5 4 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.537 ' N ' HD22 ' A' ' 14' ' ' LEU . 13.5 t70 38.14 54.29 1.7 Allowed 'General case' 0 N--CA 1.513 2.685 0 C-N-CA 131.465 3.906 . . . . 0.0 114.642 -176.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.625 ' HA ' HH22 ' A' ' 139' ' ' ARG 0.484 10.4 pt-20 -75.92 66.03 2.09 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 125.499 2.571 . . . . 0.0 113.822 178.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.374 18.2 p -79.26 -16.85 55.82 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.925 2.89 . . . . 0.0 114.108 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -65.55 -33.95 77.12 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 129.652 3.181 . . . . 0.0 110.188 166.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -65.77 -46.68 88.24 Favored 'Isoleucine or valine' 0 C--N 1.362 1.116 0 C-N-CA 127.567 2.347 . . . . 0.0 109.888 -174.403 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.63 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 48.7 m-85 -62.41 -39.54 93.6 Favored 'General case' 0 C--O 1.21 -0.996 1 C-N-CA 132.572 4.349 . . . . 0.0 112.473 168.031 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -66.53 -45.41 79.54 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.724 2.056 . . . . 0.0 112.787 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.662 HD12 HD21 ' A' ' 111' ' ' LEU . 1.9 tm? -64.79 -49.3 71.22 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.974 1.309 . . . . 0.0 113.104 168.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.455 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.883 0.0 OUTLIER -76.38 -16.55 59.69 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 118.818 -2.426 . . . . 0.0 114.996 -176.908 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.534 ' CE1' HG12 ' A' ' 25' ' ' ILE . 54.5 m-70 -78.69 -27.57 45.1 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.729 2.412 . . . . 0.0 110.249 162.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -79.92 -18.98 49.15 Favored 'General case' 0 C--N 1.366 1.317 0 O-C-N 119.578 -1.951 . . . . 0.0 111.972 166.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.282 0.0 OUTLIER -97.62 -16.23 7.17 Favored 'Isoleucine or valine' 0 C--N 1.369 1.444 0 C-N-CA 127.168 2.187 . . . . 0.0 114.052 -177.348 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -52.15 -4.12 0.03 OUTLIER 'General case' 0 C--N 1.363 1.161 1 C-N-CA 133.973 4.909 . . . . 0.0 119.536 -175.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.262 29.7 t70 -95.77 -3.92 44.89 Favored 'General case' 0 N--CA 1.416 -2.146 1 C-N-CA 133.261 4.624 . . . . 0.0 108.373 178.783 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.44 ' CE1' HD13 ' A' ' 106' ' ' ILE . 0.2 OUTLIER -57.56 -8.24 0.81 Allowed 'General case' 0 C--N 1.385 2.113 0 C-N-CA 130.282 3.433 . . . . 0.0 114.149 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.469 HG22 HG13 ' A' ' 29' ' ' ILE . 40.3 t -42.05 -32.04 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 128.654 2.782 . . . . 0.0 115.225 157.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.52 -37.46 50.89 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.856 2.462 . . . . 0.0 113.326 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.08 -35.81 72.0 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 119.471 -2.018 . . . . 0.0 111.21 172.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.463 HG11 ' CZ ' ' A' ' 41' ' ' PHE 0.541 16.4 t -72.33 -28.55 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.16 0 C-N-CA 129.933 3.293 . . . . 0.0 112.199 173.254 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.406 ' ND2' HG11 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -67.01 -43.89 81.72 Favored 'General case' 0 C--N 1.379 1.876 0 C-N-CA 129.914 3.286 . . . . 0.0 111.278 168.301 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -63.45 -35.77 81.54 Favored 'General case' 0 C--N 1.381 1.973 0 C-N-CA 126.273 1.829 . . . . 0.0 112.182 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.32 -39.14 89.41 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 127.023 2.129 . . . . 0.0 114.539 169.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.523 HD12 ' HB ' ' A' ' 38' ' ' VAL . 2.4 tm? . . . . . 0 C--N 1.373 1.591 0 C-N-CA 130.464 3.506 . . . . 0.0 113.559 173.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.9 0 N-CA-C 117.518 1.767 . . . . 0.0 117.518 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -141.31 155.14 46.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 126.363 1.865 . . . . 0.0 107.483 173.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.0 mt -110.66 140.46 44.99 Favored 'General case' 0 C--N 1.348 0.505 0 C-N-CA 127.011 2.125 . . . . 0.0 110.034 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -129.29 110.85 12.29 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 103.877 -2.638 . . . . 0.0 103.877 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.44 HD13 ' CE1' ' A' ' 73' ' ' HIS . 13.9 pt -134.9 139.68 46.91 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 -177.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.4 m -126.69 111.16 13.95 Favored 'General case' 0 C--N 1.367 1.339 0 N-CA-C 104.234 -2.506 . . . . 0.0 104.234 -176.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 150' ' ' ILE . 4.0 t0 -136.78 161.18 36.68 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 103.618 -2.734 . . . . 0.0 103.618 -171.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.502 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 82.65 -58.01 5.02 Favored Glycine 0 N--CA 1.484 1.846 0 O-C-N 120.072 -1.642 . . . . 0.0 116.837 169.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 162.11 -29.77 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.276 1 C-N-CA 136.344 5.858 . . . . 0.0 106.691 -167.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.693 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.588 0.9 OUTLIER -79.67 137.42 37.07 Favored 'General case' 0 C--N 1.375 1.714 2 C-N-CA 132.33 4.252 . . . . 0.0 122.131 -176.858 . . . . . . . . 5 4 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -89.74 101.21 13.91 Favored 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 103.668 -2.716 . . . . 0.0 103.668 171.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.343 22.8 mt -94.23 137.49 33.34 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.1 2.16 . . . . 0.0 106.404 -178.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.82 132.69 8.51 Favored Glycine 0 C--N 1.349 1.268 0 O-C-N 119.761 -1.837 . . . . 0.0 110.372 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . 0.266 1.7 m-30 -120.47 140.13 51.86 Favored 'General case' 0 C--N 1.368 1.408 0 N-CA-C 101.407 -3.553 . . . . 0.0 101.407 172.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 92.5 m -124.82 151.84 44.7 Favored 'General case' 0 CA--C 1.49 -1.347 1 N-CA-C 99.833 -4.136 . . . . 0.0 99.833 171.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 118' ' ' CYS . 45.4 t -74.33 156.61 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 126.47 1.908 . . . . 0.0 107.931 169.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.545 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.29 72.2 m -68.54 95.49 0.64 Allowed 'General case' 0 C--N 1.362 1.133 0 CA-C-O 123.849 1.785 . . . . 0.0 109.097 164.76 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -71.94 -40.09 7.58 Favored Pre-proline 0 N--CA 1.432 -1.374 0 C-N-CA 130.795 3.638 . . . . 0.0 112.875 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -74.29 59.74 4.69 Favored 'Trans proline' 0 CA--C 1.559 1.73 0 CA-C-N 127.028 3.546 . . . . 0.0 114.122 174.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.361 4.3 p30 -162.54 -80.55 0.04 OUTLIER 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.405 2.282 . . . . 0.0 110.502 173.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . 0.403 23.9 tt0 19.52 88.29 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.7 2 C-N-CA 137.796 6.438 . . . . 0.0 122.498 -174.741 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -118.66 0.51 11.51 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 129.821 3.248 . . . . 0.0 107.661 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -114.88 -144.46 0.39 Allowed 'General case' 0 C--N 1.349 0.567 0 C-N-CA 128.298 2.639 . . . . 0.0 112.791 -165.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.264 7.9 mptt -116.84 -73.72 0.63 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 -178.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -152.98 92.03 3.36 Favored Pre-proline 0 C--N 1.353 0.752 0 CA-C-O 112.797 -3.478 . . . . 0.0 109.427 171.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -125.59 17.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.243 1 CA-C-N 130.678 4.849 . . . . 0.0 120.615 -174.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.6 t -147.56 148.21 30.91 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 156.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.2 mt -103.32 133.11 48.94 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 170.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.545 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 20.8 tt0 -91.29 44.04 1.17 Allowed 'General case' 0 C--N 1.369 1.427 0 CA-C-N 122.247 2.294 . . . . 0.0 112.355 -173.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 30.7 p 129.13 140.39 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 129.087 2.955 . . . . 0.0 106.748 -175.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -116.02 109.54 17.67 Favored 'General case' 0 N--CA 1.441 -0.914 1 N-CA-C 97.407 -5.034 . . . . 0.0 97.407 157.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.17 132.07 40.52 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 127.501 2.321 . . . . 0.0 107.662 -176.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.16 115.03 17.07 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.8 mt -141.58 129.78 22.35 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 CA-C-O 123.868 1.794 . . . . 0.0 106.397 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.693 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -118.88 179.39 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 124.829 2.252 . . . . 0.0 114.27 -170.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.65 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.7 OUTLIER -143.5 136.07 27.27 Favored 'General case' 0 N--CA 1.442 -0.846 2 C-N-CA 134.994 5.318 . . . . 0.0 98.251 171.068 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.592 ' HB2' ' HG ' ' A' ' 141' ' ' LEU . 1.0 OUTLIER -158.71 -110.45 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -169.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.625 HH22 ' HA ' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -113.04 -83.68 0.59 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.184 2.593 . . . . 0.0 111.041 -166.403 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.617 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 1.0 OUTLIER -86.16 7.84 23.37 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 131.556 3.942 . . . . 0.0 109.695 169.161 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER . . . . . 0 CA--C 1.572 1.827 0 CA-C-O 115.82 -2.038 . . . . 0.0 106.741 -169.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 108' ' ' ASP . 1.4 pt . . . . . 0 C--O 1.218 -0.581 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.412 46.4 mtpt -120.56 148.67 43.56 Favored 'General case' 0 CA--C 1.496 -1.115 1 N-CA-C 96.977 -5.194 . . . . 0.0 96.977 162.804 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 6.4 t -74.61 144.06 44.08 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 121.035 3.717 . . . . 0.0 121.035 -131.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 . . . . . 0 C--O 1.264 1.852 2 CA-C-N 105.926 -5.125 . . . . 0.0 110.655 -172.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.447 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 6.2 t-20 . . . . . 0 C--O 1.222 -0.363 0 CA-C-O 122.795 1.283 . . . . 0.0 109.442 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -64.7 0.84 Allowed 'General case' 0 C--N 1.355 0.826 0 C-N-CA 130.583 3.553 . . . . 0.0 112.058 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -71.45 -12.02 61.18 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 125.554 1.541 . . . . 0.0 113.241 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.447 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.6 OUTLIER -81.2 -39.31 17.32 Favored 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 127.829 2.452 . . . . 0.0 110.22 174.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -66.1 -42.81 88.76 Favored 'General case' 0 C--N 1.371 1.505 0 C-N-CA 129.047 2.939 . . . . 0.0 109.114 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.2 -43.36 89.45 Favored 'Isoleucine or valine' 0 C--N 1.377 1.766 0 C-N-CA 125.348 1.459 . . . . 0.0 111.297 165.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.25 0.0 OUTLIER -58.52 -50.61 73.15 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 169.52 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -56.34 -26.14 51.54 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 117.915 -2.991 . . . . 0.0 115.404 166.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -77.12 -38.23 52.57 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 118.928 -2.358 . . . . 0.0 113.731 165.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.609 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 8.4 mmmt -65.07 -27.78 69.01 Favored 'General case' 0 C--N 1.372 1.557 1 CA-C-O 129.078 4.275 . . . . 0.0 107.376 170.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.594 HD12 HG13 ' A' ' 54' ' ' ILE . 0.3 OUTLIER -71.55 -46.38 59.65 Favored 'General case' 0 C--O 1.206 -1.219 0 O-C-N 116.634 -3.791 . . . . 0.0 112.479 166.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -55.76 -27.6 51.67 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.632 2.086 . . . . 0.0 116.632 167.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.609 ' HG3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -69.88 -49.79 48.82 Favored 'General case' 0 C--N 1.397 2.647 0 CA-C-N 121.842 2.11 . . . . 0.0 112.896 168.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.419 ' CD2' ' HB ' ' A' ' 61' ' ' THR . 0.1 OUTLIER -82.55 -28.67 30.83 Favored 'General case' 0 C--N 1.364 1.218 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -177.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -67.67 -53.92 23.81 Favored 'General case' 0 C--O 1.204 -1.339 0 C-N-CA 127.746 2.418 . . . . 0.0 106.547 172.45 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -74.14 -39.77 63.06 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 119.969 3.322 . . . . 0.0 119.969 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 t -73.21 -41.94 63.21 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.531 -1.356 . . . . 0.0 113.858 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . 0.522 3.4 tt0 -77.86 -28.51 50.07 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 120.109 -1.62 . . . . 0.0 112.803 176.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.688 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -72.6 -27.81 62.4 Favored 'General case' 0 C--N 1.381 1.955 0 O-C-N 118.772 -2.455 . . . . 0.0 112.828 170.152 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.8 mtt85 -66.93 -36.84 83.14 Favored 'General case' 0 C--N 1.378 1.807 0 C-N-CA 125.612 1.565 . . . . 0.0 110.156 164.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -63.02 -43.02 99.89 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.444 HG22 HD12 ' A' ' 29' ' ' ILE . 8.0 mt -69.83 -45.34 77.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.396 0 CA-C-N 120.009 1.277 . . . . 0.0 111.859 173.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.526 13.2 p30 -69.12 -24.22 64.09 Favored 'General case' 0 C--N 1.379 1.883 0 O-C-N 119.842 -1.786 . . . . 0.0 115.335 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -73.84 -47.21 40.01 Favored 'General case' 0 C--N 1.378 1.839 0 C-N-CA 126.926 2.09 . . . . 0.0 110.044 169.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -30.9 70.94 Favored 'General case' 0 C--N 1.398 2.716 0 O-C-N 117.697 -3.127 . . . . 0.0 112.95 174.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.444 HD12 HG22 ' A' ' 25' ' ' ILE . 3.2 mt -63.3 -48.63 86.51 Favored 'Isoleucine or valine' 0 C--N 1.378 1.835 0 C-N-CA 124.675 1.19 . . . . 0.0 112.508 171.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.4 ttt85 -64.37 -37.87 89.03 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 122.34 2.336 . . . . 0.0 115.465 176.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -76.5 -38.16 55.66 Favored 'General case' 0 CA--C 1.473 -1.984 0 C-N-CA 127.157 2.183 . . . . 0.0 112.344 -177.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.56 -43.51 14.43 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.605 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.391 1.5 p -66.79 -30.73 71.01 Favored 'General case' 0 C--N 1.359 1.01 0 O-C-N 120.583 -1.323 . . . . 0.0 112.85 -179.377 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -72.04 -46.58 56.47 Favored 'General case' 0 C--N 1.375 1.68 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 162.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.72 -26.16 66.02 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 116.058 1.873 . . . . 0.0 116.058 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.57 -14.49 62.87 Favored 'General case' 0 C--N 1.376 1.738 0 C-N-CA 127.031 2.132 . . . . 0.0 112.489 166.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.41 17.63 30.81 Favored Glycine 0 C--N 1.377 2.826 0 O-C-N 121.317 -0.864 . . . . 0.0 113.291 169.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.673 HG23 HD22 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -115.82 164.1 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 -176.479 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.703 ' HB2' HD11 ' A' ' 81' ' ' LEU 0.308 0.3 OUTLIER -26.4 -57.52 0.08 Allowed 'General case' 0 C--N 1.361 1.105 1 C-N-CA 133.764 4.826 . . . . 0.0 119.429 -175.441 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.8 t 103.47 122.19 0.01 OUTLIER 'General case' 0 C--N 1.352 0.686 1 C-N-CA 132.103 4.161 . . . . 0.0 107.263 -172.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -113.65 160.53 18.5 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-O 123.037 1.399 . . . . 0.0 112.558 -173.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -110.79 145.76 37.57 Favored 'General case' 0 C--N 1.352 0.681 0 C-N-CA 127.319 2.248 . . . . 0.0 109.481 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' ' 129' ' ' LEU . 15.8 tp -126.35 154.89 42.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 118.897 -2.377 . . . . 0.0 106.665 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -132.37 172.66 12.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 O-C-N 120.202 -1.561 . . . . 0.0 111.016 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.659 ' CD2' HD13 ' A' ' 50' ' ' LEU 0.269 4.3 m-30 -93.49 172.02 8.53 Favored 'General case' 0 CA--C 1.558 1.262 0 CA-C-O 123.125 1.44 . . . . 0.0 109.197 168.17 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.3 t -127.03 98.62 5.39 Favored 'General case' 0 C--N 1.349 0.551 0 N-CA-C 101.562 -3.495 . . . . 0.0 101.562 157.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.486 0.0 OUTLIER -61.58 -10.54 8.37 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 -177.217 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.05 -46.6 13.69 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.851 2.46 . . . . 0.0 111.001 171.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.634 HD13 ' N ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -60.36 -48.49 81.53 Favored 'General case' 0 C--N 1.373 1.625 0 C-N-CA 127.401 2.28 . . . . 0.0 110.153 170.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.659 HD13 ' CD2' ' A' ' 45' ' ' TYR 0.252 6.2 tt -64.25 -33.4 75.72 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 112.54 -2.118 . . . . 0.0 112.553 172.56 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -56.82 -30.09 63.4 Favored 'General case' 0 C--N 1.368 1.395 0 CA-C-N 121.033 1.742 . . . . 0.0 112.109 166.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -84.29 -45.14 13.14 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 162.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.24 75.18 Favored 'General case' 0 C--N 1.371 1.501 0 CA-C-N 123.05 2.659 . . . . 0.0 114.005 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.594 HG13 HD12 ' A' ' 14' ' ' LEU . 1.2 tt -48.51 -34.45 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 131.075 3.75 . . . . 0.0 116.658 177.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HA ' HG22 ' A' ' 58' ' ' ILE . 9.8 mt-30 -92.16 -9.44 42.41 Favored 'General case' 0 C--N 1.362 1.127 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 173.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -94.28 -47.22 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 127.213 2.205 . . . . 0.0 108.733 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.652 ' HG2' HD11 ' A' ' 136' ' ' ILE . 28.2 mt-10 -85.86 -3.27 58.87 Favored 'General case' 0 CA--C 1.492 -1.287 1 C-N-CA 132.003 4.121 . . . . 0.0 117.997 -176.822 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.447 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -17.82 -3.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.063 2 N-CA-C 125.71 5.448 . . . . 0.0 125.71 -177.738 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.446 ' N ' HD13 ' A' ' 58' ' ' ILE . 44.6 t0 142.86 37.91 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.5 1 C-N-CA 134.798 5.239 . . . . 0.0 105.15 -166.235 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.323 54.7 mm-40 -89.67 85.36 6.43 Favored 'General case' 0 CA--C 1.472 -2.032 0 C-N-CA 131.142 3.777 . . . . 0.0 105.933 175.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.419 ' HB ' ' CD2' ' A' ' 17' ' ' HIS 0.475 0.1 OUTLIER -79.7 -11.32 59.86 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 127.908 2.483 . . . . 0.0 114.086 176.021 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.655 ' HE2' HG21 ' A' ' 136' ' ' ILE 0.281 0.7 OUTLIER -61.83 -34.76 76.53 Favored 'General case' 0 N--CA 1.479 1.021 1 C-N-CA 133.896 4.878 . . . . 0.0 111.347 169.233 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 111' ' ' LEU 0.303 0.5 OUTLIER -73.42 -49.76 34.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 C-N-CA 131.373 3.869 . . . . 0.0 106.993 -167.313 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.556 ' HA ' ' CD2' ' A' ' 67' ' ' PHE 0.257 30.7 m-85 -71.23 -29.82 65.59 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 130.928 3.691 . . . . 0.0 112.899 168.5 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.1 -41.74 94.65 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 122.018 2.19 . . . . 0.0 112.185 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.688 HD11 ' HD3' ' A' ' 151' ' ' LYS . 1.9 tm? -64.17 -40.31 95.85 Favored 'General case' 0 CA--C 1.578 2.024 0 C-N-CA 126.246 1.818 . . . . 0.0 112.113 167.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.556 ' CD2' ' HA ' ' A' ' 64' ' ' PHE . 2.2 m-85 -74.36 -17.53 60.81 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 117.925 -2.984 . . . . 0.0 113.351 174.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CD2' ' O ' ' A' ' 64' ' ' PHE 0.355 57.8 m-70 -85.83 -17.04 36.8 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 128.211 2.604 . . . . 0.0 109.671 172.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -75.25 -40.27 59.05 Favored 'General case' 0 C--N 1.371 1.513 0 CA-C-O 118.07 -0.967 . . . . 0.0 111.652 156.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 151' ' ' LYS . 1.6 mm -52.68 -46.24 49.69 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.787 0 C-N-CA 129.251 3.02 . . . . 0.0 114.617 172.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.6 pttp -50.66 -7.95 0.04 OUTLIER 'General case' 0 CA--C 1.491 -1.296 1 C-N-CA 132.591 4.356 . . . . 0.0 121.232 -160.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -106.62 -16.74 14.43 Favored 'General case' 0 N--CA 1.44 -0.975 0 O-C-N 119.932 -1.73 . . . . 0.0 107.854 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.842 ' CD2' ' HB ' ' A' ' 152' ' ' THR 0.286 1.0 OUTLIER -80.57 16.85 1.24 Allowed 'General case' 0 C--N 1.383 2.062 0 C-N-CA 128.229 2.611 . . . . 0.0 113.484 -178.497 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 78.6 t -40.2 -42.64 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.97 0 C-N-CA 129.658 3.183 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.64 -31.39 70.6 Favored 'General case' 0 C--N 1.364 1.217 0 C-N-CA 127.354 2.262 . . . . 0.0 116.205 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -76.25 -45.64 31.81 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 129.037 2.935 . . . . 0.0 113.139 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.363 4.9 p -66.3 -29.63 47.26 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.321 0 CA-C-O 126.562 3.077 . . . . 0.0 111.221 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.605 HD21 ' HB2' ' A' ' 33' ' ' SER . 5.5 m120 -73.77 -31.37 63.27 Favored 'General case' 0 C--N 1.354 0.762 0 O-C-N 118.622 -2.548 . . . . 0.0 115.353 169.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -67.08 -30.51 70.57 Favored 'General case' 0 C--N 1.37 1.469 0 CA-C-N 120.734 1.606 . . . . 0.0 110.697 168.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.28 -36.33 83.76 Favored 'General case' 0 CA--C 1.572 1.812 0 C-N-CA 125.029 1.332 . . . . 0.0 113.205 167.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.713 HD12 ' HA ' ' A' ' 126' ' ' ASP . 10.1 tt . . . . . 0 N--CA 1.5 2.061 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 168.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 N-CA-C 118.15 2.02 . . . . 0.0 118.15 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -131.36 140.31 49.68 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 126.544 1.938 . . . . 0.0 108.877 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mp -122.56 150.63 42.34 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 127.7 2.4 . . . . 0.0 113.451 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -129.52 113.08 14.42 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 127.432 2.293 . . . . 0.0 105.397 -174.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.655 HG21 ' HG2' ' A' ' 153' ' ' GLN 0.283 1.2 pt -134.85 132.83 53.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -175.045 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . 0.255 0.4 OUTLIER -139.73 127.59 22.05 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 119.973 -1.704 . . . . 0.0 111.416 -175.211 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 171.41 169.62 0.09 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 101.431 -3.544 . . . . 0.0 101.431 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.581 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.97 -33.97 4.62 Favored Glycine 0 N--CA 1.491 2.328 0 O-C-N 120.038 -1.663 . . . . 0.0 112.855 -173.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 121.05 -13.47 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.17 1 C-N-CA 137.659 6.384 . . . . 0.0 108.004 -168.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.774 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.788 0.0 OUTLIER -83.12 135.19 34.91 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 119.752 3.241 . . . . 0.0 119.752 -179.036 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -91.87 100.78 13.39 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 104.872 -2.269 . . . . 0.0 104.872 171.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.546 HD11 ' CE1' ' A' ' 67' ' ' PHE 0.269 3.5 mm? -95.98 132.89 40.83 Favored 'General case' 0 CA--C 1.558 1.268 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 174.28 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -118.36 128.78 7.88 Favored Glycine 0 C--N 1.351 1.392 0 N-CA-C 105.131 -3.188 . . . . 0.0 105.131 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.554 ' CE1' HD11 ' A' ' 106' ' ' ILE 0.258 6.0 m-30 -125.92 151.33 47.1 Favored 'General case' 0 C--N 1.366 1.289 0 CA-C-N 122.465 3.133 . . . . 0.0 102.797 -179.437 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.8 m -151.02 131.67 13.96 Favored 'General case' 0 CA--C 1.481 -1.697 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 13.6 t -69.05 142.85 15.63 Favored 'Isoleucine or valine' 0 C--N 1.371 1.511 0 C-N-CA 128.871 2.869 . . . . 0.0 107.494 172.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.481 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.362 87.4 m -51.05 110.91 0.48 Allowed 'General case' 0 C--N 1.375 1.692 0 CA-C-O 125.317 2.484 . . . . 0.0 116.99 -177.443 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.04 -39.12 7.89 Favored Pre-proline 0 N--CA 1.442 -0.863 0 CA-C-O 115.45 -2.214 . . . . 0.0 114.072 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.95 52.37 4.23 Favored 'Trans proline' 0 CA--C 1.556 1.601 0 CA-C-N 127.049 3.553 . . . . 0.0 114.786 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.97 177.22 3.8 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -173.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.5 -67.25 0.84 Allowed 'General case' 0 C--N 1.371 1.526 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 156.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.43 ' HB3' ' HG3' ' A' ' 127' ' ' PRO 0.441 5.3 mptp? 50.39 -19.28 0.0 OUTLIER 'General case' 0 N--CA 1.424 -1.732 1 C-N-CA 138.666 6.786 . . . . 0.0 118.421 -178.668 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 107.34 -143.13 0.0 OUTLIER 'General case' 0 C--N 1.369 1.423 1 C-N-CA 132.754 4.422 . . . . 0.0 109.734 175.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.477 ' HB2' ' HG ' ' A' ' 81' ' ' LEU 0.495 0.0 OUTLIER -102.82 -54.37 2.65 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.58 1.552 . . . . 0.0 110.481 -177.057 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.713 ' HA ' HD12 ' A' ' 81' ' ' LEU 0.333 0.0 OUTLIER -26.73 -74.96 0.03 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 133.786 4.834 . . . . 0.0 117.858 166.145 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.43 ' HG3' ' HB3' ' A' ' 123' ' ' LYS 0.659 0.0 OUTLIER 52.45 -177.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.384 2.406 1 N-CA-C 122.97 4.181 . . . . 0.0 122.97 145.328 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 2.1 p -124.88 152.7 43.69 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.538 ' HB2' HD12 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -102.03 128.69 48.36 Favored 'General case' 0 C--N 1.359 1.021 1 N-CA-C 97.105 -5.146 . . . . 0.0 97.105 172.641 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 30.9 tt0 -80.6 1.81 28.25 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 128.048 2.539 . . . . 0.0 113.11 -154.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 21.8 p 163.49 146.08 0.01 OUTLIER 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 32.8 ttt85 -115.05 122.04 44.93 Favored 'General case' 0 N--CA 1.429 -1.484 1 N-CA-C 99.892 -4.114 . . . . 0.0 99.892 162.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 3.6 ttt -93.14 125.28 37.66 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 102.192 -3.262 . . . . 0.0 102.192 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.18 112.84 14.98 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.77 144.48 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.131 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.858 HD13 HD12 ' A' ' 141' ' ' LEU . 0.1 OUTLIER -140.89 175.84 5.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 115.629 1.715 . . . . 0.0 115.629 -170.482 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.726 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -158.94 71.76 0.54 Allowed 'General case' 0 C--N 1.367 1.354 1 C-N-CA 136.694 5.998 . . . . 0.0 108.105 172.546 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 7.5 t -67.7 -50.0 59.8 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-O 124.038 1.875 . . . . 0.0 110.085 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.445 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -168.27 -56.63 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 110.648 -2.978 . . . . 0.0 109.267 -175.059 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.493 ' HG3' HD22 ' A' ' 141' ' ' LEU . 8.6 ptp180 -109.21 14.98 23.53 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.183 2.593 . . . . 0.0 115.603 -173.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.858 HD12 HD13 ' A' ' 136' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.369 1.437 0 C-N-CA 128.01 2.524 . . . . 0.0 107.163 -163.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.74 HD13 ' H ' ' A' ' 152' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.893 0 N-CA-C 121.25 3.796 . . . . 0.0 121.25 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.688 ' HD3' HD11 ' A' ' 66' ' ' LEU 0.458 0.0 OUTLIER -123.15 101.51 7.44 Favored 'General case' 0 C--N 1.401 2.813 2 N-CA-C 126.64 5.792 . . . . 0.0 126.64 153.488 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.842 ' HB ' ' CD2' ' A' ' 73' ' ' HIS 0.451 68.2 p -121.8 100.57 7.07 Favored 'General case' 0 CA--C 1.457 -2.621 2 O-C-N 115.382 -4.574 . . . . 0.0 105.764 152.316 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.655 ' HG2' HG21 ' A' ' 106' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.389 -3.5 0 N-CA-C 103.759 -2.682 . . . . 0.0 103.759 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.564 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 13.2 m-80 . . . . . 0 N--CA 1.487 1.39 1 N-CA-C 122.228 4.158 . . . . 0.0 122.228 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.2 p -91.25 -68.17 0.81 Allowed 'General case' 0 N--CA 1.466 0.34 1 C-N-CA 133.071 4.548 . . . . 0.0 112.702 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.64 -13.51 62.11 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 127.261 2.225 . . . . 0.0 111.858 176.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.564 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -82.19 -36.26 13.74 Favored 'Isoleucine or valine' 0 C--N 1.359 1.006 0 C-N-CA 129.814 3.246 . . . . 0.0 108.965 175.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -68.07 -42.67 80.1 Favored 'General case' 0 C--N 1.373 1.627 0 C-N-CA 128.553 2.741 . . . . 0.0 109.144 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.3 mt -61.64 -43.1 96.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.386 0 C-N-CA 126.945 2.098 . . . . 0.0 110.722 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.315 0.7 OUTLIER -62.88 -44.66 95.52 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 171.279 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -62.97 -30.38 71.54 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 166.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -76.65 -50.97 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 128.316 2.646 . . . . 0.0 111.794 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.659 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmtt -62.32 -29.71 70.64 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.518 2.727 . . . . 0.0 109.92 174.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.764 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.7 OUTLIER -66.64 -51.79 52.32 Favored 'General case' 0 C--N 1.369 1.442 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.789 164.475 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -54.62 -37.77 66.01 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 120.173 1.351 . . . . 0.0 112.63 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.659 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.28 0.9 OUTLIER -71.88 -41.64 67.75 Favored 'General case' 0 C--N 1.392 2.44 0 O-C-N 120.407 -1.433 . . . . 0.0 112.508 171.48 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -57.92 -44.64 86.99 Favored 'General case' 0 C--N 1.388 2.242 0 C-N-CA 129.116 2.966 . . . . 0.0 111.775 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.556 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -66.54 -55.28 16.25 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 128.773 2.829 . . . . 0.0 111.513 -178.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 22' ' ' PHE . 51.5 mt-10 -75.12 -32.98 61.53 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -73.68 -40.81 63.39 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 126.047 1.739 . . . . 0.0 113.513 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.504 ' HB3' ' CD2' ' A' ' 64' ' ' PHE . 0.8 OUTLIER -73.42 -28.78 62.17 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 125.666 1.586 . . . . 0.0 108.626 170.372 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.486 ' HB2' ' HA ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -57.24 -42.27 81.16 Favored 'General case' 0 C--N 1.377 1.774 0 C-N-CA 124.789 1.236 . . . . 0.0 113.901 165.545 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -59.56 -37.92 79.72 Favored 'General case' 0 C--N 1.377 1.803 0 C-N-CA 124.613 1.165 . . . . 0.0 111.612 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -58.3 -49.27 77.75 Favored 'General case' 0 C--N 1.372 1.581 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 21' ' ' GLU . 2.0 mt -66.32 -42.52 90.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 O-C-N 120.53 -1.356 . . . . 0.0 111.709 176.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -73.97 -27.08 60.81 Favored 'General case' 0 C--N 1.372 1.561 0 O-C-N 121.459 -0.776 . . . . 0.0 111.652 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -70.82 -35.98 72.73 Favored 'General case' 0 C--N 1.375 1.703 0 C-N-CA 126.084 1.754 . . . . 0.0 110.687 172.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.475 ' HG2' ' HG3' ' A' ' 71' ' ' LYS . 17.7 tp10 -69.83 -37.29 76.17 Favored 'General case' 0 C--N 1.383 2.058 0 O-C-N 120.722 -1.236 . . . . 0.0 113.538 170.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.468 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 5.2 mt -65.11 -50.29 75.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 C-N-CA 124.707 1.203 . . . . 0.0 113.322 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -63.01 -32.79 74.23 Favored 'General case' 0 C--N 1.361 1.101 0 CA-C-N 121.778 2.081 . . . . 0.0 114.429 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 21.5 pt-20 -77.33 -43.64 32.33 Favored 'General case' 0 C--N 1.376 1.748 0 O-C-N 118.521 -2.612 . . . . 0.0 111.699 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.12 -41.05 64.42 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 124.316 1.046 . . . . 0.0 113.643 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -71.42 -28.84 64.27 Favored 'General case' 0 C--N 1.352 0.705 0 C-N-CA 125.484 1.513 . . . . 0.0 111.448 175.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -77.92 -38.29 45.85 Favored 'General case' 0 C--N 1.387 2.234 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 166.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.86 62.48 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 126.838 2.055 . . . . 0.0 114.592 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.8 -10.04 59.1 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 124.531 1.133 . . . . 0.0 111.753 166.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.11 17.96 56.67 Favored Glycine 0 C--N 1.379 2.93 0 O-C-N 121.122 -0.986 . . . . 0.0 114.675 167.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.575 HG21 ' ND2' ' A' ' 78' ' ' ASN 0.504 0.6 OUTLIER -94.37 -179.46 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.74 0 C-N-CA 125.814 1.646 . . . . 0.0 114.169 -173.346 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -43.87 -50.43 7.98 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 130.645 3.578 . . . . 0.0 115.658 -177.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.313 1.5 t 90.51 125.82 0.03 OUTLIER 'General case' 0 C--N 1.36 1.039 1 C-N-CA 133.492 4.717 . . . . 0.0 110.489 -177.548 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.468 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 3.5 p90 -112.6 154.0 26.69 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 124.701 1.2 . . . . 0.0 109.308 -174.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.79 162.93 23.23 Favored 'General case' 0 CA--C 1.494 -1.19 0 CA-C-O 122.868 1.318 . . . . 0.0 111.133 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.66 138.17 52.8 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 120.983 -1.073 . . . . 0.0 109.373 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -132.04 141.85 49.36 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 165.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.73 ' CE1' HD12 ' A' ' 50' ' ' LEU . 1.8 m-85 -101.11 153.8 19.27 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 123.395 1.569 . . . . 0.0 109.563 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 72.6 m -131.8 90.03 2.78 Favored 'General case' 0 CA--C 1.499 -0.993 1 N-CA-C 99.495 -4.261 . . . . 0.0 99.495 168.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -47.79 -9.59 0.02 OUTLIER 'General case' 0 C--O 1.191 -2.025 0 CA-C-O 112.764 -3.493 . . . . 0.0 119.781 -168.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.05 61.45 Favored 'General case' 0 N--CA 1.5 2.032 1 CA-C-N 129.487 5.585 . . . . 0.0 119.933 -176.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.741 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.12 -42.77 96.71 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 130.646 3.578 . . . . 0.0 111.622 172.402 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.912 HD23 HD11 ' A' ' 54' ' ' ILE . 1.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 129.381 3.072 . . . . 0.0 109.099 171.287 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 47' ' ' GLN . 98.7 m-20 -58.89 -33.96 71.1 Favored 'General case' 0 C--N 1.365 1.268 0 C-N-CA 130.856 3.663 . . . . 0.0 110.699 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -74.71 -33.11 62.34 Favored 'General case' 0 C--N 1.364 1.225 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 164.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.41 -33.21 58.83 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 119.096 -2.252 . . . . 0.0 116.504 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.912 HD11 HD23 ' A' ' 50' ' ' LEU . 54.2 mt -63.34 -44.4 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.626 1 C-N-CA 133.746 4.818 . . . . 0.0 111.38 175.506 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.427 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -108.2 -24.91 11.32 Favored 'General case' 0 C--N 1.366 1.288 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 173.385 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -83.58 -17.09 42.88 Favored 'General case' 0 C--N 1.363 1.179 0 CA-C-N 123.528 2.876 . . . . 0.0 114.292 -173.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 15.0 pm0 -131.98 -50.62 0.96 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.223 1.409 . . . . 0.0 110.788 175.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 54' ' ' ILE 0.456 0.1 OUTLIER 73.8 156.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 C-N-CA 125.62 1.568 . . . . 0.0 111.033 177.55 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.488 ' HA ' HD23 ' A' ' 14' ' ' LEU . 14.4 t70 30.69 50.11 0.09 Allowed 'General case' 0 N--CA 1.52 3.049 0 C-N-CA 131.123 3.769 . . . . 0.0 115.458 -178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' A' ' 57' ' ' GLU 0.446 60.7 mm-40 -86.26 79.61 9.01 Favored 'General case' 0 CA--C 1.485 -1.529 0 CA-C-O 126.949 3.262 . . . . 0.0 109.742 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.309 33.2 p -78.44 -15.56 58.52 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 128.742 2.817 . . . . 0.0 112.769 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.65 ' HE2' HG21 ' A' ' 136' ' ' ILE . 1.1 t80 -68.95 -34.25 75.03 Favored 'General case' 0 C--N 1.358 0.961 1 C-N-CA 131.82 4.048 . . . . 0.0 110.45 169.002 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.521 HG13 ' CZ ' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -64.86 -45.94 93.39 Favored 'Isoleucine or valine' 0 C--N 1.358 0.953 0 C-N-CA 130.901 3.68 . . . . 0.0 106.789 -178.698 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.504 ' CD2' ' HB3' ' A' ' 21' ' ' GLU 0.316 57.5 m-85 -62.57 -41.54 98.98 Favored 'General case' 0 C--O 1.21 -1.006 0 C-N-CA 130.322 3.449 . . . . 0.0 114.778 165.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -64.28 -43.04 96.02 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 123.898 3.044 . . . . 0.0 113.575 177.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.734 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.2 tm? -68.14 -41.62 81.33 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 125.064 1.346 . . . . 0.0 114.468 171.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.521 ' CZ ' HG13 ' A' ' 63' ' ' VAL 0.886 0.1 OUTLIER -77.76 -17.06 57.94 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 118.394 -2.691 . . . . 0.0 115.512 172.878 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -78.3 -18.98 54.52 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 127.845 2.458 . . . . 0.0 108.349 163.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -78.13 -33.17 50.57 Favored 'General case' 0 CA--C 1.567 1.611 0 O-C-N 119.978 -1.702 . . . . 0.0 112.085 159.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.0 -46.08 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.914 0 C-N-CA 128.155 2.582 . . . . 0.0 113.342 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.475 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 14.0 pttm -52.46 -16.92 1.0 Allowed 'General case' 0 CA--C 1.502 -0.898 0 C-N-CA 130.512 3.525 . . . . 0.0 118.272 -176.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.277 60.7 m-20 -101.24 -14.14 17.8 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.974 2.109 . . . . 0.0 109.718 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.97 11.93 16.85 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 129.823 3.249 . . . . 0.0 113.059 -171.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.544 ' HA ' HG13 ' A' ' 77' ' ' VAL . 99.5 t -37.89 -31.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.384 2.067 0 C-N-CA 129.103 2.961 . . . . 0.0 115.996 166.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.46 ' H ' HD22 ' A' ' 75' ' ' LEU . 0.4 OUTLIER -69.5 -38.09 77.47 Favored 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 130.388 3.475 . . . . 0.0 114.404 175.311 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -76.43 -33.04 58.8 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.581 1.952 . . . . 0.0 112.101 172.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.544 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.744 0.1 OUTLIER -71.51 -26.77 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.787 0 CA-C-O 126.786 3.184 . . . . 0.0 112.517 169.83 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.575 ' ND2' HG21 ' A' ' 38' ' ' VAL . 5.9 m120 -70.44 -32.57 70.21 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 128.821 2.848 . . . . 0.0 111.997 163.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -63.72 -30.26 71.38 Favored 'General case' 0 C--N 1.377 1.784 0 C-N-CA 125.336 1.454 . . . . 0.0 112.372 161.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -41.29 98.03 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 124.944 1.298 . . . . 0.0 112.611 163.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 125' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.922 0 C-N-CA 127.628 2.371 . . . . 0.0 115.575 173.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.708 0 CA-C-O 122.62 1.122 . . . . 0.0 114.854 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -131.71 145.82 51.84 Favored 'General case' 0 CA--C 1.506 -0.719 0 O-C-N 119.35 -2.264 . . . . 0.0 110.141 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.8 tp -115.82 135.79 53.67 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.865 2.066 . . . . 0.0 109.886 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -129.4 110.69 12.11 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 103.367 -2.827 . . . . 0.0 103.367 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.486 HD11 ' CE1' ' A' ' 115' ' ' PHE . 21.6 pt -134.52 140.92 44.79 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 C-N-CA 124.776 1.231 . . . . 0.0 110.774 -173.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 23.3 m -127.48 130.58 49.46 Favored 'General case' 0 C--N 1.363 1.179 0 O-C-N 120.1 -1.625 . . . . 0.0 112.131 -176.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.445 ' HB3' ' HB ' ' A' ' 152' ' ' THR . 33.0 t0 -173.75 166.51 4.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.8 -3.037 . . . . 0.0 102.8 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.734 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.33 -38.51 3.2 Favored Glycine 0 C--N 1.351 1.411 0 CA-C-O 123.661 1.701 . . . . 0.0 111.072 172.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 108' ' ' ASP . 29.1 m-80 121.23 -8.85 0.0 OUTLIER 'General case' 0 N--CA 1.422 -1.849 1 C-N-CA 139.497 7.119 . . . . 0.0 108.453 -168.213 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.749 ' HA ' HG23 ' A' ' 136' ' ' ILE 0.641 0.0 OUTLIER -79.26 136.01 36.92 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 130.24 3.416 . . . . 0.0 116.596 177.245 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -97.21 100.48 11.95 Favored 'General case' 0 C--N 1.37 1.463 0 N-CA-C 100.26 -3.978 . . . . 0.0 100.26 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.428 HD22 ' HG ' ' A' ' 111' ' ' LEU . 1.3 pt? -119.25 123.06 43.36 Favored 'General case' 0 C--N 1.361 1.086 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -117.36 142.95 17.7 Favored Glycine 0 C--N 1.355 1.621 0 N-CA-C 106.596 -2.602 . . . . 0.0 106.596 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.486 ' CE1' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -131.85 142.22 49.64 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 176.091 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 31.4 m -125.05 129.63 50.65 Favored 'General case' 0 CA--C 1.485 -1.544 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 -173.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.0 144.05 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 127.147 2.179 . . . . 0.0 108.884 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.309 86.4 m -56.87 107.5 0.41 Allowed 'General case' 0 C--N 1.379 1.867 0 CA-C-N 120.9 1.682 . . . . 0.0 111.593 179.697 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.252 22.7 ttmm -68.81 -40.02 15.94 Favored Pre-proline 0 N--CA 1.444 -0.73 0 CA-C-O 116.057 -1.925 . . . . 0.0 115.28 -170.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.48 59.46 5.51 Favored 'Trans proline' 0 CA--C 1.56 1.778 0 CA-C-N 126.042 3.194 . . . . 0.0 113.071 171.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.258 0.0 OUTLIER 163.71 124.24 0.01 OUTLIER 'General case' 0 C--N 1.367 1.359 0 C-N-CA 129.648 3.179 . . . . 0.0 111.47 178.15 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -146.46 67.15 1.18 Allowed 'General case' 0 N--CA 1.432 -1.341 0 O-C-N 117.331 -3.356 . . . . 0.0 111.241 168.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -105.42 11.99 32.03 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 126.339 1.855 . . . . 0.0 107.832 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -128.31 150.75 49.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.088 2.555 . . . . 0.0 113.354 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.515 ' HB2' HD22 ' A' ' 81' ' ' LEU 0.266 2.4 mppt? -101.82 -45.62 5.16 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.417 1.487 . . . . 0.0 111.183 178.348 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.3 85.25 6.77 Favored Pre-proline 0 C--N 1.367 1.346 0 C-N-CA 129.058 2.943 . . . . 0.0 108.018 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -81.49 -173.12 1.68 Allowed 'Trans proline' 0 CA--C 1.497 -1.342 1 C-N-CA 132.652 8.901 . . . . 0.0 114.106 -177.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.6 p -98.44 138.94 34.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 100.375 -3.935 . . . . 0.0 100.375 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.7 134.91 42.97 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 121.136 1.789 . . . . 0.0 106.629 -167.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' A' ' 118' ' ' CYS 0.252 1.1 pt20 -95.85 66.59 2.65 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 125.486 1.514 . . . . 0.0 109.538 -169.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.309 2.1 p 98.68 148.65 0.02 OUTLIER 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.409 1.884 . . . . 0.0 109.669 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -115.09 124.16 50.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 101.164 -3.643 . . . . 0.0 101.164 165.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.486 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . 4.3 ttp -102.95 108.25 19.36 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -121.72 115.16 22.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.605 1.162 . . . . 0.0 108.439 -175.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.7 mm -139.1 136.38 42.16 Favored 'Isoleucine or valine' 0 C--N 1.363 1.186 0 N-CA-C 105.658 -1.979 . . . . 0.0 105.658 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -133.65 -179.39 3.31 Favored 'Isoleucine or valine' 0 C--N 1.351 0.651 0 C-N-CA 127.196 2.198 . . . . 0.0 112.822 -172.706 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.647 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.0 OUTLIER -135.53 149.52 49.49 Favored 'General case' 0 CA--C 1.557 1.224 1 C-N-CA 135.418 5.487 . . . . 0.0 106.972 167.199 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.436 ' HB2' HD23 ' A' ' 141' ' ' LEU . 51.4 m -164.67 -103.54 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.65 ' CD ' ' HG2' ' A' ' 140' ' ' ARG 0.258 0.0 OUTLIER -118.15 -66.69 1.05 Allowed 'General case' 0 C--N 1.355 0.815 0 C-N-CA 129.671 3.188 . . . . 0.0 113.608 -160.264 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.65 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 12.2 ptp180 -105.66 2.14 27.85 Favored 'General case' 0 CA--C 1.497 -1.079 1 C-N-CA 133.684 4.794 . . . . 0.0 108.659 174.617 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.436 HD23 ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER . . . . . 0 CA--C 1.574 1.895 0 CA-C-O 114.514 -2.66 . . . . 0.0 106.387 -152.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.752 HD11 ' H ' ' A' ' 153' ' ' GLN . 0.4 OUTLIER . . . . . 0 C--O 1.218 -0.578 0 N-CA-C 104.946 -2.242 . . . . 0.0 104.946 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.354 21.3 mttp -93.42 137.13 33.03 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 123.717 2.962 . . . . 0.0 104.382 153.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.445 ' HB ' ' HB3' ' A' ' 108' ' ' ASP 0.355 1.0 OUTLIER -79.17 116.1 19.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 120.033 3.346 . . . . 0.0 120.033 -140.332 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.752 ' H ' HD11 ' A' ' 150' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.433 2 C-N-CA 135.765 5.626 . . . . 0.0 122.93 -173.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.521 ' HA ' HG13 ' A' ' 7' ' ' VAL . 5.3 m120 . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 120.26 3.43 . . . . 0.0 120.26 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -58.37 4.31 Favored 'General case' 0 C--O 1.24 0.589 1 C-N-CA 133.172 4.589 . . . . 0.0 111.048 173.004 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -73.55 -13.62 61.06 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.096 1.759 . . . . 0.0 113.07 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.521 HG13 ' HA ' ' A' ' 4' ' ' ASN . 0.7 OUTLIER -84.88 -31.61 7.19 Favored 'Isoleucine or valine' 0 C--N 1.358 0.946 0 C-N-CA 127.808 2.443 . . . . 0.0 110.214 176.605 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.3 -38.39 71.76 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 127.567 2.347 . . . . 0.0 108.413 174.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -61.07 -44.65 98.69 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.887 164.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 1.2 mmp_? -61.4 -47.46 85.7 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 120.951 1.705 . . . . 0.0 113.916 171.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -56.83 -27.29 59.94 Favored 'General case' 0 C--N 1.376 1.736 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 164.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -76.77 -50.68 12.96 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 119.486 -2.009 . . . . 0.0 111.877 171.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -56.83 -28.4 61.5 Favored 'General case' 0 C--N 1.376 1.721 0 C-N-CA 126.828 2.051 . . . . 0.0 112.754 171.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.452 ' O ' HD22 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -73.62 -46.56 46.13 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 113.755 -1.566 . . . . 0.0 111.621 170.256 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.434 4.2 ptp180 -58.22 -36.28 72.92 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.16 -1.587 . . . . 0.0 114.586 173.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.9 mtt180 -64.19 -41.96 96.87 Favored 'General case' 0 C--N 1.384 2.069 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 162.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.502 ' CD2' HG22 ' A' ' 61' ' ' THR 0.251 3.0 t60 -62.22 -47.97 82.08 Favored 'General case' 0 C--N 1.383 2.024 0 C-N-CA 127.941 2.496 . . . . 0.0 114.392 174.473 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -59.06 -53.77 54.62 Favored 'General case' 0 C--N 1.369 1.449 1 C-N-CA 132.883 4.473 . . . . 0.0 108.8 177.885 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -70.65 -46.64 62.9 Favored 'General case' 0 C--N 1.37 1.48 0 N-CA-C 118.556 2.799 . . . . 0.0 118.556 173.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m -66.29 -38.58 88.11 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 119.597 -1.94 . . . . 0.0 114.053 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.541 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.327 4.6 mp0 -77.11 -29.15 54.68 Favored 'General case' 0 C--N 1.362 1.113 0 O-C-N 120.708 -1.245 . . . . 0.0 111.013 172.207 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.3 -36.81 83.27 Favored 'General case' 0 C--N 1.387 2.202 0 O-C-N 120.178 -1.576 . . . . 0.0 114.137 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -68.09 -34.91 77.29 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 124.745 1.218 . . . . 0.0 110.47 169.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.609 HE21 ' CE1' ' A' ' 68' ' ' HIS . 19.6 tt0 -63.49 -45.75 89.26 Favored 'General case' 0 C--N 1.364 1.223 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 169.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.521 HG12 ' CE1' ' A' ' 68' ' ' HIS . 2.1 mt -71.3 -45.48 69.87 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 O-C-N 119.277 -2.14 . . . . 0.0 111.795 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.539 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.336 3.5 m120 -75.03 -23.75 58.22 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 120.87 -1.144 . . . . 0.0 112.391 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -75.84 -38.46 58.02 Favored 'General case' 0 C--N 1.382 2.012 0 CA-C-O 116.768 -1.587 . . . . 0.0 110.561 165.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.491 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 16.4 tp10 -65.97 -35.68 81.25 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-N 122.965 2.621 . . . . 0.0 115.793 172.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.542 HD13 ' CE2' ' A' ' 41' ' ' PHE 0.38 0.7 OUTLIER -73.06 -39.68 57.63 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 115.135 1.532 . . . . 0.0 115.135 174.625 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -74.4 -31.81 62.47 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 171.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.491 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 8.6 pt-20 -77.38 -38.06 50.76 Favored 'General case' 0 C--N 1.374 1.637 0 O-C-N 118.282 -2.762 . . . . 0.0 110.81 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.58 ' HB3' HG21 ' A' ' 74' ' ' VAL . . . -77.27 -36.5 54.31 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.428 1.091 . . . . 0.0 111.899 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.1 t -68.28 -35.45 77.88 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 121.213 -0.929 . . . . 0.0 110.346 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.05 -39.42 69.07 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.83 -28.38 61.58 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 126.48 1.912 . . . . 0.0 115.375 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.95 -15.58 58.11 Favored 'General case' 0 C--N 1.385 2.141 0 C-N-CA 124.75 1.22 . . . . 0.0 110.943 171.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 17.53 59.34 Favored Glycine 0 C--N 1.376 2.779 0 N-CA-C 114.994 0.757 . . . . 0.0 114.994 166.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.505 HG21 ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -109.82 151.76 12.01 Favored 'Isoleucine or valine' 0 C--N 1.36 1.023 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 178.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.453 ' HB2' ' CD1' ' A' ' 81' ' ' LEU 0.52 7.7 m -20.74 -47.72 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.743 2 N-CA-C 125.715 5.45 . . . . 0.0 125.715 -167.267 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.343 93.7 p 87.35 137.59 0.04 OUTLIER 'General case' 0 CA--C 1.501 -0.919 1 C-N-CA 131.758 4.023 . . . . 0.0 109.543 -178.502 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.542 ' CE2' HD13 ' A' ' 29' ' ' ILE . 9.7 p90 -112.51 140.53 47.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 -175.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.423 ' O ' ' HA ' ' A' ' 128' ' ' SER . 71.1 m80 -101.96 104.61 15.31 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -175.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.401 HD13 HD12 ' A' ' 129' ' ' LEU 0.294 0.3 OUTLIER -105.68 161.18 14.61 Favored 'General case' 0 CA--C 1.504 -0.791 0 O-C-N 116.863 -3.648 . . . . 0.0 115.451 -175.529 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -135.75 153.37 51.58 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.416 3.0 p90 -108.36 135.36 49.78 Favored 'General case' 0 C--N 1.36 1.03 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 167.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.449 ' O ' HD21 ' A' ' 49' ' ' LEU . 15.9 m -106.35 133.41 51.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 174.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -80.82 -10.76 59.69 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 121.717 3.969 . . . . 0.0 121.717 -170.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.47 -48.03 74.05 Favored 'General case' 0 N--CA 1.495 1.778 1 CA-C-N 126.582 4.265 . . . . 0.0 117.054 -175.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.83 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.47 -34.81 78.58 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-O 128.031 3.777 . . . . 0.0 113.804 174.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.83 ' H ' HD22 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -72.84 -44.87 60.88 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 109.729 -3.396 . . . . 0.0 108.887 171.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.463 ' HA ' ' CG2' ' A' ' 54' ' ' ILE . 19.6 t70 -55.77 -30.03 60.6 Favored 'General case' 0 C--N 1.37 1.467 0 C-N-CA 127.818 2.447 . . . . 0.0 109.665 -179.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.4 ttm-85 -68.16 -55.96 10.48 Favored 'General case' 0 C--N 1.375 1.714 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 157.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.35 71.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 120.603 3.557 . . . . 0.0 120.603 -177.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.724 HD12 HD21 ' A' ' 50' ' ' LEU . 5.4 tt -75.36 -39.65 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 1 C-N-CA 131.962 4.105 . . . . 0.0 110.619 178.635 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.569 ' HG2' HG23 ' A' ' 54' ' ' ILE . 19.3 mm-40 -107.82 -22.43 12.46 Favored 'General case' 0 C--N 1.373 1.617 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -86.5 10.11 16.28 Favored 'General case' 0 C--N 1.377 1.768 0 CA-C-N 122.597 2.453 . . . . 0.0 113.82 -172.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -155.13 -52.85 0.09 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 125.794 1.638 . . . . 0.0 108.88 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.403 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.507 0.0 OUTLIER 75.85 160.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.373 1.629 0 C-N-CA 126.565 1.946 . . . . 0.0 110.125 -179.727 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.451 ' N ' ' HG ' ' A' ' 14' ' ' LEU . 20.8 t70 34.87 45.63 0.16 Allowed 'General case' 0 N--CA 1.512 2.629 1 C-N-CA 131.821 4.048 . . . . 0.0 113.045 -175.244 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.43 ' O ' HG12 ' A' ' 63' ' ' VAL 0.622 0.0 OUTLIER -83.38 68.64 9.79 Favored 'General case' 0 C--O 1.206 -1.201 0 C-N-CA 128.018 2.527 . . . . 0.0 109.971 -178.233 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.502 HG22 ' CD2' ' A' ' 17' ' ' HIS 0.292 23.4 p -79.51 -18.19 52.44 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 130.354 3.461 . . . . 0.0 112.896 177.785 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -65.26 -33.72 76.66 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 131.467 3.907 . . . . 0.0 111.009 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.594 HG23 HD21 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -60.07 -47.43 91.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.24 0 C-N-CA 130.712 3.605 . . . . 0.0 108.351 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.541 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.297 29.2 m-85 -64.61 -40.63 95.84 Favored 'General case' 0 CA--C 1.494 -1.174 1 C-N-CA 134.569 5.148 . . . . 0.0 113.628 171.585 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -65.35 -45.26 84.9 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.565 2.346 . . . . 0.0 114.414 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.562 HD12 HD21 ' A' ' 113' ' ' LEU . 3.2 tm? -66.57 -51.04 60.83 Favored 'General case' 0 CA--C 1.567 1.617 0 C-N-CA 124.888 1.275 . . . . 0.0 112.166 171.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.749 0.0 OUTLIER -72.08 -14.71 61.92 Favored 'General case' 0 C--N 1.379 1.864 1 O-C-N 116.155 -4.091 . . . . 0.0 112.417 177.476 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.609 ' CE1' HE21 ' A' ' 24' ' ' GLN . 21.2 m-70 -75.82 -27.6 57.97 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 129.124 2.969 . . . . 0.0 111.136 165.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.336 43.6 mmtm -69.1 -27.02 65.23 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.269 -1.52 . . . . 0.0 109.836 159.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 153' ' ' GLN 0.495 5.5 mt -70.39 -9.08 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 N-CA-C 119.296 3.072 . . . . 0.0 119.296 166.544 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.445 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 16.3 pttm -75.21 -13.38 60.44 Favored 'General case' 0 CA--C 1.512 -0.517 1 O-C-N 116.027 -4.171 . . . . 0.0 114.054 177.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.381 70.4 m-20 -92.84 -27.31 17.22 Favored 'General case' 0 N--CA 1.432 -1.369 0 C-N-CA 129.422 3.089 . . . . 0.0 112.694 -178.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.457 ' CD2' HG12 ' A' ' 70' ' ' ILE . 3.6 t-80 -70.93 -1.09 10.76 Favored 'General case' 0 CA--C 1.493 -1.228 1 C-N-CA 135.012 5.325 . . . . 0.0 115.544 -170.773 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.58 HG21 ' HB3' ' A' ' 32' ' ' ALA . 55.0 t -27.33 -45.25 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.361 1.075 1 C-N-CA 132.104 4.162 . . . . 0.0 117.502 169.424 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.13 -31.39 62.73 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.458 2.303 . . . . 0.0 112.753 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -75.38 -43.26 51.16 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 126.415 1.886 . . . . 0.0 111.926 176.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.306 8.6 p -70.15 -31.2 46.59 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 C-N-CA 126.709 2.004 . . . . 0.0 110.804 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.505 ' HB3' HG21 ' A' ' 38' ' ' VAL . 49.0 m-20 -71.9 -30.65 65.6 Favored 'General case' 0 C--N 1.357 0.93 0 O-C-N 119.293 -2.13 . . . . 0.0 115.373 169.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -68.89 -34.62 75.72 Favored 'General case' 0 C--N 1.37 1.484 0 O-C-N 118.08 -2.887 . . . . 0.0 109.551 165.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.49 9.6 t80 -73.53 -4.39 33.61 Favored 'General case' 0 C--N 1.367 1.338 1 C-N-CA 131.779 4.032 . . . . 0.0 115.678 171.634 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.628 HD13 ' HB3' ' A' ' 125' ' ' LYS . 2.1 mt . . . . . 0 N--CA 1.503 2.178 0 C-N-CA 130.867 3.667 . . . . 0.0 113.152 -172.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.519 0 N-CA-C 117.154 1.622 . . . . 0.0 117.154 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.573 ' HE ' ' HG2' ' A' ' 120' ' ' PRO . 93.6 mtt180 -132.95 144.05 49.87 Favored 'General case' 0 C--N 1.351 0.668 0 N-CA-C 100.336 -3.95 . . . . 0.0 100.336 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.5 pp -120.79 147.94 44.67 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.201 -0.937 . . . . 0.0 112.333 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.422 ' HA ' ' HA2' ' A' ' 114' ' ' GLY . 41.2 tt0 -130.24 120.64 24.77 Favored 'General case' 0 C--N 1.368 1.397 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 178.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 6.3 pt -134.64 138.23 49.85 Favored 'Isoleucine or valine' 0 C--N 1.35 0.604 0 C-N-CA 125.089 1.355 . . . . 0.0 109.723 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.4 t -118.62 129.22 55.2 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 -178.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.403 ' HB2' HG13 ' A' ' 150' ' ' ILE . 6.4 t0 -154.5 -174.74 5.09 Favored 'General case' 0 C--N 1.367 1.346 0 N-CA-C 102.253 -3.24 . . . . 0.0 102.253 174.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.0 -66.65 3.9 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 119.23 -2.169 . . . . 0.0 113.547 173.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 159.64 -31.4 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.066 1 C-N-CA 139.902 7.281 . . . . 0.0 104.209 -163.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.833 ' HG ' HG23 ' A' ' 136' ' ' ILE . 4.5 mp -78.53 137.23 37.81 Favored 'General case' 0 C--N 1.368 1.393 1 C-N-CA 133.845 4.858 . . . . 0.0 121.064 -171.129 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -94.2 103.34 15.38 Favored 'General case' 0 C--N 1.375 1.676 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 164.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.562 HD21 HD12 ' A' ' 66' ' ' LEU . 3.1 mm? -100.12 133.51 44.41 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 105' ' ' GLU . . . -110.21 141.52 16.28 Favored Glycine 0 C--N 1.343 0.937 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 173.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -129.16 133.91 47.8 Favored 'General case' 0 C--N 1.353 0.755 1 N-CA-C 99.403 -4.295 . . . . 0.0 99.403 179.041 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 42.1 p -134.37 137.65 44.28 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 -171.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . 0.27 1.6 p -92.02 151.72 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 C-N-CA 125.39 1.476 . . . . 0.0 112.602 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 15.5 p -58.73 97.94 0.03 OUTLIER 'General case' 0 C--N 1.39 2.348 0 C-N-CA 128.063 2.545 . . . . 0.0 113.583 -177.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.597 17.8 ptpt 46.52 86.66 0.13 Allowed Pre-proline 0 C--N 1.351 0.651 0 C-N-CA 129.1 2.96 . . . . 0.0 115.501 -165.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.573 ' HG2' ' HE ' ' A' ' 103' ' ' ARG . 4.9 Cg_exo -45.33 108.87 0.15 Allowed 'Trans proline' 0 C--N 1.364 1.368 1 C-N-CA 125.914 4.409 . . . . 0.0 118.863 -159.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.434 HD22 ' N ' ' A' ' 121' ' ' ASN . 0.0 OUTLIER -157.95 149.76 21.82 Favored 'General case' 0 C--N 1.364 1.216 0 C-N-CA 130.056 3.342 . . . . 0.0 109.268 -169.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -146.52 100.47 3.35 Favored 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 123.181 1.467 . . . . 0.0 110.11 166.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -108.1 -7.39 16.09 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.554 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.437 17.4 m-85 -157.0 176.01 13.33 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -164.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.628 ' HB3' HD13 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -138.28 104.99 5.34 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 103.641 -2.725 . . . . 0.0 103.641 177.841 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.9 t70 160.28 -25.89 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.542 0 C-N-CA 129.567 3.147 . . . . 0.0 115.94 -167.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.343 76.1 Cg_exo -53.12 -178.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.385 2.474 1 C-N-CA 127.638 5.559 . . . . 0.0 119.131 -179.195 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . 0.423 ' HA ' ' O ' ' A' ' 42' ' ' HIS . 30.2 t -103.29 152.37 21.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.335 2.254 . . . . 0.0 109.392 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.401 HD12 HD13 ' A' ' 43' ' ' LEU . 20.2 mt -102.34 130.85 49.19 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 177.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -89.53 38.55 0.91 Allowed 'General case' 0 C--N 1.383 2.042 0 C-N-CA 128.427 2.691 . . . . 0.0 111.26 -163.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 19.5 t 98.66 143.93 0.02 OUTLIER 'General case' 0 C--N 1.371 1.521 0 C-N-CA 125.754 1.622 . . . . 0.0 106.929 -168.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.51 HH22 HG21 ' A' ' 25' ' ' ILE . 38.1 mtm180 -107.18 122.37 46.39 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 100.452 -3.907 . . . . 0.0 100.452 168.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.444 ' SD ' ' HB2' ' A' ' 49' ' ' LEU . 1.6 tmm? -93.02 118.67 31.45 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 104.313 -2.477 . . . . 0.0 104.313 -174.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -124.67 114.96 20.01 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . 0.267 80.4 mt -140.08 148.59 22.53 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.833 HG23 ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -133.96 -178.76 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 124.877 2.275 . . . . 0.0 110.461 -169.129 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.686 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.3 OUTLIER -157.28 138.67 13.79 Favored 'General case' 0 N--CA 1.441 -0.89 1 C-N-CA 134.268 5.027 . . . . 0.0 102.02 176.416 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.527 ' HB2' ' HG ' ' A' ' 141' ' ' LEU . 0.9 OUTLIER -164.91 -115.07 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 120.137 3.384 . . . . 0.0 120.137 -168.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.635 ' CD ' ' HG2' ' A' ' 140' ' ' ARG 0.25 0.0 OUTLIER -103.44 -69.48 0.8 Allowed 'General case' 0 C--N 1.354 0.763 1 C-N-CA 133.515 4.726 . . . . 0.0 114.594 -159.482 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.635 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 12.5 ptp180 -111.55 9.92 21.22 Favored 'General case' 0 N--CA 1.446 -0.647 1 C-N-CA 133.05 4.54 . . . . 0.0 107.25 173.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.623 HD23 ' CD ' ' A' ' 139' ' ' ARG . 0.3 OUTLIER . . . . . 0 CA--C 1.574 1.868 0 CA-C-O 115.658 -2.115 . . . . 0.0 106.878 -156.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.564 HD12 ' O ' ' A' ' 151' ' ' LYS 0.424 0.1 OUTLIER . . . . . 0 CA--C 1.546 0.795 1 N-CA-C 125.988 5.551 . . . . 0.0 125.988 . . . . . . . . . 4 3 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.564 ' O ' HD12 ' A' ' 150' ' ' ILE 0.324 0.0 OUTLIER -78.92 149.04 32.48 Favored 'General case' 0 CA--C 1.496 -1.116 1 C-N-CA 140.861 7.664 . . . . 0.0 101.059 159.66 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.608 ' O ' HG23 ' A' ' 152' ' ' THR . 11.7 t -79.35 97.21 6.23 Favored 'General case' 0 CA--C 1.566 1.561 1 CA-C-O 129.689 4.566 . . . . 0.0 111.108 168.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.563 ' HB2' HD11 ' A' ' 70' ' ' ILE . 3.7 tt0 . . . . . 1 N--CA 1.37 -4.46 2 C-N-CA 138.226 6.611 . . . . 0.0 106.838 173.063 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.615 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.366 10.8 t-20 . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 120.306 3.447 . . . . 0.0 120.306 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.05 -59.2 2.56 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 130.894 3.678 . . . . 0.0 111.145 172.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.77 -12.31 61.48 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 128.142 2.577 . . . . 0.0 112.47 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.615 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.7 t -88.43 -30.11 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 C-N-CA 130.508 3.523 . . . . 0.0 108.39 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.4 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 45.2 t80 -73.57 -42.11 62.04 Favored 'General case' 0 C--N 1.369 1.426 0 C-N-CA 125.778 1.631 . . . . 0.0 109.038 174.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.69 -42.91 93.75 Favored 'Isoleucine or valine' 0 C--N 1.369 1.433 0 C-N-CA 126.958 2.103 . . . . 0.0 110.875 168.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.289 11.4 tpp180 -65.07 -47.29 77.81 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.4 mtm180 -57.89 -31.82 67.12 Favored 'General case' 0 C--N 1.379 1.849 0 C-N-CA 128.77 2.828 . . . . 0.0 117.507 167.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -77.15 -46.62 22.81 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 127.384 2.273 . . . . 0.0 110.683 170.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.64 ' HA ' ' HG3' ' A' ' 16' ' ' ARG 0.337 31.1 mtpt -59.3 -28.42 66.75 Favored 'General case' 0 C--N 1.367 1.341 0 C-N-CA 126.646 1.979 . . . . 0.0 111.36 172.271 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.6 OUTLIER -71.81 -49.31 39.72 Favored 'General case' 0 C--O 1.21 -1.018 0 C-N-CA 125.504 1.522 . . . . 0.0 111.591 169.474 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.386 15.5 ptt180 -55.78 -33.34 64.27 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 170.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.64 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.292 0.1 OUTLIER -75.43 -38.16 59.96 Favored 'General case' 0 C--N 1.399 2.747 0 O-C-N 120.393 -1.442 . . . . 0.0 113.772 167.009 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.296 89.6 m-70 -56.93 -44.89 82.93 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 130.177 3.391 . . . . 0.0 109.402 172.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.602 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -65.51 -53.49 41.71 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 129.78 3.232 . . . . 0.0 110.802 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -69.07 -40.01 78.74 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.3 m -73.56 -35.47 65.47 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.861 2.064 . . . . 0.0 112.371 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.536 ' HB3' ' CD2' ' A' ' 64' ' ' PHE 0.281 50.7 mt-10 -77.3 -29.09 53.52 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 119.279 -2.138 . . . . 0.0 109.988 168.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -34.21 74.64 Favored 'General case' 0 C--N 1.376 1.72 0 O-C-N 119.196 -2.19 . . . . 0.0 112.637 169.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.321 7.4 ptm180 -69.65 -35.91 75.6 Favored 'General case' 0 C--N 1.375 1.7 0 CA-C-O 118.17 -0.919 . . . . 0.0 113.473 164.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -59.46 -50.41 74.03 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.3 mt -71.77 -44.56 68.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 C-N-CA 125.475 1.51 . . . . 0.0 110.35 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.596 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.625 0.0 OUTLIER -70.15 -24.11 63.11 Favored 'General case' 0 C--N 1.375 1.679 0 O-C-N 119.396 -2.065 . . . . 0.0 114.247 174.443 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -75.02 -37.35 61.8 Favored 'General case' 0 C--N 1.375 1.693 0 O-C-N 119.683 -1.886 . . . . 0.0 112.879 170.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.505 ' HA ' ' HG2' ' A' ' 31' ' ' GLU 0.451 0.0 OUTLIER -69.3 -34.4 74.62 Favored 'General case' 0 C--N 1.402 2.89 0 CA-C-N 122.816 2.553 . . . . 0.0 113.735 172.866 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.73 HD13 ' CE1' ' A' ' 41' ' ' PHE 0.257 2.2 pp -67.19 -44.94 87.42 Favored 'Isoleucine or valine' 0 C--N 1.387 2.202 0 C-N-CA 124.624 1.169 . . . . 0.0 112.183 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -61.25 -38.57 87.18 Favored 'General case' 0 C--N 1.363 1.167 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 170.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.9 pt-20 -76.87 -41.57 43.34 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 119.432 -2.043 . . . . 0.0 113.031 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB3' HG21 ' A' ' 74' ' ' VAL . . . -73.46 -39.66 64.76 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.494 ' HA ' HD21 ' A' ' 78' ' ' ASN . 10.3 t -71.46 -35.5 70.89 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.896 1.278 . . . . 0.0 110.356 174.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -70.4 -38.0 74.59 Favored 'General case' 0 C--N 1.388 2.244 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 167.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.42 62.41 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.298 1.839 . . . . 0.0 114.251 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.25 -18.9 61.18 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 120.018 1.281 . . . . 0.0 112.162 170.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.14 18.23 47.39 Favored Glycine 0 C--N 1.376 2.753 0 CA-C-O 121.82 0.678 . . . . 0.0 113.355 168.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.511 HG23 HD22 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -119.89 162.76 18.0 Favored 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 123.774 0.83 . . . . 0.0 109.343 -175.212 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 22.67 -51.09 0.0 OUTLIER 'General case' 0 C--N 1.371 1.504 1 C-N-CA 137.974 6.51 . . . . 0.0 120.718 176.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.2 m 72.75 92.48 0.08 Allowed 'General case' 0 C--N 1.364 1.209 0 C-N-CA 131.141 3.776 . . . . 0.0 109.737 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.73 ' CE1' HD13 ' A' ' 29' ' ' ILE . 36.7 p90 -113.96 140.87 48.05 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 122.019 0.914 . . . . 0.0 111.568 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -102.71 167.64 9.77 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 129.163 2.985 . . . . 0.0 105.114 170.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.397 2.8 pp -122.64 156.6 33.99 Favored 'General case' 0 CA--C 1.495 -1.162 0 O-C-N 119.639 -1.913 . . . . 0.0 110.829 167.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -138.83 146.01 40.74 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 100.33 -3.952 . . . . 0.0 100.33 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -142.66 151.8 41.77 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 121.719 0.771 . . . . 0.0 110.151 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.3 t -105.23 140.62 38.11 Favored 'General case' 0 C--N 1.358 0.952 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . 0.327 7.4 mm-40 -80.82 -9.27 59.83 Favored 'General case' 0 C--O 1.203 -1.369 0 C-N-CA 127.874 2.47 . . . . 0.0 116.309 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.06 -48.3 82.38 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 125.731 3.878 . . . . 0.0 118.367 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.676 HD23 ' H ' ' A' ' 134' ' ' ALA . 0.0 OUTLIER -64.81 -34.23 77.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-O 125.024 2.345 . . . . 0.0 112.365 172.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.755 ' CD2' HD11 ' A' ' 54' ' ' ILE 0.292 0.7 OUTLIER -68.09 -44.43 76.26 Favored 'General case' 0 C--O 1.196 -1.729 0 C-N-CA 129.671 3.188 . . . . 0.0 107.03 172.79 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -54.58 -37.83 65.99 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 129.461 3.104 . . . . 0.0 111.253 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -71.87 -39.34 69.7 Favored 'General case' 0 C--N 1.374 1.645 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 163.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.66 95.03 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 124.607 3.367 . . . . 0.0 115.345 170.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.755 HD11 ' CD2' ' A' ' 50' ' ' LEU . 56.7 mt -58.8 -45.79 91.22 Favored 'Isoleucine or valine' 0 C--N 1.368 1.389 1 C-N-CA 133.686 4.795 . . . . 0.0 112.562 176.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -106.99 -21.89 12.85 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 118.659 2.836 . . . . 0.0 118.659 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.4 ttp-105 -87.32 -30.91 20.48 Favored 'General case' 0 C--N 1.366 1.305 0 CA-C-N 123.893 3.042 . . . . 0.0 111.498 -178.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.705 ' HA ' HD22 ' A' ' 141' ' ' LEU . 23.4 mt-10 -102.75 -57.56 2.03 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.689 1.595 . . . . 0.0 111.309 -176.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.457 HD12 ' N ' ' A' ' 59' ' ' ASP 0.557 0.2 OUTLIER 55.44 135.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 C-N-CA 129.152 2.981 . . . . 0.0 114.379 178.475 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.457 ' N ' HD12 ' A' ' 58' ' ' ILE 0.718 32.8 t70 61.07 25.26 15.3 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 127.784 2.433 . . . . 0.0 113.73 -174.54 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.534 ' O ' HG12 ' A' ' 63' ' ' VAL 0.873 0.4 OUTLIER -65.42 58.31 0.03 OUTLIER 'General case' 0 C--O 1.2 -1.539 0 C-N-CA 129.597 3.159 . . . . 0.0 117.314 -177.09 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.503 1.7 p -78.6 -10.01 59.58 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 130.977 3.711 . . . . 0.0 114.681 174.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 136' ' ' ILE . 71.1 t80 -68.18 -34.23 75.91 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.238 3.015 . . . . 0.0 108.156 165.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 60' ' ' GLU 0.279 0.4 OUTLIER -62.87 -46.04 97.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.362 0 C-N-CA 129.623 3.169 . . . . 0.0 107.929 177.957 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.536 ' CD2' ' HB3' ' A' ' 21' ' ' GLU . 85.1 m-85 -61.44 -32.61 72.59 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 131.678 3.991 . . . . 0.0 115.175 164.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -73.61 -43.44 59.64 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-N 123.63 2.923 . . . . 0.0 112.016 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.642 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 0.9 OUTLIER -70.64 -40.32 73.13 Favored 'General case' 0 CA--C 1.559 1.324 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.913 0.0 OUTLIER -77.76 -16.28 58.51 Favored 'General case' 0 C--N 1.377 1.787 0 O-C-N 119.972 -1.705 . . . . 0.0 114.754 176.315 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.432 ' CD2' ' O ' ' A' ' 64' ' ' PHE . 31.3 m-70 -76.29 -30.24 57.69 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.972 2.509 . . . . 0.0 108.622 163.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -72.26 -25.49 61.63 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.473 -2.017 . . . . 0.0 112.301 163.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.429 HG13 ' HA ' ' A' ' 67' ' ' PHE . 1.0 OUTLIER -74.68 -31.63 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 C-N-CA 128.463 2.705 . . . . 0.0 111.581 172.339 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 pttp -52.68 -24.54 8.75 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 129.949 3.299 . . . . 0.0 118.676 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.267 35.8 t70 -97.37 -27.24 14.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.155 2.182 . . . . 0.0 109.513 -175.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.505 ' CE1' ' H ' ' A' ' 152' ' ' THR . 16.0 m-70 -77.28 6.79 6.09 Favored 'General case' 0 C--N 1.368 1.377 1 C-N-CA 132.454 4.302 . . . . 0.0 114.708 -174.501 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 32' ' ' ALA . 93.0 t -36.72 -35.68 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 C-N-CA 129.16 2.984 . . . . 0.0 115.915 166.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.417 HD22 ' H ' ' A' ' 75' ' ' LEU . 0.8 OUTLIER -70.29 -34.25 72.53 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.783 -1.823 . . . . 0.0 113.6 177.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 79' ' ' GLU 0.323 35.0 mt-10 -76.41 -34.04 58.81 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.294 1.438 . . . . 0.0 113.794 171.715 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.345 1.9 m -70.72 -36.96 67.24 Favored 'Isoleucine or valine' 0 C--N 1.377 1.785 0 CA-C-O 125.439 2.542 . . . . 0.0 110.68 172.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.564 ' O ' HD23 ' A' ' 81' ' ' LEU . 44.1 m-20 -65.34 -32.41 74.03 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 128.107 2.563 . . . . 0.0 112.559 169.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 76' ' ' GLU 0.404 5.6 pt-20 -71.5 -29.66 65.05 Favored 'General case' 0 C--N 1.369 1.439 0 O-C-N 117.7 -3.125 . . . . 0.0 112.33 164.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -74.41 -5.59 43.29 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 128.14 2.576 . . . . 0.0 114.197 168.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 78' ' ' ASN . 2.9 pp . . . . . 0 N--CA 1.508 2.43 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 -164.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.939 0 CA-C-O 121.7 0.611 . . . . 0.0 113.701 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -137.01 158.01 45.44 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 120.467 -1.607 . . . . 0.0 111.411 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.665 HD23 HD11 ' A' ' 106' ' ' ILE . 12.7 tp -133.02 151.77 52.03 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.397 1.879 . . . . 0.0 113.132 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -125.92 118.2 24.91 Favored 'General case' 0 C--N 1.369 1.433 0 N-CA-C 103.649 -2.722 . . . . 0.0 103.649 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.665 HD11 HD23 ' A' ' 104' ' ' LEU . 1.0 OUTLIER -122.95 119.19 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 126.882 2.073 . . . . 0.0 106.676 -174.173 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.9 m -127.21 108.23 10.71 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.417 ' CG ' HD21 ' A' ' 66' ' ' LEU . 53.0 t0 -159.17 161.61 36.23 Favored 'General case' 0 CA--C 1.482 -1.657 0 N-CA-C 101.087 -3.671 . . . . 0.0 101.087 -172.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.642 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 83.8 -38.0 2.81 Favored Glycine 0 N--CA 1.474 1.222 0 O-C-N 119.708 -1.87 . . . . 0.0 114.251 174.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 108.95 0.3 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.613 1 C-N-CA 136.157 5.783 . . . . 0.0 108.19 -161.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.839 ' HA ' HG23 ' A' ' 136' ' ' ILE . 2.3 tp -79.78 129.36 34.41 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 128.867 2.867 . . . . 0.0 109.264 175.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.7 m95 -96.73 100.97 12.5 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 170.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.319 2.0 mm? -97.26 131.24 44.17 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 173.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -105.92 125.3 8.15 Favored Glycine 0 C--N 1.351 1.394 0 N-CA-C 107.234 -2.346 . . . . 0.0 107.234 162.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.565 ' CE1' HD12 ' A' ' 106' ' ' ILE 0.294 1.0 OUTLIER -118.56 152.54 35.82 Favored 'General case' 0 C--N 1.374 1.667 0 CA-C-N 122.373 3.087 . . . . 0.0 106.712 179.163 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.7 m -122.27 137.8 54.72 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 100.438 -3.912 . . . . 0.0 100.438 166.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.22 128.64 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.369 0 N-CA-C 100.702 -3.814 . . . . 0.0 100.702 165.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.629 ' CB ' HD21 ' A' ' 121' ' ' ASN . 14.2 p 40.31 -137.4 0.12 Allowed 'General case' 0 C--N 1.363 1.163 0 N-CA-C 121.266 3.802 . . . . 0.0 121.266 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.359 88.3 tttt 159.31 -65.72 0.0 OUTLIER Pre-proline 0 N--CA 1.421 -1.885 2 C-N-CA 133.879 4.872 . . . . 0.0 109.182 161.812 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -75.46 53.62 3.59 Favored 'Trans proline' 0 CA--C 1.554 1.515 0 C-N-CA 123.267 2.644 . . . . 0.0 115.431 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.629 HD21 ' CB ' ' A' ' 118' ' ' CYS . 0.4 OUTLIER -170.16 172.32 6.41 Favored 'General case' 0 C--N 1.371 1.5 0 N-CA-C 117.148 2.277 . . . . 0.0 117.148 -177.542 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.623 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 29.0 tt0 -141.83 -91.29 0.14 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 128.495 2.718 . . . . 0.0 105.634 156.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 6.9 mptt 50.77 14.85 0.2 Allowed 'General case' 0 C--N 1.364 1.223 1 C-N-CA 136.735 6.014 . . . . 0.0 117.505 -172.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.623 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -169.83 -119.83 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.171 0 C-N-CA 130.669 3.588 . . . . 0.0 106.964 -167.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.465 ' H ' ' HB3' ' A' ' 124' ' ' PHE . 10.0 mmtt -108.72 -65.53 1.13 Allowed 'General case' 0 N--CA 1.425 -1.712 0 N-CA-C 102.634 -3.098 . . . . 0.0 102.634 171.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -177.31 145.98 0.62 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 128.341 2.657 . . . . 0.0 107.893 169.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -147.2 38.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.065 0 N-CA-C 118.681 2.531 . . . . 0.0 118.681 -171.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.8 m -144.06 156.37 44.35 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 170.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.24 130.47 53.38 Favored 'General case' 0 C--N 1.358 0.978 1 N-CA-C 99.001 -4.444 . . . . 0.0 99.001 159.739 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . 0.327 35.9 mt-30 -119.99 72.39 0.93 Allowed 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 120.232 -1.542 . . . . 0.0 107.311 -172.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.256 4.8 t 104.12 117.1 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 125.597 1.559 . . . . 0.0 110.124 -177.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -114.87 113.86 24.76 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 173.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.407 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 6.0 ttp -94.01 108.16 20.01 Favored 'General case' 0 CA--C 1.497 -1.063 0 C-N-CA 126.077 1.751 . . . . 0.0 108.465 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.676 ' H ' HD23 ' A' ' 49' ' ' LEU . . . -123.61 114.81 20.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 121.276 0.56 . . . . 0.0 110.227 -172.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 6.3 mm -134.68 134.17 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.398 1.079 . . . . 0.0 110.544 178.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.839 HG23 ' HA ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -142.65 -179.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.15 0 C-N-CA 127.488 2.315 . . . . 0.0 113.278 -173.087 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.88 106.34 18.32 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 131.156 3.782 . . . . 0.0 107.719 155.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.729 ' CB ' HD21 ' A' ' 141' ' ' LEU 0.277 0.4 OUTLIER -96.59 -91.91 0.23 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 120.069 3.359 . . . . 0.0 120.069 -175.838 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.574 ' HB2' ' HG2' ' A' ' 140' ' ' ARG . 27.0 mtp180 -127.55 -51.99 1.37 Allowed 'General case' 0 C--N 1.371 1.5 0 CA-C-O 123.384 1.564 . . . . 0.0 109.2 -158.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.574 ' HG2' ' HB2' ' A' ' 139' ' ' ARG . 1.6 ptm180 -123.58 19.95 9.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 129.729 3.212 . . . . 0.0 111.335 -168.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.729 HD21 ' CB ' ' A' ' 138' ' ' SER . 0.4 OUTLIER . . . . . 0 CA--C 1.492 -1.255 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.871 -170.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.467 HD11 ' CG2' ' A' ' 106' ' ' ILE . 1.2 pp . . . . . 0 C--O 1.219 -0.509 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.443 68.6 mttt -114.43 148.19 38.12 Favored 'General case' 0 C--N 1.355 0.845 1 N-CA-C 98.48 -4.637 . . . . 0.0 98.48 148.268 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.505 ' H ' ' CE1' ' A' ' 73' ' ' HIS 0.994 0.5 OUTLIER -76.82 146.05 38.04 Favored 'General case' 0 N--CA 1.494 1.74 1 N-CA-C 129.65 6.907 . . . . 0.0 129.65 -134.56 . . . . . . . . 5 4 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 . . . . . 0 N--CA 1.416 -2.133 2 C-N-CA 135.27 5.428 . . . . 0.0 105.418 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.669 ' HA ' HG13 ' A' ' 7' ' ' VAL . 18.1 m-80 . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 115.838 1.792 . . . . 0.0 115.838 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.74 -57.91 10.39 Favored 'General case' 0 C--N 1.347 0.495 1 C-N-CA 133.268 4.627 . . . . 0.0 111.694 171.594 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.0 -15.24 61.1 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.562 2.345 . . . . 0.0 113.294 177.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.669 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.252 0.6 OUTLIER -87.77 -37.03 10.28 Favored 'Isoleucine or valine' 0 C--N 1.355 0.827 0 C-N-CA 127.514 2.325 . . . . 0.0 110.565 179.304 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -70.26 -40.42 74.38 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 129.435 3.094 . . . . 0.0 108.795 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.17 -43.91 99.08 Favored 'Isoleucine or valine' 0 C--N 1.376 1.759 0 C-N-CA 125.02 1.328 . . . . 0.0 109.629 165.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.269 0.3 OUTLIER -58.11 -49.35 77.26 Favored 'General case' 0 C--N 1.37 1.472 0 N-CA-C 116.175 1.917 . . . . 0.0 116.175 171.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.4 -31.39 72.06 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 169.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -77.15 -51.24 11.33 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 126.93 2.092 . . . . 0.0 111.846 174.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -59.11 -28.76 66.83 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.173 3.389 . . . . 0.0 110.15 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.4 OUTLIER -70.14 -51.6 30.18 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 124.779 1.232 . . . . 0.0 111.27 167.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.3 ttt-85 -55.08 -39.56 69.43 Favored 'General case' 0 CA--C 1.566 1.587 0 C-N-CA 125.692 1.597 . . . . 0.0 112.622 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.5 mmt-85 -63.39 -43.86 96.37 Favored 'General case' 0 C--N 1.38 1.9 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 165.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.2 m-70 -56.89 -49.6 75.05 Favored 'General case' 0 C--N 1.39 2.368 0 C-N-CA 128.878 2.871 . . . . 0.0 110.327 171.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.661 ' CE2' HD11 ' A' ' 50' ' ' LEU . 1.4 t80 -54.92 -54.21 45.58 Favored 'General case' 0 C--N 1.379 1.864 0 C-N-CA 131.107 3.763 . . . . 0.0 110.079 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.72 -42.48 67.27 Favored 'General case' 0 C--N 1.372 1.58 0 N-CA-C 119.336 3.088 . . . . 0.0 119.336 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.6 m -69.95 -42.74 72.82 Favored 'General case' 0 C--N 1.363 1.183 0 C-N-CA 127.047 2.139 . . . . 0.0 113.337 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.626 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 4.5 mp0 -74.84 -29.19 60.97 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.208 1.403 . . . . 0.0 109.878 171.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.264 0.2 OUTLIER -62.26 -34.18 76.05 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.043 -1.66 . . . . 0.0 113.275 166.393 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -62.99 -37.55 87.62 Favored 'General case' 0 C--N 1.381 1.974 0 C-N-CA 124.313 1.045 . . . . 0.0 111.432 167.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 tp60 -60.16 -47.71 84.77 Favored 'General case' 0 C--N 1.371 1.537 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 166.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.6 mt -66.84 -45.11 88.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 O-C-N 120.942 -1.099 . . . . 0.0 112.162 178.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.59 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.56 0.7 OUTLIER -72.75 -23.02 60.77 Favored 'General case' 0 C--N 1.366 1.322 0 O-C-N 120.248 -1.533 . . . . 0.0 114.796 173.528 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -73.38 -36.09 66.01 Favored 'General case' 0 C--N 1.362 1.149 0 O-C-N 120.223 -1.548 . . . . 0.0 112.41 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.545 ' HG2' ' HG2' ' A' ' 71' ' ' LYS . 4.0 tp10 -74.03 -43.32 58.34 Favored 'General case' 0 C--N 1.394 2.521 0 O-C-N 119.281 -2.137 . . . . 0.0 109.645 171.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.59 HG13 ' HA ' ' A' ' 26' ' ' ASN 0.431 0.7 OUTLIER -63.66 -42.55 96.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 CA-C-N 120.714 1.597 . . . . 0.0 115.058 176.507 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -71.12 -32.34 68.89 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 120.204 1.366 . . . . 0.0 114.114 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -76.45 -39.62 52.83 Favored 'General case' 0 C--N 1.377 1.781 0 O-C-N 119.449 -2.032 . . . . 0.0 111.275 177.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.63 -44.58 56.61 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.348 1.459 . . . . 0.0 114.277 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.263 59.5 p -68.43 -30.37 69.25 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 120.092 -1.63 . . . . 0.0 112.481 175.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -70.05 -47.35 62.37 Favored 'General case' 0 C--N 1.379 1.848 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 162.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.41 -33.09 74.92 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 126.421 1.888 . . . . 0.0 115.988 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -14.96 61.48 Favored 'General case' 0 C--N 1.376 1.72 0 CA-C-N 119.865 1.211 . . . . 0.0 112.645 168.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 17.91 47.41 Favored Glycine 0 C--N 1.385 3.251 0 O-C-N 121.076 -1.015 . . . . 0.0 113.324 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.512 HG11 ' CG ' ' A' ' 78' ' ' ASN 0.277 0.6 OUTLIER -107.84 177.24 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.987 0 C-N-CA 126.534 1.934 . . . . 0.0 107.224 -174.868 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 6.94 -65.89 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.564 2 C-N-CA 135.758 5.623 . . . . 0.0 122.019 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.0 m 80.28 88.72 0.05 OUTLIER 'General case' 0 C--N 1.36 1.05 1 C-N-CA 132.075 4.15 . . . . 0.0 102.422 -165.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.462 ' CZ ' HG21 ' A' ' 77' ' ' VAL 0.321 52.0 p90 -111.15 140.87 45.34 Favored 'General case' 0 C--N 1.361 1.1 0 CA-C-O 122.743 1.259 . . . . 0.0 109.666 -167.173 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -100.96 162.4 12.92 Favored 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 126.148 1.779 . . . . 0.0 106.808 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.72 122.46 44.59 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.014 0.926 . . . . 0.0 108.916 -178.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -137.49 141.38 41.5 Favored 'General case' 0 N--CA 1.426 -1.663 1 N-CA-C 99.233 -4.358 . . . . 0.0 99.233 174.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.401 ' CD2' ' CD1' ' A' ' 50' ' ' LEU . 3.6 p90 -130.96 155.02 47.5 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 174.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.9 m -99.62 139.61 35.03 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 104.782 -2.303 . . . . 0.0 104.782 167.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -79.44 -8.74 59.33 Favored 'General case' 0 C--O 1.208 -1.129 0 C-N-CA 128.805 2.842 . . . . 0.0 116.374 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.38 96.6 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 124.447 3.294 . . . . 0.0 116.539 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.778 HD22 ' H ' ' A' ' 49' ' ' LEU 0.321 0.2 OUTLIER -68.62 -39.07 80.98 Favored 'General case' 0 CA--C 1.444 -3.127 0 C-N-CA 130.065 3.346 . . . . 0.0 113.151 174.884 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.888 HD23 HD11 ' A' ' 54' ' ' ILE 0.286 0.2 OUTLIER -65.01 -45.98 83.3 Favored 'General case' 0 C--O 1.202 -1.415 1 CA-C-N 108.304 -4.044 . . . . 0.0 108.991 170.71 . . . . . . . . 5 4 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -55.02 -34.32 63.39 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 117.28 -3.387 . . . . 0.0 110.915 170.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -76.63 -27.05 55.55 Favored 'General case' 0 C--N 1.365 1.281 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 166.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.0 -49.26 11.16 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 117.493 -3.254 . . . . 0.0 113.921 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.888 HD11 HD23 ' A' ' 50' ' ' LEU . 66.8 mt -51.56 -43.3 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 1 C-N-CA 134.686 5.194 . . . . 0.0 111.461 174.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.436 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -107.0 -26.0 11.36 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 119.549 3.166 . . . . 0.0 119.549 171.555 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -85.44 -16.6 39.16 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-N 124.394 3.27 . . . . 0.0 113.015 -175.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.605 ' HA ' HD22 ' A' ' 141' ' ' LEU . 16.6 mt-10 -121.59 -56.76 1.86 Allowed 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 128.443 2.697 . . . . 0.0 110.268 -175.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.553 HD13 ' N ' ' A' ' 59' ' ' ASP 0.608 0.0 OUTLIER 73.6 -169.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 C-N-CA 129.894 3.278 . . . . 0.0 108.925 -178.089 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.553 ' N ' HD13 ' A' ' 58' ' ' ILE . 13.2 t70 -8.25 69.24 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.791 1 C-N-CA 133.756 4.822 . . . . 0.0 116.275 173.741 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.5 ' O ' HG12 ' A' ' 63' ' ' VAL 0.393 11.7 pt-20 -98.51 62.17 1.42 Allowed 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 129.469 3.108 . . . . 0.0 108.682 -173.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.389 24.3 p -79.21 -11.91 59.97 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 126.793 3.187 . . . . 0.0 113.244 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.626 ' CE2' HG21 ' A' ' 136' ' ' ILE . 25.2 t80 -69.56 -33.58 72.96 Favored 'General case' 0 CA--C 1.551 1.003 1 C-N-CA 133.131 4.572 . . . . 0.0 109.692 166.499 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.548 HG23 HD13 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -61.98 -44.96 99.64 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 C-N-CA 128.477 2.711 . . . . 0.0 108.767 -178.381 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.287 43.9 m-85 -62.42 -45.27 93.84 Favored 'General case' 0 C--O 1.205 -1.249 1 C-N-CA 134.38 5.072 . . . . 0.0 111.976 167.34 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -61.48 -46.21 90.98 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 124.902 3.501 . . . . 0.0 115.575 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.641 HD12 HD21 ' A' ' 111' ' ' LEU . 2.0 tm? -67.76 -45.94 73.5 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.744 1.217 . . . . 0.0 113.908 169.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.41 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.964 0.0 OUTLIER -77.05 -16.13 59.36 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.153 -2.217 . . . . 0.0 115.869 -179.616 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -72.65 -36.64 68.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 130.066 3.346 . . . . 0.0 107.214 162.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.95 -15.85 61.11 Favored 'General case' 0 CA--C 1.59 2.518 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.663 HG23 ' CD2' ' A' ' 73' ' ' HIS . 4.4 mm -86.23 -40.15 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 128.079 2.552 . . . . 0.0 113.743 171.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.545 ' HG2' ' HG2' ' A' ' 28' ' ' GLU . 31.6 ttpt -52.75 -14.27 0.52 Allowed 'General case' 0 N--CA 1.503 2.203 1 C-N-CA 136.104 5.762 . . . . 0.0 115.951 175.496 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.343 35.3 t70 -80.89 -34.51 33.47 Favored 'General case' 0 N--CA 1.432 -1.369 1 C-N-CA 135.97 5.708 . . . . 0.0 111.014 176.914 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.663 ' CD2' HG23 ' A' ' 70' ' ' ILE 0.371 0.0 OUTLIER -88.12 24.31 1.88 Allowed 'General case' 0 CA--C 1.487 -1.459 0 C-N-CA 130.103 3.361 . . . . 0.0 116.573 -168.407 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.593 ' HA ' HG13 ' A' ' 77' ' ' VAL . 73.1 t -38.4 -33.51 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 129.206 3.002 . . . . 0.0 113.989 158.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.436 ' H ' HD22 ' A' ' 75' ' ' LEU . 2.6 mm? -64.92 -39.5 93.6 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 131.217 3.807 . . . . 0.0 115.628 171.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -74.82 -36.74 62.42 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 127.039 2.135 . . . . 0.0 111.921 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.593 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.514 0.2 OUTLIER -71.34 -28.85 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-O 124.178 1.942 . . . . 0.0 113.149 172.801 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.512 ' CG ' HG11 ' A' ' 38' ' ' VAL . 0.8 OUTLIER -63.53 -47.66 80.71 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 128.765 2.826 . . . . 0.0 110.957 164.464 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -59.26 -30.49 68.33 Favored 'General case' 0 C--N 1.382 2.002 0 C-N-CA 126.459 1.903 . . . . 0.0 114.58 168.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -68.57 -37.9 80.27 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 127.652 2.381 . . . . 0.0 112.697 171.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.686 HD22 ' HB2' ' A' ' 125' ' ' LYS . 2.3 tm? . . . . . 0 C--N 1.377 1.791 0 C-N-CA 129.227 3.011 . . . . 0.0 111.489 170.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.491 -1.429 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 43.1 ptt85 -118.57 149.57 41.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.937 1.827 . . . . 0.0 113.996 -176.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.87 143.39 47.0 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 129.255 3.022 . . . . 0.0 108.305 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -129.88 117.83 20.78 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 103.035 -2.95 . . . . 0.0 103.035 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.432 ' HB ' HD11 ' A' ' 150' ' ' ILE 0.319 15.4 pt -135.57 140.98 43.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 C-N-CA 127.175 2.19 . . . . 0.0 107.664 -175.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.6 m -132.93 125.09 29.07 Favored 'General case' 0 CA--C 1.497 -1.087 0 O-C-N 118.252 -2.78 . . . . 0.0 106.29 -172.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.574 ' HB3' HD11 ' A' ' 66' ' ' LEU . 2.1 t0 -148.12 162.49 39.31 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 103.128 -2.915 . . . . 0.0 103.128 -169.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.617 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 84.29 -61.33 4.73 Favored Glycine 0 N--CA 1.479 1.552 0 O-C-N 119.885 -1.759 . . . . 0.0 115.793 170.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 162.12 -30.34 0.0 OUTLIER 'General case' 0 CA--C 1.563 1.456 1 C-N-CA 137.845 6.458 . . . . 0.0 106.611 -167.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.751 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.559 0.5 OUTLIER -79.56 136.61 36.91 Favored 'General case' 0 C--N 1.379 1.878 2 C-N-CA 132.657 4.383 . . . . 0.0 122.358 -175.908 . . . . . . . . 5 4 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -90.32 101.84 14.57 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.276 0.2 OUTLIER -94.49 131.57 40.06 Favored 'General case' 0 C--N 1.383 2.032 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 177.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.92 127.19 7.69 Favored Glycine 0 C--N 1.353 1.514 0 N-CA-C 105.95 -2.86 . . . . 0.0 105.95 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -120.95 139.93 52.57 Favored 'General case' 0 C--N 1.368 1.405 0 N-CA-C 104.121 -2.548 . . . . 0.0 104.121 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -132.52 137.42 47.16 Favored 'General case' 0 CA--C 1.481 -1.688 0 N-CA-C 100.956 -3.72 . . . . 0.0 100.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -68.62 164.04 2.9 Favored 'Isoleucine or valine' 0 C--N 1.368 1.39 0 CA-C-N 120.282 1.401 . . . . 0.0 109.41 169.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.554 ' CB ' HD21 ' A' ' 121' ' ' ASN . 24.8 p -39.04 99.2 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 126.662 1.985 . . . . 0.0 115.813 169.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.264 54.5 tptt -68.02 -40.62 23.3 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 119.404 3.113 . . . . 0.0 119.404 -168.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -100.15 58.46 0.04 OUTLIER 'Trans proline' 0 CA--C 1.549 1.271 0 CA-C-N 125.327 2.938 . . . . 0.0 111.165 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.554 HD21 ' CB ' ' A' ' 118' ' ' CYS . 0.2 OUTLIER 174.34 -173.83 0.07 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 125.721 1.609 . . . . 0.0 107.009 -175.118 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.436 ' H ' ' HD2' ' A' ' 123' ' ' LYS . 2.9 tp10 -156.09 -77.54 0.09 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 153.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.436 ' HD2' ' H ' ' A' ' 122' ' ' GLU 0.3 1.7 mptp? 60.84 -32.54 0.07 Allowed 'General case' 0 N--CA 1.436 -1.15 1 C-N-CA 135.58 5.552 . . . . 0.0 117.137 -172.872 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.31 -149.07 0.43 Allowed 'General case' 0 N--CA 1.442 -0.827 1 C-N-CA 132.119 4.168 . . . . 0.0 109.602 -179.523 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.686 ' HB2' HD22 ' A' ' 81' ' ' LEU 0.306 0.0 OUTLIER -99.7 -54.01 3.03 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 129.066 2.947 . . . . 0.0 107.456 172.534 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -171.65 107.36 0.38 Allowed Pre-proline 0 C--N 1.356 0.886 0 C-N-CA 125.485 1.514 . . . . 0.0 114.199 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.503 ' HD2' ' SG ' ' A' ' 118' ' ' CYS . 8.2 Cg_endo -121.69 19.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.375 1.957 0 CA-C-N 124.015 2.47 . . . . 0.0 118.125 174.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.26 0.7 OUTLIER -146.29 153.5 40.63 Favored 'General case' 0 CA--C 1.479 -1.769 0 N-CA-C 103.361 -2.829 . . . . 0.0 103.361 159.256 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mt -103.82 135.03 46.13 Favored 'General case' 0 C--N 1.365 1.27 1 N-CA-C 99.758 -4.164 . . . . 0.0 99.758 161.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -129.95 74.85 1.61 Allowed 'General case' 0 CA--C 1.488 -1.41 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 -173.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.285 71.7 m 120.85 78.48 0.0 OUTLIER 'General case' 0 C--N 1.359 1.013 0 N-CA-C 103.845 -2.65 . . . . 0.0 103.845 -174.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -101.66 109.03 20.74 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 102.537 -3.134 . . . . 0.0 102.537 170.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.35 135.17 50.09 Favored 'General case' 0 C--N 1.348 0.528 0 C-N-CA 127.06 2.144 . . . . 0.0 111.134 -174.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.07 116.29 19.06 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 126.62 1.968 . . . . 0.0 110.647 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -135.2 133.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.365 1.255 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 174.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.796 HG22 ' H ' ' A' ' 137' ' ' ASN . 0.2 OUTLIER -121.35 -167.92 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.764 0 C-N-CA 127.432 2.293 . . . . 0.0 112.225 -172.243 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.796 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -177.19 -173.49 0.45 Allowed 'General case' 0 CA--C 1.476 -1.885 1 C-N-CA 137.991 6.517 . . . . 0.0 106.989 177.353 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.574 ' HB2' ' CD ' ' A' ' 139' ' ' ARG 0.375 12.5 m 153.81 -49.94 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 109.923 -3.308 . . . . 0.0 103.975 -168.064 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.574 ' CD ' ' HB2' ' A' ' 138' ' ' SER . 0.0 OUTLIER -133.17 -78.66 0.48 Allowed 'General case' 0 N--CA 1.424 -1.765 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.985 -157.421 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.558 ' HG3' ' HD3' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -105.89 -19.44 13.74 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 130.222 3.409 . . . . 0.0 119.394 -165.413 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.724 ' HB2' ' HA ' ' A' ' 137' ' ' ASN . 2.7 mt . . . . . 0 N--CA 1.439 -1.019 0 C-N-CA 129.647 3.179 . . . . 0.0 114.049 -162.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.432 HD11 ' HB ' ' A' ' 106' ' ' ILE . 4.5 pt . . . . . 0 CA--C 1.547 0.846 0 CA-C-O 122.114 0.959 . . . . 0.0 113.226 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.385 38.7 mttm -116.65 146.98 42.35 Favored 'General case' 0 CA--C 1.5 -0.956 1 N-CA-C 98.969 -4.456 . . . . 0.0 98.969 155.043 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 5.9 t -77.62 139.47 39.5 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 -132.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 . . . . . 0 C--O 1.262 1.761 0 CA-C-N 109.01 -3.723 . . . . 0.0 117.51 -162.011 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.711 ' HA ' HG13 ' A' ' 7' ' ' VAL . 35.4 m-80 . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 117.322 2.341 . . . . 0.0 117.322 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.33 -57.7 9.53 Favored 'General case' 0 C--N 1.349 0.571 1 C-N-CA 131.956 4.102 . . . . 0.0 111.728 172.839 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -75.13 -14.57 60.58 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.013 2.125 . . . . 0.0 112.616 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.711 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.316 0.8 OUTLIER -86.66 -33.67 7.26 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 126.791 2.036 . . . . 0.0 110.696 176.395 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -66.76 -44.69 80.76 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 128.599 2.759 . . . . 0.0 109.002 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mt -58.2 -43.21 85.23 Favored 'Isoleucine or valine' 0 C--N 1.363 1.169 0 CA-C-N 113.615 -1.629 . . . . 0.0 111.696 165.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 12.6 ttm105 -59.94 -49.44 77.66 Favored 'General case' 0 C--N 1.369 1.435 0 O-C-N 119.733 -1.855 . . . . 0.0 115.654 170.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.431 ' HD2' ' HG2' ' A' ' 55' ' ' GLN . 75.9 mtm180 -58.59 -30.53 67.27 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 119.113 3.005 . . . . 0.0 119.113 167.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -77.16 -49.02 16.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.696 3.198 . . . . 0.0 111.035 173.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 14.2 mmtp -57.49 -29.14 64.02 Favored 'General case' 0 C--N 1.376 1.752 0 C-N-CA 128.629 2.772 . . . . 0.0 109.679 170.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.66 HD13 HG23 ' A' ' 54' ' ' ILE . 0.0 OUTLIER -72.32 -43.45 64.12 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.038 1.335 . . . . 0.0 113.854 168.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -55.8 -40.92 73.38 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 119.764 -1.835 . . . . 0.0 112.496 168.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.3 mmt-85 -63.38 -48.09 79.36 Favored 'General case' 0 C--N 1.379 1.879 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 165.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.407 ' CG ' ' O ' ' A' ' 13' ' ' LYS 0.29 11.4 m-70 -57.03 -46.89 82.04 Favored 'General case' 0 C--N 1.39 2.354 1 C-N-CA 131.932 4.093 . . . . 0.0 110.27 175.81 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.625 ' CE1' HD21 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -58.55 -54.54 45.91 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 130.144 3.378 . . . . 0.0 110.889 175.238 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.17 -45.16 58.11 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 118.046 2.609 . . . . 0.0 118.046 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.9 m -65.78 -41.41 92.06 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.252 2.221 . . . . 0.0 112.748 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.567 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.392 3.7 mp0 -77.28 -29.25 53.7 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 120.611 -1.306 . . . . 0.0 111.249 172.071 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.67 -31.27 70.52 Favored 'General case' 0 C--N 1.388 2.258 0 O-C-N 119.18 -2.2 . . . . 0.0 112.76 167.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -69.17 -38.33 78.64 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 125.203 1.401 . . . . 0.0 110.632 165.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 31.4 tp60 -58.47 -46.87 85.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 168.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.453 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.7 mt -70.75 -45.46 73.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 O-C-N 121.24 -0.912 . . . . 0.0 112.285 175.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.628 0.5 OUTLIER -70.61 -23.69 62.6 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 119.825 1.193 . . . . 0.0 113.662 177.099 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -69.31 -45.95 68.3 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.19 -1.569 . . . . 0.0 109.814 167.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.42 ' HG2' ' CG ' ' A' ' 71' ' ' LYS . 18.9 tp10 -64.19 -36.75 85.09 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.764 -1.835 . . . . 0.0 114.308 174.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.409 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 4.8 mt -62.31 -50.09 81.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 C-N-CA 125.055 1.342 . . . . 0.0 113.943 171.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttm105 -68.31 -28.6 67.32 Favored 'General case' 0 C--N 1.361 1.085 0 CA-C-N 121.534 1.97 . . . . 0.0 115.056 176.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -76.21 -45.38 33.34 Favored 'General case' 0 C--N 1.37 1.489 0 O-C-N 119.776 -1.827 . . . . 0.0 110.331 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.6 -40.42 66.53 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.443 ' HA ' HD21 ' A' ' 78' ' ' ASN 0.348 4.0 p -68.93 -39.04 79.84 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.617 1.167 . . . . 0.0 111.19 177.801 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 mmtp -66.32 -46.25 77.53 Favored 'General case' 0 C--N 1.376 1.758 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 167.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.93 71.93 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 126.114 1.766 . . . . 0.0 114.783 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.33 -13.89 60.81 Favored 'General case' 0 C--N 1.376 1.736 0 CA-C-N 119.411 1.005 . . . . 0.0 113.495 169.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.98 18.02 30.68 Favored Glycine 0 C--N 1.38 2.988 0 CA-C-N 119.567 1.076 . . . . 0.0 114.094 171.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.556 HG23 HD11 ' A' ' 81' ' ' LEU . 1.9 m -118.83 175.8 3.56 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 -175.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.316 3.6 m -52.44 162.04 0.59 Allowed 'General case' 0 N--CA 1.428 -1.546 1 C-N-CA 132.574 4.35 . . . . 0.0 118.966 176.86 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.6 m -92.82 112.71 24.76 Favored 'General case' 0 CA--C 1.49 -1.335 0 C-N-CA 124.821 1.249 . . . . 0.0 107.632 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.489 ' HA ' ' O ' ' A' ' 127' ' ' PRO 0.277 42.9 p90 -114.0 144.53 42.95 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.056 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -118.35 163.12 17.19 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-O 123.601 1.667 . . . . 0.0 112.359 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -122.06 121.78 37.76 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 125.766 1.626 . . . . 0.0 114.403 -174.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -122.01 162.05 21.84 Favored 'General case' 0 C--N 1.373 1.621 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 171.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.46 ' CD2' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -116.34 172.55 7.12 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 170.035 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.9 m -97.59 117.84 32.76 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 102.893 -3.002 . . . . 0.0 102.893 159.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.54 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.529 0.0 OUTLIER -78.12 -10.16 59.5 Favored 'General case' 0 CA--C 1.556 1.18 0 O-C-N 120.004 -1.685 . . . . 0.0 115.281 -175.298 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.7 -38.82 46.57 Favored 'General case' 0 C--N 1.376 1.746 0 CA-C-O 126.127 2.87 . . . . 0.0 110.071 172.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.402 HD21 ' HA ' ' A' ' 133' ' ' MET . 21.0 tp -64.45 -35.01 79.55 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 127.809 2.444 . . . . 0.0 111.213 168.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.625 HD21 ' CE1' ' A' ' 18' ' ' PHE . 1.8 mp -74.71 -28.09 60.66 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.123 166.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.15 -30.6 64.6 Favored 'General case' 0 C--N 1.365 1.262 0 O-C-N 118.299 -2.75 . . . . 0.0 109.747 171.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -79.53 -55.43 5.04 Favored 'General case' 0 C--N 1.386 2.195 0 N-CA-C 117.821 2.526 . . . . 0.0 117.821 158.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.16 -30.69 70.55 Favored 'General case' 0 N--CA 1.502 2.15 1 CA-C-N 127.366 4.621 . . . . 0.0 118.852 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.66 HG23 HD13 ' A' ' 14' ' ' LEU . 42.1 mt -68.53 -46.49 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 128.08 2.552 . . . . 0.0 112.529 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.551 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.1 mt-30 -102.54 -18.98 15.04 Favored 'General case' 0 C--N 1.371 1.517 0 N-CA-C 119.031 2.975 . . . . 0.0 119.031 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -90.0 -7.41 54.05 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-N 123.168 2.713 . . . . 0.0 111.794 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 141' ' ' LEU . 28.4 mt-10 -125.96 -65.25 1.0 Allowed 'General case' 0 C--N 1.354 0.786 0 C-N-CA 126.403 1.881 . . . . 0.0 108.93 -176.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.551 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.49 0.2 OUTLIER 71.47 147.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 128.574 2.75 . . . . 0.0 112.593 178.243 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.421 ' HB2' HD12 ' A' ' 58' ' ' ILE . 22.0 t70 58.6 -61.52 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 129.409 3.084 . . . . 0.0 113.679 -175.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.59 ' O ' HG12 ' A' ' 63' ' ' VAL 0.508 7.0 pt-20 27.69 61.56 0.1 Allowed 'General case' 0 C--O 1.205 -1.275 1 C-N-CA 133.799 4.84 . . . . 0.0 114.301 -178.101 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.438 34.9 p -78.03 -10.82 59.79 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 118.171 -2.831 . . . . 0.0 114.043 -172.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.435 ' HE2' HG21 ' A' ' 136' ' ' ILE . 10.8 t80 -68.95 -33.49 73.8 Favored 'General case' 0 CA--C 1.552 1.032 1 C-N-CA 133.653 4.781 . . . . 0.0 110.56 164.314 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.59 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -67.52 -44.33 86.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.412 0 C-N-CA 129.785 3.234 . . . . 0.0 108.804 -178.518 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.567 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.292 28.1 m-85 -63.81 -43.94 94.74 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 130.591 3.556 . . . . 0.0 112.682 166.445 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -59.25 -44.91 92.36 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.259 2.3 . . . . 0.0 114.681 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.73 ' HG ' HD21 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -59.47 -50.72 72.83 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 129.4 3.08 . . . . 0.0 113.125 169.797 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.812 0.1 OUTLIER -77.67 -17.48 57.64 Favored 'General case' 0 C--N 1.377 1.779 0 O-C-N 119.201 -2.187 . . . . 0.0 114.64 176.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.453 ' CE1' HG12 ' A' ' 25' ' ' ILE . 52.9 m-70 -80.03 -16.29 55.42 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 126.852 2.061 . . . . 0.0 111.405 166.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -84.36 -40.93 17.27 Favored 'General case' 0 CA--C 1.556 1.201 0 O-C-N 120.38 -1.45 . . . . 0.0 110.488 160.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.676 HD13 ' N ' ' A' ' 153' ' ' GLN 0.327 0.9 OUTLIER -58.51 -26.16 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.808 0 C-N-CA 128.521 2.728 . . . . 0.0 113.896 176.009 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.42 ' CG ' ' HG2' ' A' ' 28' ' ' GLU . 29.5 pttt -61.72 -11.95 14.39 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 129.615 3.166 . . . . 0.0 117.431 174.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.316 80.5 m-20 -89.18 -36.81 15.46 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 123.8 1.762 . . . . 0.0 109.987 -173.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.529 ' NE2' ' HG3' ' A' ' 151' ' ' LYS . 1.9 t-80 -87.46 24.14 1.73 Allowed 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 131.48 3.912 . . . . 0.0 116.206 -166.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.561 ' HA ' HG13 ' A' ' 77' ' ' VAL 0.283 95.7 t -41.95 -31.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 128.171 2.589 . . . . 0.0 114.118 161.168 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.97 -39.07 92.92 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 127.108 2.163 . . . . 0.0 115.748 171.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.47 ' HG3' ' HE1' ' A' ' 73' ' ' HIS 0.368 63.9 mm-40 -76.24 -34.74 59.2 Favored 'General case' 0 C--N 1.366 1.324 0 O-C-N 118.908 -2.37 . . . . 0.0 113.698 170.413 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.561 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.404 1.9 p -70.81 -29.29 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.699 0 CA-C-O 124.084 1.897 . . . . 0.0 113.654 173.318 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.443 HD21 ' HA ' ' A' ' 33' ' ' SER . 4.6 m120 -64.43 -45.37 87.79 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 130.36 3.464 . . . . 0.0 110.326 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.28 -30.28 71.13 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 126.187 1.795 . . . . 0.0 112.762 172.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.518 ' CE1' HG23 ' A' ' 77' ' ' VAL 0.609 0.2 OUTLIER -74.86 -29.6 61.08 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 169.381 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.556 HD11 HG23 ' A' ' 38' ' ' VAL 0.307 0.4 OUTLIER . . . . . 0 C--N 1.377 1.795 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 168.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.616 0 CA-C-O 122.562 1.09 . . . . 0.0 113.347 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.1 ptt180 -119.42 146.56 45.27 Favored 'General case' 0 C--N 1.349 0.546 0 C-N-CA 125.59 1.556 . . . . 0.0 111.695 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pp -140.16 150.42 44.2 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 126.423 1.889 . . . . 0.0 111.715 -175.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -130.16 130.87 45.29 Favored 'General case' 0 C--N 1.367 1.336 0 C-N-CA 127.277 2.231 . . . . 0.0 105.444 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.855 HD13 ' HG2' ' A' ' 153' ' ' GLN . 4.9 pt -134.51 138.68 49.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.662 ' O ' HG22 ' A' ' 150' ' ' ILE . 8.9 t -101.64 106.97 18.09 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 173.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.39 143.77 34.14 Favored 'General case' 0 CA--C 1.477 -1.845 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 -168.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 81.71 -21.76 6.23 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.866 2.174 . . . . 0.0 112.23 178.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 116.53 -9.49 0.0 OUTLIER 'General case' 0 C--N 1.376 1.73 1 C-N-CA 135.653 5.581 . . . . 0.0 110.623 -167.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.826 HD13 HD12 ' A' ' 136' ' ' ILE 0.64 0.0 OUTLIER -78.82 138.2 38.07 Favored 'General case' 0 CA--C 1.481 -1.68 1 C-N-CA 135.025 5.33 . . . . 0.0 118.654 -178.649 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . 0.478 ' HE1' ' ND2' ' A' ' 137' ' ' ASN . 54.8 m95 -90.45 98.48 11.8 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 103.191 -2.892 . . . . 0.0 103.191 172.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.571 HD13 HD11 ' A' ' 66' ' ' LEU 0.369 0.1 OUTLIER -108.46 119.43 39.49 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.758 176.085 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -106.76 131.73 10.79 Favored Glycine 0 C--N 1.361 1.943 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.672 ' CE1' HD11 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -115.53 145.97 42.14 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 103.249 -2.871 . . . . 0.0 103.249 177.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -138.86 124.42 19.5 Favored 'General case' 0 CA--C 1.488 -1.42 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -79.57 145.03 9.94 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 120.116 1.326 . . . . 0.0 110.876 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 25.0 m -4.44 84.1 0.0 OUTLIER 'General case' 0 C--N 1.37 1.458 0 C-N-CA 130.353 3.461 . . . . 0.0 119.856 -172.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.266 19.0 tptm -43.39 -48.63 17.57 Favored Pre-proline 0 C--N 1.365 1.266 0 C-N-CA 129.955 3.302 . . . . 0.0 116.238 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -87.06 90.02 0.6 Allowed 'Trans proline' 0 CA--C 1.561 1.87 0 C-N-CA 123.464 2.776 . . . . 0.0 107.589 156.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.264 11.0 m120 -47.78 116.97 1.65 Allowed 'General case' 0 C--N 1.369 1.413 0 C-N-CA 131.19 3.796 . . . . 0.0 119.226 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -83.48 -7.41 59.55 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 130.927 3.691 . . . . 0.0 120.652 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.295 19.4 mmtm 53.51 46.69 25.63 Favored 'General case' 0 N--CA 1.434 -1.229 1 C-N-CA 132.017 4.127 . . . . 0.0 119.958 176.71 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.271 38.1 m-85 -156.63 170.36 22.56 Favored 'General case' 0 CA--C 1.489 -1.384 0 CA-C-N 114.475 -1.238 . . . . 0.0 113.972 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.78 76.27 0.97 Allowed 'General case' 0 C--N 1.364 1.224 0 C-N-CA 127.575 2.35 . . . . 0.0 109.416 174.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.449 ' N ' ' HD3' ' A' ' 127' ' ' PRO . 1.2 p30 -175.48 49.9 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.321 1 C-N-CA 137.937 6.495 . . . . 0.0 110.564 177.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.489 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 11.1 Cg_exo -98.7 -178.23 0.26 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.057 3.172 . . . . 0.0 114.182 -164.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.5 p -125.74 163.98 21.65 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.08 130.38 48.66 Favored 'General case' 0 C--N 1.361 1.104 0 N-CA-C 100.288 -3.967 . . . . 0.0 100.288 176.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -109.68 58.49 0.61 Allowed 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 -168.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 17.2 t 119.08 120.39 0.0 OUTLIER 'General case' 0 C--N 1.364 1.22 0 O-C-N 126.796 2.56 . . . . 0.0 106.259 -169.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -114.55 109.42 18.24 Favored 'General case' 0 C--N 1.357 0.907 1 N-CA-C 97.199 -5.112 . . . . 0.0 97.199 159.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . 0.421 ' O ' ' HA ' ' A' ' 113' ' ' LEU . 0.0 OUTLIER -93.88 119.52 32.91 Favored 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 125.632 1.573 . . . . 0.0 107.87 -177.26 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -127.77 114.93 17.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 120.347 1.43 . . . . 0.0 108.422 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 5.3 mt -142.35 144.19 25.2 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.826 HD12 HD13 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -125.51 177.66 4.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.65 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -164.161 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.478 ' ND2' ' HE1' ' A' ' 112' ' ' TRP . 0.2 OUTLIER -133.14 117.5 17.56 Favored 'General case' 0 C--N 1.361 1.082 2 N-CA-C 98.023 -4.806 . . . . 0.0 98.023 162.202 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.99 -61.65 0.03 OUTLIER 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 103.838 -2.652 . . . . 0.0 103.838 -173.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.718 ' CD ' ' H ' ' A' ' 140' ' ' ARG 0.716 0.2 OUTLIER 94.88 132.09 0.02 OUTLIER 'General case' 0 C--N 1.369 1.417 0 CA-C-O 122.524 1.154 . . . . 0.0 112.704 -177.736 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.718 ' H ' ' CD ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER 124.5 -41.32 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.454 3 C-N-CA 135.705 5.602 . . . . 0.0 99.018 -144.388 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.64 HD13 ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.38 1.893 2 N-CA-C 127.924 6.268 . . . . 0.0 127.924 171.046 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.861 HD13 ' HG2' ' A' ' 151' ' ' LYS 0.432 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 122.05 0.929 . . . . 0.0 109.783 . . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.861 ' HG2' HD13 ' A' ' 150' ' ' ILE 0.381 7.2 ptmt -73.87 152.82 40.11 Favored 'General case' 0 CA--C 1.511 -0.523 1 C-N-CA 135.177 5.391 . . . . 0.0 105.095 175.73 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.484 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 82.8 p -86.21 93.64 9.1 Favored 'General case' 0 C--O 1.203 -1.38 2 O-C-N 114.173 -5.33 . . . . 0.0 109.077 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.855 ' HG2' HD13 ' A' ' 106' ' ' ILE 0.426 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 1 N-CA-C 126.395 5.702 . . . . 0.0 126.395 -162.303 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.37 3.4 m120 . . . . . 0 N--CA 1.466 0.347 0 N-CA-C 119.673 3.212 . . . . 0.0 119.673 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -50.75 72.8 Favored 'General case' 0 N--CA 1.445 -0.717 1 C-N-CA 133.341 4.656 . . . . 0.0 111.696 166.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -80.35 -16.83 53.64 Favored 'General case' 0 C--N 1.372 1.57 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.0 t -81.55 -39.42 17.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.213 0 C-N-CA 130.41 3.484 . . . . 0.0 108.828 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.56 -47.99 76.7 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.363 2.665 . . . . 0.0 110.339 173.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.81 -43.22 66.47 Favored 'Isoleucine or valine' 0 C--N 1.362 1.14 0 C-N-CA 125.708 1.603 . . . . 0.0 113.495 166.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.1 mtm180 -60.45 -50.78 72.19 Favored 'General case' 0 CA--C 1.56 1.345 0 C-N-CA 126.132 1.773 . . . . 0.0 114.086 171.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -60.47 -26.98 67.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 128.793 2.837 . . . . 0.0 117.634 167.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -77.72 -51.09 11.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 130.381 3.472 . . . . 0.0 110.991 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.8 mmtt -57.75 -29.75 65.04 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 128.907 2.883 . . . . 0.0 109.739 169.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' A' ' 54' ' ' ILE . 0.2 OUTLIER -66.68 -49.75 65.11 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 114.233 -1.349 . . . . 0.0 113.887 164.27 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -57.64 -39.56 77.27 Favored 'General case' 0 C--N 1.371 1.533 0 CA-C-N 123.474 2.852 . . . . 0.0 114.452 171.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -61.18 -53.18 60.15 Favored 'General case' 0 C--N 1.379 1.85 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 167.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.293 50.1 m-70 -58.21 -48.73 79.45 Favored 'General case' 0 C--N 1.383 2.046 0 C-N-CA 129.157 2.983 . . . . 0.0 111.922 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.612 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU 0.287 0.9 OUTLIER -57.07 -55.64 32.04 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 128.372 2.669 . . . . 0.0 114.583 174.947 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.98 -35.46 62.05 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -176.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -67.96 -45.01 75.39 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 124.634 1.174 . . . . 0.0 112.806 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.64 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 38.1 mt-10 -77.56 -29.96 52.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.263 -1.523 . . . . 0.0 112.491 173.023 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.312 2.2 m-85 -67.38 -25.96 66.22 Favored 'General case' 0 C--N 1.383 2.05 0 O-C-N 118.706 -2.497 . . . . 0.0 112.362 169.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -66.31 -46.97 75.09 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-O 117.088 -1.434 . . . . 0.0 109.827 161.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -56.68 -47.61 79.47 Favored 'General case' 0 C--N 1.364 1.227 0 N-CA-C 118.842 2.904 . . . . 0.0 118.842 171.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.526 HG12 ' CE1' ' A' ' 68' ' ' HIS . 6.8 mt -70.21 -42.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 O-C-N 120.638 -1.289 . . . . 0.0 111.49 176.023 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.729 0.0 OUTLIER -74.75 -23.27 58.52 Favored 'General case' 0 C--N 1.373 1.59 0 O-C-N 119.224 -2.173 . . . . 0.0 115.345 177.186 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.61 -37.38 73.84 Favored 'General case' 0 C--N 1.383 2.026 0 C-N-CA 125.652 1.581 . . . . 0.0 110.724 167.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.93 -39.36 93.39 Favored 'General case' 0 C--N 1.388 2.245 0 O-C-N 118.961 -2.337 . . . . 0.0 112.013 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.456 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.6 mt -61.55 -42.0 92.34 Favored 'Isoleucine or valine' 0 C--N 1.373 1.59 0 CA-C-N 120.177 1.353 . . . . 0.0 114.321 172.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.424 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 44.8 ttm180 -59.71 -49.52 77.41 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 124.815 1.246 . . . . 0.0 114.356 174.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -77.06 -37.97 53.54 Favored 'General case' 0 C--N 1.372 1.58 0 C-N-CA 128.527 2.731 . . . . 0.0 113.912 -176.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.534 ' HB3' HG11 ' A' ' 74' ' ' VAL . . . -80.31 -29.16 38.09 Favored 'General case' 0 CA--C 1.494 -1.175 0 CA-C-O 122.49 1.138 . . . . 0.0 113.336 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.461 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.344 23.2 p -79.11 -32.78 44.66 Favored 'General case' 0 C--N 1.357 0.904 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.727 173.277 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 90.2 mttt -60.43 -38.78 85.15 Favored 'General case' 0 C--N 1.374 1.647 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 163.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.09 -36.76 64.29 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.764 2.426 . . . . 0.0 112.843 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.61 61.25 Favored 'General case' 0 C--N 1.383 2.033 0 CA-C-N 119.342 0.974 . . . . 0.0 112.508 168.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.36 17.15 51.16 Favored Glycine 0 C--N 1.364 2.114 0 C-N-CA 127.161 2.315 . . . . 0.0 114.076 172.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.8 HG23 HD11 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -119.52 148.13 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.607 0 CA-C-O 124.482 2.086 . . . . 0.0 108.824 -174.776 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.322 0.1 OUTLIER -11.25 -58.77 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.655 2 C-N-CA 135.757 5.623 . . . . 0.0 121.846 -179.584 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.302 90.8 p 100.23 171.28 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.743 0 C-N-CA 129.3 3.04 . . . . 0.0 108.542 -171.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.456 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 54.2 p90 -151.12 154.79 37.62 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 126.189 1.796 . . . . 0.0 107.195 176.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.428 ' O ' ' HA ' ' A' ' 128' ' ' SER . 72.0 t60 -116.33 124.15 49.41 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 122.296 1.046 . . . . 0.0 109.835 174.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -94.55 160.91 14.43 Favored 'General case' 0 C--N 1.338 0.105 0 O-C-N 118.275 -2.765 . . . . 0.0 114.356 -175.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -138.73 141.41 38.91 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.25 1.82 . . . . 0.0 106.631 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -108.56 154.61 21.7 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 125.445 1.498 . . . . 0.0 108.238 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 110.71 22.76 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 125.063 1.345 . . . . 0.0 113.067 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.563 ' HA ' ' CB ' ' A' ' 50' ' ' LEU 0.965 0.0 OUTLIER -72.73 -8.28 54.62 Favored 'General case' 0 C--N 1.355 0.816 1 C-N-CA 134.004 4.922 . . . . 0.0 120.656 -175.304 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 -47.08 15.82 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 125.292 2.472 . . . . 0.0 109.707 167.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.8 tp -60.67 -36.07 77.83 Favored 'General case' 0 C--N 1.369 1.429 0 C-N-CA 128.339 2.656 . . . . 0.0 110.06 164.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.612 ' HG ' ' CZ ' ' A' ' 18' ' ' PHE 0.367 0.2 OUTLIER -74.52 -28.51 61.0 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 113.203 -1.817 . . . . 0.0 111.443 170.414 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -59.93 -29.47 68.41 Favored 'General case' 0 CA--C 1.559 1.31 0 O-C-N 116.524 -3.86 . . . . 0.0 109.287 171.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -73.21 -50.93 19.72 Favored 'General case' 0 C--N 1.381 1.948 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 158.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.456 ' HB3' HD13 ' A' ' 50' ' ' LEU . . . -61.8 -29.48 70.18 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 123.945 3.066 . . . . 0.0 116.919 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.573 ' HA ' HD23 ' A' ' 14' ' ' LEU . 1.3 tt -75.58 -39.01 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.139 1 C-N-CA 132.754 4.422 . . . . 0.0 112.693 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.19 -26.28 15.0 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 118.525 -1.27 . . . . 0.0 112.8 172.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -74.03 -52.31 13.12 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 120.617 -1.302 . . . . 0.0 112.179 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.511 ' HG2' HD11 ' A' ' 141' ' ' LEU . 2.6 mp0 -109.51 8.42 25.16 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 116.826 2.158 . . . . 0.0 116.826 -175.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 59' ' ' ASP 0.474 0.0 OUTLIER 23.83 -26.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.633 2 C-N-CA 136.656 5.982 . . . . 0.0 125.723 175.096 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.487 ' N ' HD13 ' A' ' 58' ' ' ILE . 10.6 p-10 -112.92 -47.47 3.04 Favored 'General case' 0 CA--C 1.467 -2.214 1 C-N-CA 132.334 4.253 . . . . 0.0 108.706 176.613 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.469 ' O ' ' HB ' ' A' ' 63' ' ' VAL 0.892 0.0 OUTLIER 15.47 55.61 0.01 OUTLIER 'General case' 0 C--N 1.359 0.995 0 N-CA-C 121.348 3.833 . . . . 0.0 121.348 -166.887 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.258 21.6 p -78.78 -19.07 53.08 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 129.605 3.162 . . . . 0.0 110.705 174.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.412 ' HE2' HG21 ' A' ' 136' ' ' ILE 0.266 40.5 t80 -65.48 -34.51 78.43 Favored 'General case' 0 CA--C 1.543 0.703 1 C-N-CA 132.458 4.303 . . . . 0.0 111.636 168.621 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.484 ' CG2' HD21 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -60.66 -45.87 96.77 Favored 'Isoleucine or valine' 0 C--N 1.364 1.233 0 C-N-CA 130.231 3.413 . . . . 0.0 109.076 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.64 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 43.2 m-85 -62.61 -46.0 90.29 Favored 'General case' 0 CA--C 1.493 -1.241 1 C-N-CA 132.422 4.289 . . . . 0.0 112.79 170.078 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.89 -42.47 97.46 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 121.564 1.984 . . . . 0.0 114.902 177.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.459 HD21 ' HB3' ' A' ' 108' ' ' ASP . 2.2 tm? -65.02 -49.27 70.83 Favored 'General case' 0 CA--C 1.565 1.526 0 C-N-CA 127.797 2.439 . . . . 0.0 113.516 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.431 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.782 0.0 OUTLIER -78.5 -16.26 57.7 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 118.485 -2.634 . . . . 0.0 115.909 178.23 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.526 ' CE1' HG12 ' A' ' 25' ' ' ILE . 46.5 m-70 -76.81 -28.31 55.52 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 129.405 3.082 . . . . 0.0 106.797 164.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -70.08 -34.89 73.74 Favored 'General case' 0 CA--C 1.569 1.704 0 O-C-N 118.769 -2.457 . . . . 0.0 112.483 159.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.804 HD13 ' HB2' ' A' ' 153' ' ' GLN . 20.1 mm -72.1 -11.88 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.087 1 C-N-CA 132.258 4.223 . . . . 0.0 118.05 176.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.3 pttm -60.06 -26.94 66.55 Favored 'General case' 0 C--N 1.32 -0.699 2 N-CA-C 124.157 4.873 . . . . 0.0 124.157 -175.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.34 -20.26 15.93 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 127.239 2.215 . . . . 0.0 108.735 -172.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.721 ' CD2' ' HA ' ' A' ' 153' ' ' GLN . 2.1 m-70 -77.22 16.07 0.64 Allowed 'General case' 0 C--N 1.372 1.563 0 C-N-CA 129.174 2.99 . . . . 0.0 112.414 172.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.571 ' HA ' ' CG1' ' A' ' 77' ' ' VAL . 3.9 p -49.99 -27.93 4.08 Favored 'Isoleucine or valine' 0 C--N 1.378 1.82 0 C-N-CA 128.678 2.791 . . . . 0.0 111.569 157.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.24 -31.01 69.29 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 128.215 2.606 . . . . 0.0 113.22 174.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -76.28 -40.06 52.69 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 126.967 2.107 . . . . 0.0 112.324 172.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.571 ' CG1' ' HA ' ' A' ' 74' ' ' VAL 0.461 3.0 p -70.11 -27.82 33.81 Favored 'Isoleucine or valine' 0 C--N 1.367 1.353 0 CA-C-O 124.629 2.156 . . . . 0.0 111.636 171.405 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.461 HD21 ' HB2' ' A' ' 33' ' ' SER . 9.1 m120 -70.12 -38.7 75.64 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.991 2.116 . . . . 0.0 114.39 167.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -30.43 70.0 Favored 'General case' 0 C--N 1.369 1.423 0 CA-C-N 121.075 1.761 . . . . 0.0 111.269 170.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -64.04 -36.17 83.11 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 129.139 2.976 . . . . 0.0 112.03 167.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.8 HD11 HG23 ' A' ' 38' ' ' VAL 0.275 0.5 OUTLIER . . . . . 0 C--N 1.39 2.365 0 O-C-N 119.81 -1.806 . . . . 0.0 113.769 170.321 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.171 0 N-CA-C 119.017 2.367 . . . . 0.0 119.017 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -140.99 140.96 34.44 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 120.961 -1.317 . . . . 0.0 107.695 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 mt -115.95 129.3 56.33 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 127.004 2.122 . . . . 0.0 108.54 -176.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -129.89 110.87 12.04 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 18.0 pt -135.72 139.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 110.673 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -112.49 127.71 56.13 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 173.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.459 ' HB3' HD21 ' A' ' 66' ' ' LEU . 47.8 t0 -139.11 -174.54 3.88 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 100.625 -3.843 . . . . 0.0 100.625 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.81 -59.44 3.01 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 121.468 3.347 . . . . 0.0 121.468 154.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . 0.272 1.1 m-80 129.74 -28.57 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 131.163 3.785 . . . . 0.0 104.403 -144.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.484 HD21 ' CG2' ' A' ' 63' ' ' VAL . 0.2 OUTLIER -79.47 132.47 36.36 Favored 'General case' 0 C--N 1.359 1.006 1 C-N-CA 132.412 4.285 . . . . 0.0 117.959 -171.853 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -92.02 101.48 14.02 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 167.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.443 HD11 ' CD1' ' A' ' 66' ' ' LEU 0.294 1.4 mm? -95.09 121.53 36.82 Favored 'General case' 0 C--N 1.383 2.037 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 176.456 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -116.19 122.65 5.6 Favored Glycine 0 C--N 1.355 1.611 0 N-CA-C 106.484 -2.647 . . . . 0.0 106.484 171.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -117.6 147.0 43.25 Favored 'General case' 0 C--N 1.367 1.347 0 CA-C-N 121.402 2.601 . . . . 0.0 104.656 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.9 m -134.57 133.31 40.09 Favored 'General case' 0 C--N 1.367 1.334 0 N-CA-C 103.118 -2.919 . . . . 0.0 103.118 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -92.84 139.96 17.12 Favored 'Isoleucine or valine' 0 C--N 1.352 0.698 0 C-N-CA 125.497 1.519 . . . . 0.0 109.514 177.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.306 20.0 p -7.41 73.15 0.0 OUTLIER 'General case' 0 C--N 1.38 1.898 0 C-N-CA 131.571 3.948 . . . . 0.0 119.869 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.333 44.5 tttp -44.3 -53.68 13.56 Favored Pre-proline 0 C--N 1.363 1.161 1 C-N-CA 133.585 4.754 . . . . 0.0 116.959 -171.869 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.64 71.52 1.45 Allowed 'Trans proline' 0 CA--C 1.564 1.983 0 C-N-CA 123.368 2.712 . . . . 0.0 110.429 161.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -55.66 141.25 38.54 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 120.692 3.59 . . . . 0.0 120.692 -173.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.15 113.48 2.96 Favored 'General case' 0 N--CA 1.425 -1.706 2 N-CA-C 95.529 -5.73 . . . . 0.0 95.529 167.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 33.6 mmtm -71.43 55.98 0.24 Allowed 'General case' 0 C--N 1.345 0.382 0 C-N-CA 129.937 3.295 . . . . 0.0 117.241 -172.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -58.28 148.83 26.04 Favored 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.538 4.335 . . . . 0.0 117.586 177.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.307 0.0 OUTLIER -110.82 48.78 0.9 Allowed 'General case' 0 C--N 1.368 1.391 0 CA-C-O 123.816 1.769 . . . . 0.0 107.546 176.024 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.408 ' N ' ' HD3' ' A' ' 127' ' ' PRO . 31.4 t70 -173.36 62.77 0.28 Allowed Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 130.789 3.635 . . . . 0.0 108.448 176.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.41 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 29.8 Cg_exo -71.78 -177.07 2.32 Favored 'Trans proline' 0 C--N 1.355 0.88 1 C-N-CA 126.589 4.859 . . . . 0.0 118.838 -175.018 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 42' ' ' HIS . 77.7 p -137.63 153.07 49.92 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-N 110.413 -3.085 . . . . 0.0 103.343 167.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 43.1 mt -103.24 130.68 50.53 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 101.329 -3.582 . . . . 0.0 101.329 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -126.34 67.4 1.22 Allowed 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -160.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 72.5 m 110.8 84.04 0.0 OUTLIER 'General case' 0 C--N 1.372 1.587 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -101.58 109.81 21.68 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 101.418 -3.549 . . . . 0.0 101.418 173.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.52 121.98 45.39 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 127.325 2.25 . . . . 0.0 107.355 -174.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.15 114.76 17.42 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 176.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -133.8 149.73 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-O 123.053 1.406 . . . . 0.0 109.211 -176.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.537 HD13 HD21 ' A' ' 141' ' ' LEU . 0.1 OUTLIER -129.02 -179.7 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 C-N-CA 125.275 1.43 . . . . 0.0 108.597 -175.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.524 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -133.6 124.52 27.0 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 128.735 2.814 . . . . 0.0 116.863 -170.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . 0.401 ' HB3' HH11 ' A' ' 139' ' ' ARG 0.36 14.5 m 150.22 -83.8 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.089 1 C-N-CA 132.135 4.174 . . . . 0.0 102.926 176.561 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.65 ' HG2' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER 153.83 152.23 0.01 OUTLIER 'General case' 0 CA--C 1.483 -1.596 1 N-CA-C 96.747 -5.279 . . . . 0.0 96.747 -166.309 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.65 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 39.77 -51.78 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.975 2 CA-C-N 129.347 5.522 . . . . 0.0 124.173 -178.657 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.537 HD21 HD13 ' A' ' 136' ' ' ILE 0.416 0.0 OUTLIER . . . . . 0 N--CA 1.427 -1.621 1 C-N-CA 150.524 11.53 . . . . 0.0 118.821 178.175 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.466 ' CD1' ' HG2' ' A' ' 151' ' ' LYS 0.543 0.0 OUTLIER . . . . . 0 N--CA 1.448 -0.537 0 CA-C-O 124.772 2.225 . . . . 0.0 110.089 . . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.466 ' HG2' ' CD1' ' A' ' 150' ' ' ILE . 0.0 OUTLIER -75.12 158.31 33.29 Favored 'General case' 0 N--CA 1.416 -2.127 1 C-N-CA 145.279 9.432 . . . . 0.0 110.91 -171.888 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.506 ' O ' HG23 ' A' ' 152' ' ' THR . 14.6 t -74.18 113.88 11.89 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 128.003 3.763 . . . . 0.0 102.883 166.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.804 ' HB2' HD13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.402 -2.844 0 CA-C-N 109.582 -3.463 . . . . 0.0 108.841 -167.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.1 m120 . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 124.09 1.9 . . . . 0.0 114.264 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -58.23 1.93 Allowed 'General case' 0 N--CA 1.448 -0.557 1 C-N-CA 135.515 5.526 . . . . 0.0 106.768 164.557 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 13.5 mt-10 -66.21 -9.82 35.79 Favored 'General case' 0 C--N 1.369 1.449 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.31 -38.14 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 C-N-CA 129.561 3.145 . . . . 0.0 112.035 177.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -71.56 -47.4 55.29 Favored 'General case' 0 C--N 1.357 0.933 1 C-N-CA 132.148 4.179 . . . . 0.0 107.665 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.9 mt -58.72 -43.88 88.76 Favored 'Isoleucine or valine' 0 C--N 1.37 1.497 0 C-N-CA 125.254 1.422 . . . . 0.0 112.132 168.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HB3' HD13 ' A' ' 58' ' ' ILE 0.296 91.2 mtm-85 -64.09 -50.14 69.48 Favored 'General case' 0 C--N 1.376 1.739 0 O-C-N 120.046 -1.659 . . . . 0.0 114.33 169.09 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 29.7 mtp180 -57.5 -28.64 63.63 Favored 'General case' 0 C--N 1.374 1.639 0 CA-C-N 124.405 3.275 . . . . 0.0 119.165 172.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -77.6 -51.64 10.32 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 130.374 3.47 . . . . 0.0 112.006 172.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -57.44 -28.62 63.48 Favored 'General case' 0 C--N 1.378 1.809 0 C-N-CA 128.131 2.572 . . . . 0.0 110.742 170.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.661 HD12 ' HA ' ' A' ' 58' ' ' ILE . 0.2 OUTLIER -70.71 -45.36 65.08 Favored 'General case' 0 C--O 1.206 -1.215 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.544 167.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -55.81 -40.39 72.67 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.747 -1.221 . . . . 0.0 114.106 169.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 mmt-85 -63.45 -49.08 75.08 Favored 'General case' 0 C--N 1.374 1.654 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 166.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -56.77 -43.51 80.87 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 129.397 3.079 . . . . 0.0 110.875 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.446 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.76 -54.95 39.01 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 130.546 3.538 . . . . 0.0 112.174 175.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -75.82 -39.62 56.42 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 -178.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -73.2 -36.11 66.46 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.749 2.42 . . . . 0.0 112.426 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.654 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.341 33.4 mt-10 -77.64 -29.37 51.66 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 120.463 -1.398 . . . . 0.0 110.89 167.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.515 ' CZ ' ' CE2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -59.18 -32.58 70.04 Favored 'General case' 0 C--N 1.383 2.049 0 O-C-N 119.175 -2.203 . . . . 0.0 113.511 168.59 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.438 ' HE ' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -67.49 -45.98 74.27 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 127.774 2.43 . . . . 0.0 109.527 167.468 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -57.47 -39.75 77.06 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 170.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.543 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.1 mt -72.07 -45.56 62.59 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 O-C-N 120.908 -1.12 . . . . 0.0 111.657 177.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.438 HD21 ' HE ' ' A' ' 23' ' ' ARG 0.488 8.3 p30 -70.84 -24.16 62.48 Favored 'General case' 0 C--N 1.373 1.61 0 O-C-N 120.179 -1.575 . . . . 0.0 114.283 173.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -73.77 -29.99 62.52 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.159 2.184 . . . . 0.0 110.182 169.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.68 -38.46 64.9 Favored 'General case' 0 C--N 1.39 2.346 0 O-C-N 118.315 -2.741 . . . . 0.0 109.739 172.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.436 HG12 ' CE2' ' A' ' 41' ' ' PHE . 1.3 mt -64.62 -46.13 93.37 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 CA-C-O 118.04 -0.981 . . . . 0.0 111.101 167.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.8 tpp180 -55.38 -45.0 76.62 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 122.632 2.469 . . . . 0.0 116.705 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.59 -41.16 47.27 Favored 'General case' 0 CA--C 1.488 -1.418 0 C-N-CA 128.018 2.527 . . . . 0.0 112.639 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.13 -31.4 30.6 Favored 'General case' 0 C--N 1.355 0.835 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.297 25.6 p -75.4 -34.82 61.1 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.388 1.475 . . . . 0.0 108.722 177.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -71.15 -35.88 71.85 Favored 'General case' 0 C--N 1.368 1.395 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 165.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 -36.2 64.31 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.79 -14.74 60.31 Favored 'General case' 0 C--N 1.375 1.697 0 CA-C-N 120.761 1.619 . . . . 0.0 114.016 171.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.37 15.42 44.15 Favored Glycine 0 C--N 1.376 2.8 0 O-C-N 121.187 -0.945 . . . . 0.0 114.51 172.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.776 HG22 HD23 ' A' ' 81' ' ' LEU . 7.5 p -99.98 179.37 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 126.379 1.872 . . . . 0.0 107.026 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.82 ' HB3' HD21 ' A' ' 81' ' ' LEU 0.27 32.5 t -83.56 155.71 23.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 124.676 2.179 . . . . 0.0 110.957 167.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.9 m -92.89 130.1 38.59 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.935 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.436 ' CE2' HG12 ' A' ' 29' ' ' ILE . 5.0 p90 -113.41 152.73 29.66 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 129.09 2.956 . . . . 0.0 105.704 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -101.5 161.35 13.7 Favored 'General case' 0 C--N 1.354 0.795 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -121.41 120.3 34.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.146 -1.596 . . . . 0.0 111.281 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.55 141.46 51.36 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.768 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 4.3 m-85 -101.48 150.16 23.33 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.892 1.277 . . . . 0.0 108.871 172.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.4 m -123.06 85.78 2.48 Favored 'General case' 0 C--N 1.349 0.587 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 165.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.415 ' HG2' ' H ' ' A' ' 47' ' ' GLN . 4.7 mm-40 -48.24 -10.9 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 121.217 3.784 . . . . 0.0 121.217 -168.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.68 -37.55 79.09 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 125.948 3.976 . . . . 0.0 116.166 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.799 HD13 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -68.28 -43.38 77.86 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-O 125.968 2.794 . . . . 0.0 111.132 171.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.799 ' H ' HD13 ' A' ' 49' ' ' LEU . 2.7 tt -64.11 -38.72 92.07 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 118.62 -2.55 . . . . 0.0 109.533 176.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -60.43 -32.46 71.38 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 129.621 3.168 . . . . 0.0 109.585 171.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 78.0 mtm180 -63.02 -47.12 84.42 Favored 'General case' 0 C--N 1.391 2.383 0 O-C-N 120.357 -1.464 . . . . 0.0 113.625 161.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -28.59 68.47 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.581 HD12 ' CD2' ' A' ' 50' ' ' LEU 0.336 0.1 OUTLIER -70.3 -39.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 131.698 3.999 . . . . 0.0 111.179 179.299 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.4 mt-30 -107.39 -26.48 10.96 Favored 'General case' 0 C--N 1.372 1.559 0 N-CA-C 117.24 2.311 . . . . 0.0 117.24 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -83.5 -18.6 37.92 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.801 2.091 . . . . 0.0 113.933 -175.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 140' ' ' ARG . 1.9 mp0 -115.21 -67.68 0.98 Allowed 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 127.528 2.331 . . . . 0.0 109.085 166.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.661 ' HA ' HD12 ' A' ' 14' ' ' LEU 0.487 0.3 OUTLIER 74.91 135.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.429 -1.419 . . . . 0.0 111.121 -173.477 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.543 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 21.6 t70 44.88 45.19 8.4 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 130.922 3.689 . . . . 0.0 114.77 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.514 ' HG2' HD11 ' A' ' 14' ' ' LEU 0.399 10.4 pt-20 -74.33 62.26 0.95 Allowed 'General case' 0 CA--C 1.491 -1.308 0 C-N-CA 129.632 3.173 . . . . 0.0 114.436 179.43 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.39 14.0 p -79.0 -20.94 47.82 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.862 2.865 . . . . 0.0 113.18 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.523 ' CD2' HD21 ' A' ' 141' ' ' LEU . 5.9 t80 -64.21 -33.35 75.61 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.726 2.01 . . . . 0.0 111.151 166.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.5 HG23 HD13 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -57.62 -46.48 86.42 Favored 'Isoleucine or valine' 0 C--N 1.37 1.466 0 C-N-CA 128.846 2.858 . . . . 0.0 109.392 -175.674 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.654 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 45.9 m-85 -61.68 -45.39 94.19 Favored 'General case' 0 CA--C 1.495 -1.171 1 C-N-CA 134.184 4.994 . . . . 0.0 112.65 169.527 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -66.12 -44.62 83.76 Favored 'General case' 0 C--N 1.35 0.597 0 CA-C-N 122.001 2.182 . . . . 0.0 114.503 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.717 ' HG ' HD21 ' A' ' 111' ' ' LEU . 1.4 tm? -63.09 -50.46 70.45 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.36 1.864 . . . . 0.0 114.177 166.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.429 ' CZ ' HG13 ' A' ' 63' ' ' VAL 0.742 0.0 OUTLIER -76.7 -29.15 56.16 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 118.979 -2.326 . . . . 0.0 111.59 -175.829 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.543 ' CE1' HG12 ' A' ' 25' ' ' ILE . 63.7 m-70 -64.17 -28.17 69.57 Favored 'General case' 0 C--N 1.367 1.353 0 C-N-CA 125.489 1.515 . . . . 0.0 112.147 162.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -77.27 -26.66 52.67 Favored 'General case' 0 C--N 1.377 1.786 0 O-C-N 121.214 -0.929 . . . . 0.0 112.017 171.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.322 0.0 OUTLIER -88.13 -44.29 15.68 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 C-N-CA 126.353 1.861 . . . . 0.0 115.054 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.553 9.1 mmpt? -49.02 0.21 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 1 C-N-CA 137.194 6.197 . . . . 0.0 120.365 -178.129 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.62 -24.04 67.46 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 131.033 3.733 . . . . 0.0 107.859 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.413 ' NE2' ' HB2' ' A' ' 153' ' ' GLN . 0.1 OUTLIER -42.07 1.55 0.0 OUTLIER 'General case' 0 C--N 1.389 2.315 1 C-N-CA 139.394 7.078 . . . . 0.0 119.207 176.659 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.485 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 46.2 t -50.03 -49.22 22.21 Favored 'Isoleucine or valine' 0 CA--C 1.461 -2.463 1 C-N-CA 135.864 5.666 . . . . 0.0 107.382 170.486 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.49 ' H ' HD22 ' A' ' 75' ' ' LEU . 1.7 mm? -58.88 -29.26 66.88 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 117.468 2.395 . . . . 0.0 117.468 176.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -75.19 -50.84 14.96 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 127.523 2.329 . . . . 0.0 112.634 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.372 14.6 p -66.93 -29.55 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.043 0 C-N-CA 127.631 2.373 . . . . 0.0 111.545 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.485 ' HB3' ' O ' ' A' ' 74' ' ' VAL . 8.0 t-20 -75.11 -32.75 61.49 Favored 'General case' 0 C--N 1.365 1.255 1 C-N-CA 132.322 4.249 . . . . 0.0 112.826 169.135 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . 0.356 6.7 pt-20 -67.74 -29.81 69.13 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 122.407 2.367 . . . . 0.0 110.034 169.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -66.47 -47.66 72.37 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 163.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.82 HD21 ' HB3' ' A' ' 39' ' ' SER 0.381 15.9 tp . . . . . 0 C--N 1.373 1.595 0 C-N-CA 130.011 3.325 . . . . 0.0 119.762 176.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.899 0 N-CA-C 118.164 2.026 . . . . 0.0 118.164 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.2 ptt-85 -141.06 152.54 44.91 Favored 'General case' 0 N--CA 1.44 -0.974 0 O-C-N 121.067 -1.255 . . . . 0.0 109.024 177.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -109.24 125.84 52.68 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 126.37 1.868 . . . . 0.0 107.223 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -128.51 109.4 11.35 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.523 HD11 ' CZ ' ' A' ' 115' ' ' PHE . 9.7 pt -135.97 140.59 43.76 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 C-N-CA 125.235 1.414 . . . . 0.0 112.61 -174.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.419 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 2.7 m -111.57 121.85 46.24 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 119.871 -1.768 . . . . 0.0 108.73 173.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.708 ' HB2' HG22 ' A' ' 150' ' ' ILE . 42.1 t0 -139.19 171.77 13.8 Favored 'General case' 0 CA--C 1.504 -0.826 1 N-CA-C 100.093 -4.04 . . . . 0.0 100.093 177.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.75 -68.37 3.03 Favored Glycine 0 N--CA 1.475 1.288 0 O-C-N 118.033 -2.917 . . . . 0.0 113.378 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.612 HD21 HD11 ' A' ' 141' ' ' LEU . 0.1 OUTLIER 156.01 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.366 1.294 2 C-N-CA 134.324 5.05 . . . . 0.0 109.474 -152.609 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.717 HD21 ' HG ' ' A' ' 66' ' ' LEU 0.476 1.1 pt? -78.22 137.4 38.11 Favored 'General case' 0 CA--C 1.507 -0.706 1 C-N-CA 134.978 5.311 . . . . 0.0 119.813 -177.543 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.34 100.66 13.42 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.435 HD11 ' CD1' ' A' ' 66' ' ' LEU 0.314 0.0 OUTLIER -94.84 127.78 41.1 Favored 'General case' 0 C--N 1.38 1.907 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 176.191 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -125.16 130.43 7.34 Favored Glycine 0 C--N 1.352 1.464 0 N-CA-C 106.138 -2.785 . . . . 0.0 106.138 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.523 ' CZ ' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -131.95 137.17 47.83 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.469 2.634 . . . . 0.0 105.671 178.384 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.0 m -124.99 102.05 7.34 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.841 1.655 . . . . 0.0 106.808 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.08 116.35 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 121.328 1.876 . . . . 0.0 107.276 172.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 1.6 m 3.66 104.58 0.0 OUTLIER 'General case' 0 C--N 1.38 1.921 0 C-N-CA 130.937 3.695 . . . . 0.0 117.677 -160.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.522 ' H ' ' HB2' ' A' ' 130' ' ' GLN . 34.4 ttpt -34.31 -44.25 0.56 Allowed Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 118.474 2.768 . . . . 0.0 118.474 -178.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -98.13 18.7 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.288 0 C-N-CA 123.47 2.78 . . . . 0.0 114.305 172.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.461 0.6 OUTLIER -161.53 108.05 1.38 Allowed 'General case' 0 CA--C 1.562 1.417 0 N-CA-C 118.899 2.926 . . . . 0.0 118.899 -178.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -99.3 -45.05 6.0 Favored 'General case' 0 C--N 1.351 0.671 0 O-C-N 118.67 -2.519 . . . . 0.0 115.193 170.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.411 0.0 OUTLIER -40.2 -14.74 0.01 OUTLIER 'General case' 0 C--N 1.353 0.726 1 C-N-CA 136.278 5.831 . . . . 0.0 120.754 -172.347 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -110.46 -6.07 15.01 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.773 2.029 . . . . 0.0 113.073 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.552 ' HB2' HD13 ' A' ' 81' ' ' LEU 0.416 0.0 OUTLIER 64.65 -51.71 0.31 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 128.379 2.672 . . . . 0.0 117.567 176.341 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.283 2.5 p30 -64.03 -15.97 0.33 Allowed Pre-proline 0 CA--C 1.551 1.004 1 C-N-CA 132.08 4.152 . . . . 0.0 119.562 173.386 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.358 39.7 Cg_exo -37.78 -176.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.486 1 C-N-CA 128.771 6.314 . . . . 0.0 121.008 166.464 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.0 m -99.61 164.3 12.13 Favored 'General case' 0 CA--C 1.486 -1.518 0 N-CA-C 104.113 -2.551 . . . . 0.0 104.113 -173.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.3 mp -100.12 129.04 46.11 Favored 'General case' 0 C--N 1.348 0.505 0 N-CA-C 100.208 -3.997 . . . . 0.0 100.208 176.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.522 ' HB2' ' H ' ' A' ' 119' ' ' LYS . 0.6 OUTLIER -93.19 60.21 3.18 Favored 'General case' 0 C--N 1.364 1.198 0 C-N-CA 126.258 1.823 . . . . 0.0 107.635 -171.038 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.304 1.9 p 102.8 138.27 0.01 OUTLIER 'General case' 0 C--N 1.373 1.593 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 -171.113 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -114.87 133.69 55.76 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 100.796 -3.779 . . . . 0.0 100.796 163.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 7.7 ttp -109.29 120.36 42.27 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 127.263 2.225 . . . . 0.0 105.446 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.627 ' H ' HD21 ' A' ' 49' ' ' LEU . . . -127.71 116.16 19.83 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.0 mm -139.8 138.44 38.66 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 CA-C-N 119.341 0.973 . . . . 0.0 109.495 178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.621 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -127.68 169.03 19.74 Favored 'Isoleucine or valine' 0 C--N 1.349 0.583 0 C-N-CA 128.164 2.586 . . . . 0.0 108.022 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.512 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -100.33 123.64 44.81 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.13 2.972 . . . . 0.0 114.398 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.261 2.5 p 171.86 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 123.934 1.825 . . . . 0.0 115.424 175.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.0 -50.32 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 109.628 -3.442 . . . . 0.0 107.871 -155.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.485 ' HA ' ' O ' ' A' ' 57' ' ' GLU . 14.6 ptp180 175.74 73.81 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.564 0 CA-C-O 126.005 2.812 . . . . 0.0 104.081 -170.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.612 HD11 HD21 ' A' ' 110' ' ' ASN 0.285 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.599 0 N-CA-C 117.764 2.505 . . . . 0.0 117.764 -162.62 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.708 HG22 ' HB2' ' A' ' 108' ' ' ASP 0.506 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.391 0 CA-C-O 126.722 3.153 . . . . 0.0 116.488 . . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.46 ' O ' HG23 ' A' ' 150' ' ' ILE 0.334 5.6 ptpt -78.02 149.6 33.99 Favored 'General case' 0 N--CA 1.423 -1.802 2 C-N-CA 138.292 6.637 . . . . 0.0 113.584 177.24 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 20.2 p -96.33 97.73 9.72 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 118.314 -2.741 . . . . 0.0 107.809 169.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.413 ' HB2' ' NE2' ' A' ' 73' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.257 1.472 1 C-N-CA 135.319 5.448 . . . . 0.0 109.155 174.676 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.47 ' HA ' HG13 ' A' ' 7' ' ' VAL . 14.1 m120 . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 122.32 1.057 . . . . 0.0 113.414 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -81.86 -62.56 1.6 Allowed 'General case' 0 C--N 1.348 0.516 1 C-N-CA 133.714 4.806 . . . . 0.0 110.3 176.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -71.29 -9.23 57.79 Favored 'General case' 0 C--N 1.368 1.387 0 C-N-CA 125.585 1.554 . . . . 0.0 112.279 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.47 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.286 0.7 OUTLIER -88.41 -28.45 5.38 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 C-N-CA 126.877 2.071 . . . . 0.0 108.969 174.368 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -72.86 -38.96 66.87 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 125.7 1.6 . . . . 0.0 108.688 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 28.8 mt -61.68 -44.52 98.85 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 C-N-CA 125.051 1.34 . . . . 0.0 110.636 165.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.314 0.6 OUTLIER -58.85 -48.91 79.7 Favored 'General case' 0 C--N 1.367 1.336 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 173.301 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -57.74 -34.11 69.17 Favored 'General case' 0 C--N 1.374 1.636 0 N-CA-C 118.835 2.902 . . . . 0.0 118.835 166.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -77.08 -49.28 15.66 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 128.141 2.576 . . . . 0.0 111.917 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -58.18 -29.28 65.51 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 130.04 3.336 . . . . 0.0 109.375 170.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.717 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -76.14 -37.56 57.84 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 169.832 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -58.45 -44.19 89.1 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.767 1.227 . . . . 0.0 111.419 166.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -62.85 -45.14 93.98 Favored 'General case' 0 C--N 1.382 2.019 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 166.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -42.92 80.85 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 129.542 3.137 . . . . 0.0 112.207 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.448 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -66.01 -54.41 26.34 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 128.509 2.724 . . . . 0.0 113.114 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -74.67 -36.03 62.81 Favored 'General case' 0 C--N 1.367 1.361 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.5 m -72.78 -40.81 65.63 Favored 'General case' 0 C--N 1.365 1.256 0 C-N-CA 125.958 1.703 . . . . 0.0 111.946 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.621 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.545 52.0 mt-10 -77.77 -29.92 51.19 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 119.982 -1.699 . . . . 0.0 114.066 169.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -59.32 -36.95 76.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 118.284 -2.76 . . . . 0.0 112.665 168.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.251 7.4 ptm180 -71.22 -33.35 69.8 Favored 'General case' 0 C--N 1.376 1.756 0 C-N-CA 124.031 0.933 . . . . 0.0 112.368 168.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -61.91 -48.22 81.41 Favored 'General case' 0 C--N 1.362 1.134 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 170.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.466 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.1 mt -72.33 -46.42 57.02 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 O-C-N 121.333 -0.855 . . . . 0.0 110.975 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.567 0.0 OUTLIER -74.23 -23.5 59.17 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 119.761 -1.837 . . . . 0.0 114.29 177.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -72.83 -32.78 65.73 Favored 'General case' 0 C--N 1.388 2.24 0 O-C-N 120.213 -1.554 . . . . 0.0 110.515 168.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.52 -40.73 85.1 Favored 'General case' 0 C--N 1.389 2.307 0 O-C-N 118.509 -2.619 . . . . 0.0 112.407 168.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.486 ' HB ' ' CZ ' ' A' ' 41' ' ' PHE 0.395 0.1 OUTLIER -64.77 -44.63 96.43 Favored 'Isoleucine or valine' 0 C--N 1.369 1.422 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 176.461 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -67.97 -38.84 83.23 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -76.51 -35.91 58.06 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 125.325 1.45 . . . . 0.0 111.463 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.8 -33.74 60.15 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 176.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.3 t -73.77 -37.3 65.04 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 125.512 1.525 . . . . 0.0 109.852 175.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp -68.66 -44.65 73.65 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 168.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.25 -30.47 64.91 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.094 1.758 . . . . 0.0 113.543 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.03 -17.53 60.49 Favored 'General case' 0 C--N 1.383 2.022 0 CA-C-N 119.307 0.958 . . . . 0.0 113.197 169.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.37 18.31 28.9 Favored Glycine 0 C--N 1.374 2.693 0 O-C-N 121.179 -0.95 . . . . 0.0 114.775 174.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.488 HG23 HD23 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -111.48 171.59 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 t -59.06 177.84 0.15 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 129.398 3.079 . . . . 0.0 115.979 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.6 m -96.86 126.39 41.97 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 125.689 1.596 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.486 ' CZ ' ' HB ' ' A' ' 29' ' ' ILE 0.286 41.8 p90 -113.6 141.02 47.69 Favored 'General case' 0 C--N 1.357 0.921 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 174.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -116.14 164.9 13.79 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 123.42 1.581 . . . . 0.0 113.326 -172.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -121.18 133.96 55.2 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.361 1.864 . . . . 0.0 113.872 -174.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -139.44 162.04 36.02 Favored 'General case' 0 C--N 1.37 1.496 0 N-CA-C 105.026 -2.212 . . . . 0.0 105.026 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.287 9.8 m-85 -125.31 161.34 27.19 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 126.688 1.995 . . . . 0.0 113.589 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.1 m -132.66 89.83 2.69 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 103.334 -2.839 . . . . 0.0 103.334 159.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' A' ' 51' ' ' ASP . 11.1 mp0 -47.45 -10.25 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 131.658 3.983 . . . . 0.0 118.354 -175.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.47 -37.12 56.39 Favored 'General case' 0 N--CA 1.503 2.212 1 CA-C-N 128.417 5.099 . . . . 0.0 119.201 -176.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.678 HD12 ' H ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -69.6 -41.37 75.82 Favored 'General case' 0 C--O 1.242 0.7 1 C-N-CA 134.415 5.086 . . . . 0.0 110.82 173.798 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.678 ' H ' HD12 ' A' ' 49' ' ' LEU 0.282 4.2 tt -74.8 -28.99 60.95 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 127.343 2.257 . . . . 0.0 110.707 171.011 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.473 ' HA ' HG22 ' A' ' 54' ' ' ILE . 10.1 t70 -68.05 -31.95 71.96 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 130.323 3.449 . . . . 0.0 108.165 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -70.99 -40.79 71.66 Favored 'General case' 0 C--N 1.373 1.594 0 O-C-N 119.874 -1.766 . . . . 0.0 114.984 160.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.22 62.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.597 ' HA ' HD12 ' A' ' 14' ' ' LEU . 2.7 tt -72.89 -35.9 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 1 C-N-CA 132.064 4.146 . . . . 0.0 110.828 178.292 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.498 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.2 mt-30 -108.63 -30.14 8.37 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 119.155 3.02 . . . . 0.0 119.155 171.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -88.91 -5.24 58.13 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 119.701 -1.875 . . . . 0.0 114.067 -172.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' A' ' 60' ' ' GLU . 2.9 tt0 -137.73 -64.58 0.54 Allowed 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 -178.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.498 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.697 0.0 OUTLIER 119.55 -28.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.374 1.659 0 N-CA-C 121.768 3.988 . . . . 0.0 121.768 167.37 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.717 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 31.1 t70 -147.37 80.34 1.51 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 130.735 3.614 . . . . 0.0 105.992 -170.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.554 ' O ' HG12 ' A' ' 63' ' ' VAL 0.54 12.5 pt-20 -79.77 59.1 3.0 Favored 'General case' 0 C--N 1.38 1.922 0 O-C-N 118.883 -2.386 . . . . 0.0 112.301 177.216 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.369 36.0 p -79.56 -21.66 44.81 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 129.816 3.247 . . . . 0.0 113.955 177.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -67.45 -30.24 69.92 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 130.643 3.577 . . . . 0.0 111.132 167.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.693 HG23 HD21 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -64.9 -44.68 96.17 Favored 'Isoleucine or valine' 0 C--N 1.367 1.328 0 C-N-CA 126.078 1.751 . . . . 0.0 110.579 178.773 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.621 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 59.5 m-85 -58.88 -43.33 90.91 Favored 'General case' 0 C--O 1.204 -1.293 1 C-N-CA 133.727 4.811 . . . . 0.0 111.542 170.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -67.57 -45.6 75.11 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 121.786 2.084 . . . . 0.0 115.954 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.66 ' CD2' ' HA3' ' A' ' 109' ' ' GLY . 2.8 tm? -62.19 -49.21 76.72 Favored 'General case' 0 CA--C 1.57 1.738 0 O-C-N 119.198 -2.189 . . . . 0.0 112.315 169.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.645 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.859 0.0 OUTLIER -77.49 -16.28 58.82 Favored 'General case' 0 C--N 1.379 1.869 0 O-C-N 118.923 -2.361 . . . . 0.0 115.078 -178.657 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.466 ' CE1' HG12 ' A' ' 25' ' ' ILE 0.295 58.2 m-70 -75.65 -23.13 56.28 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.437 2.295 . . . . 0.0 109.896 163.331 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.44 71.6 mmtt -75.47 -40.19 57.67 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 114.767 -2.773 . . . . 0.0 114.28 153.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.523 HD13 ' OXT' ' A' ' 153' ' ' GLN . 16.1 mm -53.63 -25.87 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 C-N-CA 129.643 3.177 . . . . 0.0 115.126 175.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -52.91 -26.1 13.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 C-N-CA 131.056 3.742 . . . . 0.0 118.209 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -101.3 2.89 40.22 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 125.282 1.433 . . . . 0.0 107.551 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 151' ' ' LYS 0.279 94.3 m-70 -86.17 13.22 8.19 Favored 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.622 2.769 . . . . 0.0 112.177 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.497 ' HB ' HD22 ' A' ' 75' ' ' LEU . 78.6 t -39.16 -55.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.576 1 C-N-CA 133.334 4.654 . . . . 0.0 109.55 157.368 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.497 HD22 ' HB ' ' A' ' 74' ' ' VAL . 3.6 mm? -58.59 -28.52 65.66 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.546 2.338 . . . . 0.0 115.996 176.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -75.47 -44.78 42.27 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 125.319 1.448 . . . . 0.0 112.23 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.415 HG21 ' CE2' ' A' ' 41' ' ' PHE 0.341 0.3 OUTLIER -67.83 -32.11 55.1 Favored 'Isoleucine or valine' 0 C--N 1.371 1.54 0 CA-C-O 124.338 2.018 . . . . 0.0 112.684 175.56 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -74.98 -39.49 61.25 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 129.883 3.273 . . . . 0.0 114.319 173.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.41 -29.2 70.53 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-N 120.694 1.588 . . . . 0.0 112.191 166.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -70.74 -32.08 69.13 Favored 'General case' 0 CA--C 1.58 2.098 0 C-N-CA 126.046 1.739 . . . . 0.0 114.485 167.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.509 HD22 ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.566 0 C-N-CA 128.814 2.846 . . . . 0.0 112.239 169.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.093 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -128.87 159.56 35.41 Favored 'General case' 0 CA--C 1.501 -0.91 0 CA-C-O 123.931 1.824 . . . . 0.0 113.265 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.5 128.8 53.77 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.311 2.645 . . . . 0.0 104.647 174.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -129.78 131.86 46.36 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 103.526 -2.768 . . . . 0.0 103.526 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.511 HD12 HD12 ' A' ' 70' ' ' ILE . 2.8 mt -131.54 133.37 61.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.886 0 C-N-CA 126.487 1.915 . . . . 0.0 108.266 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.6 m -134.1 115.51 14.35 Favored 'General case' 0 C--N 1.353 0.743 0 O-C-N 120.72 -1.237 . . . . 0.0 110.615 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 176.14 -173.2 0.09 Allowed 'General case' 0 C--N 1.365 1.274 0 N-CA-C 100.217 -3.994 . . . . 0.0 100.217 173.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.66 ' HA3' ' CD2' ' A' ' 66' ' ' LEU . . . 72.6 9.23 73.77 Favored Glycine 1 CA--C 1.44 -4.597 0 O-C-N 118.285 -2.759 . . . . 0.0 117.29 175.375 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.542 ' O ' HG22 ' A' ' 136' ' ' ILE . 1.5 m-80 70.61 9.24 6.84 Favored 'General case' 0 C--N 1.377 1.781 0 C-N-CA 128.624 2.77 . . . . 0.0 110.876 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.693 HD21 HG23 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -120.56 130.33 54.16 Favored 'General case' 0 N--CA 1.44 -0.946 1 C-N-CA 134.45 5.1 . . . . 0.0 114.601 -164.587 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -112.51 100.15 8.52 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 101.065 -3.68 . . . . 0.0 101.065 174.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.296 1.3 pt? -107.51 138.59 43.45 Favored 'General case' 0 C--N 1.368 1.381 0 O-C-N 120.554 -1.341 . . . . 0.0 109.894 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.76 142.35 13.44 Favored Glycine 0 C--N 1.355 1.616 0 N-CA-C 107.452 -2.259 . . . . 0.0 107.452 172.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.45 132.36 44.23 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 104.636 -2.357 . . . . 0.0 104.636 176.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.4 m -109.97 108.94 19.36 Favored 'General case' 0 C--N 1.367 1.342 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.403 HG13 ' CB ' ' A' ' 127' ' ' PRO . 1.0 OUTLIER -75.03 105.31 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 C-N-CA 127.827 2.451 . . . . 0.0 111.663 -176.655 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 16.7 m 42.83 72.58 0.17 Allowed 'General case' 0 C--N 1.368 1.408 0 C-N-CA 129.831 3.252 . . . . 0.0 115.282 -170.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.363 37.9 ttpt -30.81 -62.04 0.25 Allowed Pre-proline 0 C--N 1.361 1.095 1 C-N-CA 132.275 4.23 . . . . 0.0 118.768 -171.924 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -71.84 66.97 3.17 Favored 'Trans proline' 0 CA--C 1.556 1.621 0 C-N-CA 125.087 3.858 . . . . 0.0 111.039 169.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.345 7.9 m120 -36.53 149.73 0.02 OUTLIER 'General case' 0 C--N 1.363 1.153 2 N-CA-C 125.615 5.413 . . . . 0.0 125.615 -170.012 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -162.65 -46.23 0.04 OUTLIER 'General case' 0 C--N 1.358 0.955 0 C-N-CA 130.91 3.684 . . . . 0.0 113.96 -174.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.353 0.0 OUTLIER 75.54 100.27 0.07 Allowed 'General case' 0 N--CA 1.424 -1.763 1 C-N-CA 133.185 4.594 . . . . 0.0 113.246 -178.833 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -105.62 16.68 25.01 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 117.86 2.541 . . . . 0.0 117.86 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.72 0.0 OUTLIER 19.86 55.11 0.01 OUTLIER 'General case' 0 C--N 1.366 1.289 0 N-CA-C 121.292 3.812 . . . . 0.0 121.292 174.17 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.509 ' HA ' HD22 ' A' ' 81' ' ' LEU . 44.9 m-20 170.59 46.42 0.0 OUTLIER Pre-proline 0 CA--C 1.568 1.667 1 C-N-CA 140.319 7.448 . . . . 0.0 105.785 -172.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.43 ' CD ' ' H ' ' A' ' 126' ' ' ASP . 13.7 Cg_exo -92.56 -179.25 1.03 Allowed 'Trans proline' 0 C--N 1.361 1.205 0 CA-C-N 127.349 3.66 . . . . 0.0 118.951 -158.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 12.1 p -124.62 150.08 46.39 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.675 -2.342 . . . . 0.0 104.675 174.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 mp -101.82 130.34 48.24 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 102.174 -3.269 . . . . 0.0 102.174 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -114.62 45.72 1.51 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 119.949 -1.72 . . . . 0.0 109.364 -170.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' CYS . . . . . 0.437 ' SG ' HD21 ' A' ' 49' ' ' LEU . 45.4 t 141.81 126.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.522 0 C-N-CA 128.201 2.6 . . . . 0.0 105.194 -170.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -115.36 111.47 20.9 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 102.583 -3.117 . . . . 0.0 102.583 165.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 4.5 ttt -99.43 121.22 40.83 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.03 3.332 . . . . 0.0 108.505 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . 0.486 ' HB1' HG21 ' A' ' 63' ' ' VAL . . . -128.69 116.44 19.55 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.56 1.544 . . . . 0.0 109.174 178.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.5 mm -136.03 128.29 45.59 Favored 'Isoleucine or valine' 0 C--N 1.365 1.252 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 176.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.542 HG22 ' O ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -103.88 171.39 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 C-N-CA 127.723 2.409 . . . . 0.0 108.61 -179.079 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.72 -178.78 5.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.148 1.779 . . . . 0.0 106.398 163.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.744 52.6 p -65.24 75.8 0.06 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 117.644 2.461 . . . . 0.0 117.644 175.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ARG . . . . . 0.535 ' CD ' ' H ' ' A' ' 141' ' ' LEU . 0.0 OUTLIER -71.83 -21.49 61.68 Favored 'General case' 0 C--N 1.377 1.772 0 CA-C-N 110.989 -2.823 . . . . 0.0 106.614 148.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 139' ' ' ARG 0.402 70.6 mtt85 165.8 -45.86 0.0 OUTLIER 'General case' 0 CA--C 1.473 -2.009 1 C-N-CA 144.85 9.26 . . . . 0.0 114.218 -179.217 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' LEU . . . . . 0.535 ' H ' ' CD ' ' A' ' 139' ' ' ARG 0.262 0.1 OUTLIER . . . . . 0 CA--C 1.55 0.946 0 C-N-CA 129.298 3.039 . . . . 0.0 117.513 -175.756 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.666 HD13 ' O ' ' A' ' 151' ' ' LYS 0.396 0.1 OUTLIER . . . . . 0 CA--C 1.568 1.646 1 N-CA-C 122.548 4.277 . . . . 0.0 122.548 . . . . . . . . . 4 3 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' LYS . . . . . 0.666 ' O ' HD13 ' A' ' 150' ' ' ILE . 0.0 OUTLIER -94.16 149.55 21.13 Favored 'General case' 0 CA--C 1.48 -1.744 2 C-N-CA 146.004 9.722 . . . . 0.0 97.652 167.87 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' THR . . . . . 0.584 ' O ' HG23 ' A' ' 152' ' ' THR 0.322 11.3 t -76.1 96.14 3.78 Favored 'General case' 0 CA--C 1.575 1.93 3 CA-C-O 130.563 4.982 . . . . 0.0 122.666 -162.49 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' GLN . . . . . 0.546 ' HA ' HD12 ' A' ' 150' ' ' ILE 0.481 0.0 OUTLIER . . . . . 0 N--CA 1.381 -3.913 2 C-N-CA 136.099 5.759 . . . . 0.0 117.524 166.591 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.7 mmm . . . . . 0 C--O 1.231 0.129 0 CA-C-O 123.04 1.4 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.7 m -168.83 165.83 11.61 Favored 'General case' 0 C--N 1.357 0.924 0 N-CA-C 101.343 -3.577 . . . . 0.0 101.343 -173.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 mm -80.89 54.51 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.365 1.263 0 C-N-CA 128.651 2.78 . . . . 0.0 112.468 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.455 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 2.3 t-20 -44.67 -15.85 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 1 C-N-CA 136.564 5.946 . . . . 0.0 117.743 -176.813 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -58.76 6.66 Favored 'General case' 0 N--CA 1.445 -0.715 1 C-N-CA 132.95 4.5 . . . . 0.0 112.274 169.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -71.84 -25.87 62.14 Favored 'General case' 0 C--N 1.37 1.469 0 C-N-CA 126.907 2.083 . . . . 0.0 113.065 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.455 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.9 OUTLIER -77.01 -39.52 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.947 0 C-N-CA 129.721 3.208 . . . . 0.0 112.551 176.698 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.431 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 27.3 t80 -65.36 -45.05 85.69 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 129.039 2.935 . . . . 0.0 109.611 175.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -58.3 -43.73 86.72 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 126.625 1.97 . . . . 0.0 110.99 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.651 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.257 9.2 ttp-105 -66.34 -47.32 73.84 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.431 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.8 mtm180 -61.17 -27.63 68.55 Favored 'General case' 0 C--N 1.377 1.762 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 167.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -77.12 -48.75 16.89 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 128.691 2.796 . . . . 0.0 110.139 173.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.606 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 27.6 mmtt -57.8 -28.44 64.02 Favored 'General case' 0 C--N 1.374 1.664 0 C-N-CA 127.529 2.331 . . . . 0.0 110.573 169.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 58' ' ' ILE . 0.3 OUTLIER -66.68 -49.07 67.31 Favored 'General case' 0 C--N 1.371 1.54 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.519 166.271 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.416 ' HB2' HD11 ' A' ' 54' ' ' ILE . 39.2 ttt85 -55.81 -34.68 65.55 Favored 'General case' 0 C--N 1.353 0.742 0 CA-C-N 121.15 1.795 . . . . 0.0 115.21 169.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.606 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.289 0.1 OUTLIER -73.7 -37.04 65.31 Favored 'General case' 0 C--N 1.386 2.17 0 O-C-N 120.065 -1.647 . . . . 0.0 113.812 170.088 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.13 -44.27 97.59 Favored 'General case' 0 C--N 1.381 1.972 0 C-N-CA 129.063 2.945 . . . . 0.0 111.041 172.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.508 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -61.17 -52.59 64.18 Favored 'General case' 0 C--N 1.371 1.508 1 C-N-CA 132.003 4.121 . . . . 0.0 110.315 175.598 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -74.56 -39.53 62.22 Favored 'General case' 0 C--N 1.373 1.608 0 N-CA-C 118.218 2.673 . . . . 0.0 118.218 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.4 t -73.16 -40.52 64.78 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.024 1.73 . . . . 0.0 112.18 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.307 4.1 mp0 -75.95 -28.92 58.12 Favored 'General case' 0 C--N 1.355 0.812 0 O-C-N 118.637 -2.539 . . . . 0.0 110.41 171.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.339 0.3 OUTLIER -65.18 -31.21 72.27 Favored 'General case' 0 C--N 1.384 2.077 0 O-C-N 119.824 -1.797 . . . . 0.0 113.688 166.956 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.394 0.0 OUTLIER -66.36 -35.49 80.49 Favored 'General case' 0 C--N 1.382 2.02 0 CA-C-N 119.033 0.833 . . . . 0.0 111.8 166.604 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.519 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 47.2 tt0 -62.55 -45.02 94.85 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 169.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.488 HG12 ' CE1' ' A' ' 68' ' ' HIS . 3.1 mt -69.77 -43.48 79.88 Favored 'Isoleucine or valine' 0 C--N 1.369 1.414 0 O-C-N 120.617 -1.302 . . . . 0.0 113.06 176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.32 0.3 OUTLIER -70.34 -26.49 63.77 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 119.379 0.991 . . . . 0.0 113.004 176.205 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -69.41 -39.78 77.72 Favored 'General case' 0 C--N 1.385 2.122 0 O-C-N 121.109 -0.994 . . . . 0.0 110.166 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.401 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.492 0.0 OUTLIER -67.07 -35.01 78.9 Favored 'General case' 0 C--N 1.403 2.911 0 CA-C-N 120.405 1.457 . . . . 0.0 113.21 168.575 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.402 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.7 mt -61.92 -44.73 99.29 Favored 'Isoleucine or valine' 0 C--N 1.37 1.467 0 CA-C-N 120.797 1.635 . . . . 0.0 114.702 174.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -59.96 -47.31 86.31 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 172.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -77.34 -37.45 52.41 Favored 'General case' 0 C--N 1.372 1.553 0 C-N-CA 125.165 1.386 . . . . 0.0 114.265 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.609 ' CB ' HG11 ' A' ' 74' ' ' VAL . . . -80.35 -34.01 36.87 Favored 'General case' 0 CA--C 1.482 -1.656 0 CA-C-O 121.638 0.732 . . . . 0.0 112.409 -178.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.6 t -71.35 -36.15 71.41 Favored 'General case' 0 C--N 1.365 1.245 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 174.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 42.2 mmtt -64.14 -42.42 96.8 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 167.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.38 -32.11 66.14 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 126.881 2.073 . . . . 0.0 113.936 176.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.32 -19.36 58.3 Favored 'General case' 0 C--N 1.375 1.692 0 C-N-CA 125.382 1.473 . . . . 0.0 111.94 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.03 17.7 31.5 Favored Glycine 0 C--N 1.371 2.509 0 N-CA-C 115.272 0.869 . . . . 0.0 115.272 171.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.561 HG23 HD13 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -123.76 147.18 28.24 Favored 'Isoleucine or valine' 0 C--N 1.358 0.974 0 CA-C-O 123.544 1.64 . . . . 0.0 108.998 -178.249 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.498 ' HB2' HD11 ' A' ' 81' ' ' LEU 0.277 10.0 t 5.8 -79.88 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.302 1 C-N-CA 132.715 4.406 . . . . 0.0 119.736 -173.777 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 71.0 m 121.71 124.27 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.689 2 N-CA-C 98.863 -4.495 . . . . 0.0 98.863 -169.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.454 ' CZ ' HG22 ' A' ' 77' ' ' VAL . 10.7 p90 -113.24 142.54 45.69 Favored 'General case' 0 C--N 1.352 0.704 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -100.7 126.63 47.24 Favored 'General case' 0 C--N 1.361 1.103 0 C-N-CA 125.758 1.623 . . . . 0.0 108.039 -175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 HD22 ' A' ' 129' ' ' LEU . 0.1 OUTLIER -95.78 128.29 42.53 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 124.599 1.16 . . . . 0.0 110.838 -173.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -139.34 143.97 38.03 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 101.994 -3.335 . . . . 0.0 101.994 177.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.533 ' CE1' HD13 ' A' ' 50' ' ' LEU . 2.4 p90 -131.09 154.39 48.33 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.61 118.79 28.51 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 127.26 2.224 . . . . 0.0 107.585 173.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.446 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.502 0.0 OUTLIER -68.39 -10.32 54.33 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 129.224 3.01 . . . . 0.0 116.936 -174.404 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.64 -41.29 27.3 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 128.09 2.556 . . . . 0.0 111.489 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 133' ' ' MET . 0.1 OUTLIER -59.42 -47.7 84.45 Favored 'General case' 0 C--N 1.375 1.675 0 CA-C-O 127.738 3.637 . . . . 0.0 109.102 170.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.533 HD13 ' CE1' ' A' ' 45' ' ' TYR 0.279 7.0 tt -74.11 -31.58 62.84 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-N 110.567 -3.015 . . . . 0.0 111.116 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -62.34 -34.33 76.44 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 125.821 1.648 . . . . 0.0 109.537 170.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -62.63 -47.86 81.91 Favored 'General case' 0 C--N 1.384 2.105 0 O-C-N 120.53 -1.356 . . . . 0.0 113.232 167.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.48 -27.26 65.99 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 117.885 2.55 . . . . 0.0 117.885 171.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.499 HD12 ' CD2' ' A' ' 50' ' ' LEU 0.302 0.1 OUTLIER -73.68 -42.93 54.87 Favored 'Isoleucine or valine' 0 C--N 1.347 0.496 0 C-N-CA 129.52 3.128 . . . . 0.0 110.884 178.975 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -103.2 -26.83 12.84 Favored 'General case' 0 C--N 1.38 1.912 0 N-CA-C 117.079 2.251 . . . . 0.0 117.079 176.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -87.44 -29.14 21.66 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 119.456 -2.028 . . . . 0.0 111.426 -174.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -124.97 44.05 2.88 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 128.392 2.677 . . . . 0.0 107.491 -172.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.651 HD11 ' HE ' ' A' ' 10' ' ' ARG 0.393 0.5 OUTLIER -56.19 134.32 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 C-N-CA 125.986 1.714 . . . . 0.0 112.419 -177.331 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.494 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 24.9 t70 57.54 21.21 6.85 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 130.822 3.649 . . . . 0.0 113.202 -173.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.463 0.7 OUTLIER -73.97 80.52 1.68 Allowed 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.863 2.865 . . . . 0.0 109.626 170.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.3 p -82.06 -26.59 33.56 Favored 'General case' 0 N--CA 1.437 -1.089 2 C-N-CA 141.404 7.882 . . . . 0.0 110.92 162.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.94 -33.32 71.75 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 128.008 2.523 . . . . 0.0 109.582 172.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.557 ' HA ' HD22 ' A' ' 111' ' ' LEU . 3.2 t -43.18 -57.44 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.993 1 C-N-CA 132.455 4.302 . . . . 0.0 111.572 165.195 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 47.8 m-85 -62.5 -36.74 83.5 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 131.452 3.901 . . . . 0.0 113.468 172.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -72.98 -45.29 58.82 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 126.259 1.823 . . . . 0.0 111.607 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.576 HD13 HD13 ' A' ' 70' ' ' ILE . 3.2 tm? -63.19 -38.44 91.17 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.559 1.544 . . . . 0.0 113.268 169.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.682 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.974 0.0 OUTLIER -78.27 -17.48 56.6 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 117.742 2.497 . . . . 0.0 117.742 170.739 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.519 ' CE1' ' HB3' ' A' ' 24' ' ' GLN . 25.4 m-70 -84.51 -19.13 33.74 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 129.014 2.926 . . . . 0.0 109.682 171.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.61 ' O ' HG21 ' A' ' 152' ' ' THR . 48.6 mmtm -93.74 -27.34 16.55 Favored 'General case' 0 C--N 1.364 1.223 0 C-N-CA 126.434 1.894 . . . . 0.0 107.895 168.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.682 ' HB ' ' HA ' ' A' ' 67' ' ' PHE 0.356 0.9 OUTLIER -74.98 -12.13 14.73 Favored 'Isoleucine or valine' 0 CA--C 1.469 -2.145 0 C-N-CA 129.787 3.235 . . . . 0.0 112.684 178.327 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HB2' ' CD ' ' A' ' 28' ' ' GLU 0.313 19.2 ptmt -49.49 -35.32 19.45 Favored 'General case' 0 N--CA 1.428 -1.542 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 -169.26 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.276 26.6 m-20 -78.77 -15.05 58.9 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 127.448 2.299 . . . . 0.0 108.565 -176.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.716 ' CD2' ' HA ' ' A' ' 152' ' ' THR 0.373 0.0 OUTLIER -66.8 -7.08 18.82 Favored 'General case' 0 C--N 1.379 1.859 0 C-N-CA 129.173 2.989 . . . . 0.0 109.379 167.62 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.609 HG11 ' CB ' ' A' ' 32' ' ' ALA . 13.0 p -43.57 -38.66 1.18 Allowed 'Isoleucine or valine' 1 C--N 1.428 4.016 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 151.328 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 2.7 tm? -61.74 -36.49 81.13 Favored 'General case' 0 C--N 1.384 2.066 0 C-N-CA 129.941 3.296 . . . . 0.0 115.419 172.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.547 ' HA ' ' HG3' ' A' ' 79' ' ' GLU . 71.1 mm-40 -75.26 -38.82 60.32 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 120.211 -1.555 . . . . 0.0 111.442 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.454 HG22 ' CZ ' ' A' ' 41' ' ' PHE 0.415 0.1 OUTLIER -71.47 -29.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 CA-C-O 124.472 2.082 . . . . 0.0 112.203 171.89 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.502 ' HA ' HD22 ' A' ' 78' ' ' ASN . 0.9 OUTLIER -70.01 -46.79 64.37 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 127.706 2.402 . . . . 0.0 116.782 168.407 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.333 0.8 OUTLIER -66.94 -29.51 69.4 Favored 'General case' 0 C--N 1.371 1.517 0 C-N-CA 127.332 2.253 . . . . 0.0 110.288 176.785 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -60.31 -45.66 92.61 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.02 2.528 . . . . 0.0 112.07 163.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.561 HD13 HG23 ' A' ' 38' ' ' VAL . 3.3 tt -70.84 -35.17 72.33 Favored 'General case' 0 N--CA 1.502 2.152 0 CA-C-N 122.524 2.42 . . . . 0.0 115.546 168.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.6 m -66.09 3.87 0.78 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 129.325 3.05 . . . . 0.0 118.754 -170.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.842 ' CE ' HG23 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -73.54 166.59 42.65 Favored Pre-proline 0 C--N 1.359 1.012 0 C-N-CA 127.524 2.33 . . . . 0.0 113.497 -179.145 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.99 -178.68 0.43 Allowed 'Trans proline' 0 CA--C 1.56 1.799 1 C-N-CA 125.818 4.346 . . . . 0.0 113.407 174.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -59.92 142.2 98.05 Favored 'Trans proline' 0 C--N 1.362 1.246 1 CA-C-N 128.724 4.152 . . . . 0.0 113.477 -177.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.578 ' HE ' ' HA ' ' A' ' 125' ' ' LYS 0.276 22.0 mmt180 -58.48 -59.99 11.73 Favored Pre-proline 0 C--N 1.376 1.742 0 C-N-CA 126.416 1.887 . . . . 0.0 111.042 -176.31 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.4 139.06 37.17 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 N-CA-C 118.19 2.342 . . . . 0.0 118.19 156.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.11 -11.46 8.45 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 111.402 -2.636 . . . . 0.0 110.244 169.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -165.61 176.09 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.755 1 C-N-CA 137.439 6.296 . . . . 0.0 102.995 -168.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -114.23 -14.69 12.27 Favored 'General case' 0 C--N 1.346 0.433 0 C-N-CA 124.89 1.276 . . . . 0.0 109.334 173.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.74 -49.28 18.67 Favored 'General case' 0 C--N 1.363 1.164 0 N-CA-C 116.593 2.071 . . . . 0.0 116.593 -177.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -119.22 -8.77 10.07 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 126.477 1.911 . . . . 0.0 110.897 -175.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.728 1.1 p90 38.7 -73.92 0.0 OUTLIER 'General case' 0 C--N 1.349 0.558 2 C-N-CA 132.936 4.495 . . . . 0.0 122.279 -174.301 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.456 ' HB ' ' HB ' ' A' ' 97' ' ' VAL . 1.8 pt -85.45 86.95 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 CA-C-O 127.747 3.641 . . . . 0.0 113.72 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -96.41 -27.69 14.8 Favored 'General case' 0 C--N 1.312 -1.04 2 CA-C-N 105.41 -5.359 . . . . 0.0 110.174 -177.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.55 -7.84 85.66 Favored Glycine 0 C--N 1.362 1.978 0 C-N-CA 125.786 1.66 . . . . 0.0 112.228 170.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.842 HG23 ' CE ' ' A' ' 83' ' ' MET . 77.9 t -109.68 117.99 55.82 Favored 'Isoleucine or valine' 0 C--N 1.359 1.002 0 CA-C-O 123.862 1.792 . . . . 0.0 107.331 176.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -86.21 36.64 0.69 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 130.269 3.428 . . . . 0.0 113.846 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 8.5 t80 73.19 78.75 0.14 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 130.849 3.659 . . . . 0.0 113.451 -178.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -112.49 156.17 42.68 Favored Pre-proline 0 C--N 1.362 1.112 0 O-C-N 120.214 -1.554 . . . . 0.0 110.492 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -79.48 163.08 24.64 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 124.577 3.518 . . . . 0.0 112.703 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.85 8.21 67.15 Favored Glycine 0 C--N 1.355 1.627 0 C-N-CA 126.056 1.788 . . . . 0.0 117.345 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 ptt85 -140.99 160.04 40.93 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 123.194 1.473 . . . . 0.0 110.163 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.4 131.68 54.84 Favored 'General case' 0 C--N 1.352 0.697 0 C-N-CA 127.375 2.27 . . . . 0.0 104.992 177.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -128.53 116.43 19.65 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 -174.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.687 HD12 ' CE1' ' A' ' 73' ' ' HIS . 28.9 mm -122.33 130.15 74.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.009 1.324 . . . . 0.0 109.5 -172.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.612 HG22 ' H ' ' A' ' 149' ' ' VAL 0.436 10.5 t -139.5 150.84 45.61 Favored 'General case' 0 C--N 1.378 1.813 0 O-C-N 117.088 -3.508 . . . . 0.0 112.396 178.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.618 ' HB2' ' HB2' ' A' ' 151' ' ' LYS . 0.3 OUTLIER 173.76 164.75 0.18 Allowed 'General case' 0 C--N 1.362 1.129 0 N-CA-C 103.459 -2.793 . . . . 0.0 103.459 162.905 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' A' ' 110' ' ' ASN . . . 43.39 45.97 6.75 Favored Glycine 0 CA--C 1.454 -3.751 0 C-N-CA 129.547 3.451 . . . . 0.0 120.097 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 3.4 m-80 88.43 -9.66 0.49 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 130.057 3.343 . . . . 0.0 114.292 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.557 HD22 ' HA ' ' A' ' 63' ' ' VAL . 18.2 tp -102.19 133.52 46.91 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 126.87 2.068 . . . . 0.0 114.819 -177.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -111.78 100.07 8.64 Favored 'General case' 0 C--N 1.366 1.307 0 N-CA-C 101.256 -3.609 . . . . 0.0 101.256 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.486 HD21 HG21 ' A' ' 70' ' ' ILE 0.252 0.0 OUTLIER -115.36 119.85 37.64 Favored 'General case' 0 CA--C 1.566 1.579 0 O-C-N 119.83 -1.793 . . . . 0.0 106.578 -178.765 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -124.49 154.7 18.03 Favored Glycine 0 C--N 1.355 1.602 0 O-C-N 117.299 -3.376 . . . . 0.0 109.226 -174.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -132.44 134.11 44.68 Favored 'General case' 0 C--N 1.368 1.377 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 35.8 m -124.73 135.83 53.34 Favored 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 103.165 -2.902 . . . . 0.0 103.165 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 53.3 t -54.82 159.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 C-N-CA 129.167 2.987 . . . . 0.0 112.158 173.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 130' ' ' GLN 0.335 91.5 m -64.01 98.65 0.22 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 116.918 -1.913 . . . . 0.0 113.183 167.718 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -64.16 -36.67 20.9 Favored Pre-proline 0 N--CA 1.45 -0.442 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -175.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -85.14 72.71 4.47 Favored 'Trans proline' 0 CA--C 1.56 1.814 0 CA-C-N 126.005 3.18 . . . . 0.0 112.598 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.426 8.7 p30 -163.43 -136.6 0.03 OUTLIER 'General case' 0 C--N 1.377 1.796 0 N-CA-C 116.697 2.11 . . . . 0.0 116.697 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -95.84 -27.2 15.32 Favored 'General case' 0 C--N 1.376 1.732 0 C-N-CA 131.003 3.721 . . . . 0.0 113.919 174.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.452 0.0 OUTLIER 56.72 71.54 0.56 Allowed 'General case' 0 N--CA 1.423 -1.796 1 C-N-CA 134.745 5.218 . . . . 0.0 115.191 -176.243 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -63.52 52.5 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 130.116 3.367 . . . . 0.0 116.098 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.578 ' HA ' ' HE ' ' A' ' 86' ' ' ARG 0.467 4.7 mptt 82.03 -68.38 0.08 Allowed 'General case' 0 N--CA 1.438 -1.045 1 C-N-CA 131.719 4.007 . . . . 0.0 110.498 176.977 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -172.3 82.6 0.45 Allowed Pre-proline 0 C--N 1.353 0.739 0 CA-C-O 115.779 -2.057 . . . . 0.0 111.314 168.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.403 ' HA ' ' HB3' ' A' ' 41' ' ' PHE . 1.6 Cg_endo -123.85 16.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.369 1.612 0 CA-C-N 127.056 3.556 . . . . 0.0 118.848 177.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.319 4.2 p -147.71 159.2 44.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 111.959 -2.382 . . . . 0.0 109.063 162.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.428 HD22 HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -116.3 140.72 49.03 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 103.405 -2.813 . . . . 0.0 103.405 168.094 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.443 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 49.9 tp60 -130.41 72.02 1.48 Allowed 'General case' 0 C--N 1.361 1.082 0 N-CA-C 102.836 -3.024 . . . . 0.0 102.836 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . 0.537 ' SG ' HD22 ' A' ' 49' ' ' LEU . 49.4 t 128.99 115.73 0.0 OUTLIER 'General case' 0 C--N 1.362 1.13 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 -174.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.553 ' O ' HD21 ' A' ' 49' ' ' LEU . 8.1 mmm180 -115.81 108.98 17.01 Favored 'General case' 0 N--CA 1.446 -0.672 1 N-CA-C 99.707 -4.183 . . . . 0.0 99.707 164.038 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.709 ' HA ' HD11 ' A' ' 49' ' ' LEU . 3.4 ttp -92.69 108.91 20.35 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 128.284 2.634 . . . . 0.0 109.15 -175.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.482 ' O ' HD13 ' A' ' 135' ' ' ILE . . . -116.9 113.98 23.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 104.847 -2.279 . . . . 0.0 104.847 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.482 HD13 ' O ' ' A' ' 134' ' ' ALA . 47.3 mm -145.16 132.61 15.93 Favored 'Isoleucine or valine' 0 C--N 1.37 1.493 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.482 HD12 HD13 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -117.08 -175.83 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.682 0 CA-C-O 125.326 2.488 . . . . 0.0 108.882 -174.379 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.317 0.4 OUTLIER -134.42 132.41 39.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 108.955 -3.748 . . . . 0.0 106.713 160.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.672 ' HB2' ' HB2' ' A' ' 141' ' ' LEU 0.286 25.2 m -145.01 -119.85 0.08 Allowed 'General case' 0 N--CA 1.485 1.288 0 O-C-N 118.615 -2.553 . . . . 0.0 116.942 -174.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.741 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.1 OUTLIER -108.57 -75.66 0.63 Allowed 'General case' 0 C--N 1.36 1.038 0 C-N-CA 130.879 3.672 . . . . 0.0 110.71 -167.852 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.741 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 14.5 ptp180 -79.66 -9.33 59.62 Favored 'General case' 0 CA--C 1.498 -1.028 0 C-N-CA 130.704 3.601 . . . . 0.0 111.685 170.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.672 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER -77.9 127.43 81.92 Favored Pre-proline 0 N--CA 1.415 -2.179 0 CA-C-N 112.744 -2.026 . . . . 0.0 116.445 -159.067 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -62.14 -0.93 1.97 Allowed 'Trans proline' 0 C--N 1.322 -0.866 1 C-N-CA 126.784 4.989 . . . . 0.0 121.607 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.607 ' H ' HD23 ' A' ' 141' ' ' LEU . . . 33.34 110.73 0.0 OUTLIER Glycine 0 N--CA 1.477 1.372 2 C-N-CA 132.97 5.081 . . . . 0.0 125.458 170.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -104.45 152.63 22.1 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.411 1.885 . . . . 0.0 114.155 176.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -144.89 121.78 11.3 Favored 'General case' 0 C--N 1.367 1.341 0 C-N-CA 124.769 1.227 . . . . 0.0 109.32 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 14.5 m -91.02 -8.74 48.23 Favored 'General case' 0 C--N 1.364 1.226 0 N-CA-C 119.823 3.268 . . . . 0.0 119.823 -170.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.373 50.3 mmtm 110.5 -10.79 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 129.795 3.238 . . . . 0.0 110.353 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.45 . . 92.22 134.4 0.03 OUTLIER 'General case' 0 C--N 1.355 0.807 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 166.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.612 ' H ' HG22 ' A' ' 107' ' ' THR . 34.8 m -136.93 -161.33 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.369 1.424 0 C-N-CA 130.351 3.46 . . . . 0.0 110.224 -172.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.817 HD13 ' O ' ' A' ' 151' ' ' LYS 0.409 0.0 OUTLIER -131.92 144.7 36.46 Favored 'Isoleucine or valine' 0 C--N 1.373 1.607 0 N-CA-C 120.82 3.637 . . . . 0.0 120.82 -179.251 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.817 ' O ' HD13 ' A' ' 150' ' ' ILE 0.515 4.5 tptp -71.13 160.79 32.23 Favored 'General case' 0 CA--C 1.461 -2.463 1 C-N-CA 153.109 12.563 . . . . 0.0 103.913 -175.689 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.716 ' HA ' ' CD2' ' A' ' 73' ' ' HIS 0.398 9.8 t -71.44 97.23 1.6 Allowed 'General case' 0 CA--C 1.571 1.766 1 CA-C-O 130.546 4.974 . . . . 0.0 121.11 -173.12 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.686 2 CA-C-N 100.419 -7.628 . . . . 0.0 112.741 162.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 123.778 1.751 . . . . 0.0 113.963 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.3 p -97.73 138.06 35.67 Favored 'General case' 0 C--N 1.351 0.67 0 C-N-CA 130.112 3.365 . . . . 0.0 111.599 -175.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 mm -76.47 48.81 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.371 1.52 0 O-C-N 118.955 -2.34 . . . . 0.0 114.793 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.451 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 5.5 t-20 -62.12 0.42 0.41 Allowed 'General case' 0 N--CA 1.476 0.834 1 C-N-CA 137.044 6.138 . . . . 0.0 115.314 -179.238 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.61 -62.74 1.27 Allowed 'General case' 0 C--N 1.352 0.698 1 C-N-CA 133.866 4.867 . . . . 0.0 112.395 172.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -72.92 -20.04 61.15 Favored 'General case' 0 C--N 1.374 1.668 0 O-C-N 120.146 -1.596 . . . . 0.0 112.847 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.451 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.3 m -76.27 -34.81 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 C-N-CA 129.789 3.235 . . . . 0.0 111.215 173.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -66.99 -41.56 86.55 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 127.769 2.428 . . . . 0.0 108.513 173.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.7 mt -59.29 -43.91 91.0 Favored 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 124.538 1.135 . . . . 0.0 112.862 167.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.268 77.0 mtp85 -63.45 -49.11 74.94 Favored 'General case' 0 C--N 1.373 1.606 0 O-C-N 120.236 -1.54 . . . . 0.0 115.033 170.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -60.29 -27.31 67.19 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 171.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -76.99 -50.67 12.64 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 127.856 2.462 . . . . 0.0 110.678 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -57.3 -29.08 63.6 Favored 'General case' 0 C--N 1.377 1.78 0 C-N-CA 127.623 2.369 . . . . 0.0 110.856 171.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.485 HD22 ' C ' ' A' ' 58' ' ' ILE . 12.0 tp -68.5 -49.09 62.28 Favored 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 125.637 1.575 . . . . 0.0 112.295 168.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -55.34 -39.21 69.73 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.353 -1.467 . . . . 0.0 112.213 172.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 64.8 mmt-85 -62.4 -48.71 78.52 Favored 'General case' 0 C--N 1.372 1.575 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 163.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.498 ' HB3' HG22 ' A' ' 61' ' ' THR . 48.1 m80 -56.35 -46.49 79.95 Favored 'General case' 0 C--N 1.389 2.296 0 C-N-CA 129.644 3.178 . . . . 0.0 111.577 174.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.524 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -57.43 -53.05 62.57 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 131.472 3.909 . . . . 0.0 111.011 173.565 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -74.33 -43.98 54.37 Favored 'General case' 0 C--N 1.377 1.79 0 N-CA-C 118.015 2.598 . . . . 0.0 118.015 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 t -66.98 -38.03 85.31 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.515 2.326 . . . . 0.0 112.231 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.583 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.34 41.7 mt-10 -76.91 -29.17 55.58 Favored 'General case' 0 C--N 1.363 1.18 0 C-N-CA 125.369 1.468 . . . . 0.0 112.145 170.525 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.13 -33.97 72.88 Favored 'General case' 0 C--N 1.383 2.059 0 CA-C-N 121.415 1.916 . . . . 0.0 113.037 167.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -66.38 -44.69 82.42 Favored 'General case' 0 C--N 1.377 1.797 0 CA-C-O 117.487 -1.244 . . . . 0.0 111.894 164.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.5 ' HG2' ' CE1' ' A' ' 68' ' ' HIS . 17.5 tt0 -57.69 -40.25 79.04 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.805 2.15 . . . . 0.0 116.805 170.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.649 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -69.24 -45.64 78.96 Favored 'Isoleucine or valine' 0 C--N 1.366 1.317 0 C-N-CA 125.683 1.593 . . . . 0.0 111.106 178.043 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.758 0.0 OUTLIER -73.54 -23.26 59.96 Favored 'General case' 0 C--N 1.369 1.452 0 O-C-N 121.296 -0.878 . . . . 0.0 112.929 177.129 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.53 -41.15 66.17 Favored 'General case' 0 C--N 1.382 1.984 0 C-N-CA 125.945 1.698 . . . . 0.0 111.592 168.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.587 0.8 OUTLIER -63.65 -29.32 70.57 Favored 'General case' 0 C--N 1.403 2.908 0 O-C-N 119.507 -1.996 . . . . 0.0 113.426 169.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.497 ' HA ' HG21 ' A' ' 74' ' ' VAL . 7.2 mt -68.78 -50.5 54.37 Favored 'Isoleucine or valine' 0 C--N 1.369 1.416 0 N-CA-C 114.469 1.285 . . . . 0.0 114.469 166.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.1 mtm180 -59.96 -34.57 73.46 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 121.152 1.796 . . . . 0.0 114.743 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.21 -45.23 27.23 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 125.228 1.411 . . . . 0.0 111.417 177.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.446 ' HB3' HG11 ' A' ' 74' ' ' VAL . . . -75.53 -31.91 60.27 Favored 'General case' 0 C--N 1.359 1.019 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -178.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.4 t -78.71 -34.18 46.21 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 127.138 2.175 . . . . 0.0 108.847 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -72.42 -43.25 64.13 Favored 'General case' 0 C--N 1.384 2.076 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 165.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.42 73.14 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 126.399 1.879 . . . . 0.0 114.601 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.28 -16.86 60.92 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 119.082 0.855 . . . . 0.0 112.495 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.83 17.75 40.08 Favored Glycine 0 C--N 1.376 2.764 0 C-N-CA 124.413 1.006 . . . . 0.0 114.12 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.649 HG21 ' HB3' ' A' ' 78' ' ' ASN . 2.3 t -102.16 179.76 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.434 -1.239 0 C-N-CA 128.113 2.565 . . . . 0.0 111.106 -172.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.592 ' H ' HG12 ' A' ' 38' ' ' VAL 0.397 3.1 t -75.09 -144.93 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.436 2.294 . . . . 0.0 113.834 178.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.2 m -150.6 157.66 43.24 Favored 'General case' 0 CA--C 1.499 -1.014 0 O-C-N 119.122 -2.236 . . . . 0.0 107.588 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.491 ' CE1' HD13 ' A' ' 29' ' ' ILE . 19.9 p90 -128.63 154.64 46.04 Favored 'General case' 0 C--N 1.349 0.554 0 C-N-CA 124.559 1.144 . . . . 0.0 109.727 -177.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -100.92 114.62 28.66 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 101.847 -3.39 . . . . 0.0 101.847 174.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.345 0.0 OUTLIER -115.4 128.75 56.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.256 -1.528 . . . . 0.0 107.572 -170.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -130.83 146.04 52.16 Favored 'General case' 0 C--N 1.362 1.133 0 O-C-N 121.076 -1.015 . . . . 0.0 109.295 -178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.498 ' CE1' HD13 ' A' ' 50' ' ' LEU . 21.0 p90 -99.97 159.3 15.19 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 124.983 1.313 . . . . 0.0 110.588 177.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.1 p -108.72 118.83 37.81 Favored 'General case' 0 C--N 1.356 0.887 0 C-N-CA 124.46 1.104 . . . . 0.0 108.562 176.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.468 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.439 0.0 OUTLIER -74.8 -10.8 59.85 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 119.458 3.133 . . . . 0.0 119.458 -170.435 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.74 -48.6 24.84 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 122.161 2.255 . . . . 0.0 113.049 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.585 HD13 ' HA ' ' A' ' 133' ' ' MET . 3.7 pp -67.14 -31.46 71.91 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 128.726 2.811 . . . . 0.0 112.93 173.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.53 ' CD2' HD12 ' A' ' 54' ' ' ILE 0.306 6.2 tt -75.56 -42.72 51.52 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 128.593 2.757 . . . . 0.0 109.848 173.408 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.54 -30.32 67.01 Favored 'General case' 0 C--N 1.378 1.831 0 C-N-CA 128.471 2.708 . . . . 0.0 111.246 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -77.96 -41.32 36.53 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 119.87 -1.769 . . . . 0.0 114.508 164.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.44 -34.36 78.11 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.53 HD12 ' CD2' ' A' ' 50' ' ' LEU . 4.0 tt -66.73 -39.02 82.73 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.68 0 C-N-CA 130.421 3.489 . . . . 0.0 112.793 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -104.56 -23.79 13.08 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 174.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.77 -22.71 39.9 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 119.023 -2.298 . . . . 0.0 112.894 178.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.544 ' HB3' ' HB3' ' A' ' 60' ' ' GLU . 3.1 mm-40 -127.91 14.37 6.86 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 125.664 1.586 . . . . 0.0 114.898 -177.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.485 ' C ' HD22 ' A' ' 14' ' ' LEU 0.478 0.3 OUTLIER 20.64 -28.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.985 2 C-N-CA 136.678 5.991 . . . . 0.0 126.621 177.628 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -155.3 64.68 0.62 Allowed 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.564 ' O ' HG12 ' A' ' 63' ' ' VAL 0.452 6.7 pt-20 -87.44 61.93 6.87 Favored 'General case' 0 CA--C 1.469 -2.143 0 CA-C-O 125.53 2.586 . . . . 0.0 110.71 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.498 HG22 ' HB3' ' A' ' 17' ' ' HIS 0.319 59.6 p -78.96 -11.79 60.02 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 129.154 2.982 . . . . 0.0 112.492 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -65.68 -34.29 77.86 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 130.464 3.506 . . . . 0.0 111.185 164.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.564 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -66.89 -38.04 80.63 Favored 'Isoleucine or valine' 0 C--N 1.359 1.005 0 C-N-CA 126.363 1.865 . . . . 0.0 110.582 -174.505 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 37.6 m-85 -66.52 -46.66 75.45 Favored 'General case' 0 CA--C 1.47 -2.125 1 C-N-CA 133.224 4.61 . . . . 0.0 111.396 169.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -60.46 -38.28 83.7 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.815 1.643 . . . . 0.0 114.875 176.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 1.015 HD12 HD12 ' A' ' 111' ' ' LEU . 2.1 tm? -75.24 -47.98 25.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.97 3.308 . . . . 0.0 114.414 173.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.429 ' HA ' ' HB ' ' A' ' 70' ' ' ILE 0.623 0.0 OUTLIER -77.31 -17.68 58.11 Favored 'General case' 0 C--N 1.377 1.763 0 O-C-N 118.304 -2.748 . . . . 0.0 112.001 174.278 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.649 ' CE1' HG12 ' A' ' 25' ' ' ILE . 41.3 m-70 -67.91 -38.11 82.52 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 127.288 2.235 . . . . 0.0 109.516 162.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.493 8.9 mttt -77.22 -16.7 58.94 Favored 'General case' 0 C--N 1.396 2.63 0 CA-C-N 122.135 2.243 . . . . 0.0 112.968 168.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.771 HD12 ' HE2' ' A' ' 151' ' ' LYS 0.331 0.8 OUTLIER -71.75 -40.03 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 C-N-CA 126.044 1.738 . . . . 0.0 113.47 172.914 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.517 ' O ' HG23 ' A' ' 74' ' ' VAL 0.866 11.5 mptt -67.44 -2.4 6.29 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 131.013 3.725 . . . . 0.0 118.683 176.06 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -87.43 -16.52 34.63 Favored 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 167.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.768 ' CD2' ' HG3' ' A' ' 151' ' ' LYS 0.288 3.0 m-70 -90.65 10.25 26.49 Favored 'General case' 0 C--N 1.379 1.873 0 C-N-CA 129.768 3.227 . . . . 0.0 111.103 174.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 71' ' ' LYS 0.29 24.4 t -41.14 -40.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.414 3.396 0 C-N-CA 130.334 3.454 . . . . 0.0 111.096 160.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.64 -37.95 74.19 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.633 3.173 . . . . 0.0 115.565 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -75.58 -38.24 59.27 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 128.47 2.708 . . . . 0.0 109.904 172.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.385 1.9 m -69.99 -30.42 44.03 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 CA-C-O 124.188 1.946 . . . . 0.0 113.856 173.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.649 ' HB3' HG21 ' A' ' 38' ' ' VAL . 3.7 m120 -73.81 -34.11 64.47 Favored 'General case' 0 C--N 1.345 0.382 1 C-N-CA 132.45 4.3 . . . . 0.0 111.865 172.397 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -67.41 -30.46 70.23 Favored 'General case' 0 C--N 1.367 1.327 0 C-N-CA 125.957 1.703 . . . . 0.0 111.067 165.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.566 13.4 p90 -75.11 -29.92 60.71 Favored 'General case' 0 C--N 1.379 1.864 0 N-CA-C 116.264 1.95 . . . . 0.0 116.264 162.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.442 ' O ' HD12 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -67.32 -38.15 84.47 Favored 'General case' 0 C--N 1.368 1.4 0 C-N-CA 128.05 2.54 . . . . 0.0 114.531 174.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.9 p -93.33 3.03 56.29 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 117.406 2.373 . . . . 0.0 117.406 -171.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.7 ptm -84.3 166.01 35.35 Favored Pre-proline 0 C--N 1.365 1.242 0 CA-C-O 117.168 -1.396 . . . . 0.0 110.427 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -57.2 161.04 11.84 Favored 'Trans proline' 0 CA--C 1.553 1.438 1 C-N-CA 125.723 4.282 . . . . 0.0 114.645 178.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.518 ' HA ' ' CD ' ' A' ' 125' ' ' LYS . 5.6 Cg_endo -50.44 143.62 26.86 Favored 'Trans proline' 0 C--N 1.364 1.375 1 C-N-CA 126.357 4.704 . . . . 0.0 119.89 -160.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -109.34 61.12 0.29 Allowed Pre-proline 0 N--CA 1.491 1.623 0 N-CA-C 119.033 2.975 . . . . 0.0 119.033 175.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 93' ' ' PHE . 23.8 Cg_exo -90.6 161.56 4.31 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 124.879 3.719 . . . . 0.0 113.565 -177.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.53 -17.43 8.38 Favored 'General case' 0 C--N 1.364 1.239 1 C-N-CA 132.21 4.204 . . . . 0.0 117.813 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.426 HD12 ' HB2' ' A' ' 92' ' ' ASP . 0.0 OUTLIER -66.15 -175.35 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.351 0.655 0 C-N-CA 129.441 3.097 . . . . 0.0 115.611 177.041 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -132.55 -10.25 3.19 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.518 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -94.8 -39.03 10.48 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 116.482 2.03 . . . . 0.0 116.482 -177.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.426 ' HB2' HD12 ' A' ' 89' ' ' ILE . 27.8 m-20 -123.62 12.8 9.3 Favored 'General case' 0 N--CA 1.44 -0.93 0 C-N-CA 128.614 2.765 . . . . 0.0 111.711 -173.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.436 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 0.0 OUTLIER -70.37 -139.84 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 120.205 3.409 . . . . 0.0 120.205 -175.788 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 1.9 pt -79.68 87.01 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.269 0 CA-C-O 128.107 3.813 . . . . 0.0 111.643 175.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -115.96 -26.1 7.45 Favored 'General case' 0 N--CA 1.433 -1.297 2 CA-C-N 104.699 -5.682 . . . . 0.0 109.692 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -103.32 14.8 54.65 Favored Glycine 0 C--N 1.361 1.947 0 C-N-CA 125.06 1.314 . . . . 0.0 111.488 176.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . 0.294 10.2 p -72.96 90.57 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.136 0 CA-C-O 125.357 2.503 . . . . 0.0 115.756 178.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -107.71 9.9 29.03 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 128.259 2.624 . . . . 0.0 111.81 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -132.03 -179.75 5.6 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 128.166 2.586 . . . . 0.0 105.009 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -89.44 163.06 34.9 Favored Pre-proline 0 C--N 1.36 1.058 0 O-C-N 119.986 -1.696 . . . . 0.0 112.676 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -69.06 156.12 66.16 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 124.363 3.375 . . . . 0.0 115.677 -177.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.4 ' HA3' HG22 ' A' ' 117' ' ' VAL . . . -54.94 27.45 0.01 OUTLIER Glycine 0 C--N 1.357 1.743 2 N-CA-C 124.371 4.508 . . . . 0.0 124.371 -174.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -129.97 138.53 50.89 Favored 'General case' 0 N--CA 1.431 -1.423 1 N-CA-C 98.2 -4.741 . . . . 0.0 98.2 167.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.41 144.61 49.96 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -129.46 130.29 45.7 Favored 'General case' 0 C--N 1.361 1.108 0 N-CA-C 105.596 -2.001 . . . . 0.0 105.596 -178.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.807 HG23 HD12 ' A' ' 150' ' ' ILE . 1.0 OUTLIER -126.01 137.11 58.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 175.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.668 HG22 HG11 ' A' ' 149' ' ' VAL . 1.0 OUTLIER -136.49 107.35 6.64 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 172.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.482 ' HB2' ' HG2' ' A' ' 153' ' ' GLN . 0.4 OUTLIER -162.98 -117.76 0.01 OUTLIER 'General case' 0 CA--C 1.448 -2.97 0 N-CA-C 103.131 -2.914 . . . . 0.0 103.131 -178.429 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.569 ' H ' ' HG3' ' A' ' 153' ' ' GLN . . . -52.04 75.4 0.01 OUTLIER Glycine 0 C--N 1.384 3.231 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -160.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.623 ' O ' HG22 ' A' ' 136' ' ' ILE . 1.1 m-80 63.13 7.35 2.72 Favored 'General case' 0 C--N 1.369 1.437 1 C-N-CA 132.358 4.263 . . . . 0.0 113.192 179.063 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 1.015 HD12 HD12 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -117.32 133.12 56.35 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 129.987 3.315 . . . . 0.0 112.683 -160.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -111.4 98.54 7.55 Favored 'General case' 0 C--N 1.363 1.163 1 N-CA-C 98.979 -4.452 . . . . 0.0 98.979 174.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.638 HD23 HD13 ' A' ' 111' ' ' LEU 0.287 0.8 OUTLIER -115.91 121.11 41.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.453 1.501 . . . . 0.0 107.205 -167.623 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.25 132.1 7.22 Favored Glycine 0 C--N 1.364 2.117 0 O-C-N 119.938 -1.726 . . . . 0.0 109.605 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 152.85 50.56 Favored 'General case' 0 C--N 1.372 1.548 0 CA-C-N 120.848 2.324 . . . . 0.0 107.744 174.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 m -130.1 142.17 50.63 Favored 'General case' 0 C--N 1.371 1.506 0 C-N-CA 125.797 1.639 . . . . 0.0 106.709 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.4 HG22 ' HA3' ' A' ' 102' ' ' GLY . 12.5 m -77.47 179.18 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.999 0 C-N-CA 125.566 1.546 . . . . 0.0 110.289 169.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.526 ' HA ' ' HG3' ' A' ' 130' ' ' GLN 0.267 0.5 OUTLIER -56.66 92.56 0.01 OUTLIER 'General case' 0 C--N 1.359 1.014 0 CA-C-O 124.194 1.949 . . . . 0.0 115.698 168.029 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.354 9.1 pttp -71.6 -40.21 8.32 Favored Pre-proline 0 C--N 1.345 0.383 1 C-N-CA 133.09 4.556 . . . . 0.0 114.028 -178.711 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -75.74 60.3 5.92 Favored 'Trans proline' 0 CA--C 1.568 2.176 0 C-N-CA 124.29 3.327 . . . . 0.0 108.205 160.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.561 0.6 OUTLIER 2.3 -3.24 0.0 OUTLIER 'General case' 0 C--N 1.354 0.764 2 N-CA-C 129.217 6.747 . . . . 0.0 129.217 -168.178 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 56.38 -16.21 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.984 1 N-CA-C 123.224 4.528 . . . . 0.0 123.224 167.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.371 10.0 mptt 72.19 18.66 4.7 Favored 'General case' 0 N--CA 1.421 -1.877 1 C-N-CA 134.821 5.248 . . . . 0.0 114.03 177.58 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -145.71 177.78 8.64 Favored 'General case' 0 C--N 1.346 0.415 0 C-N-CA 128.373 2.669 . . . . 0.0 107.36 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.518 ' CD ' ' HA ' ' A' ' 85' ' ' PRO . 0.0 OUTLIER -63.71 -89.9 0.01 OUTLIER 'General case' 0 C--N 1.354 0.771 1 C-N-CA 132.14 4.176 . . . . 0.0 118.838 -170.466 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -109.8 -4.4 0.11 Allowed Pre-proline 0 N--CA 1.446 -0.636 1 CA-C-O 111.538 -4.077 . . . . 0.0 115.874 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.258 31.1 Cg_exo -69.0 23.61 0.15 Allowed 'Trans proline' 0 C--N 1.371 1.719 2 CA-C-N 133.963 6.022 . . . . 0.0 124.665 -166.898 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.292 19.3 m -145.41 149.55 34.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 C-N-CA 124.514 1.125 . . . . 0.0 108.916 158.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.25 130.42 55.94 Favored 'General case' 0 C--N 1.36 1.026 1 N-CA-C 98.903 -4.48 . . . . 0.0 98.903 159.675 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.526 ' HG3' ' HA ' ' A' ' 118' ' ' CYS . 61.0 mm-40 -125.08 71.99 1.22 Allowed 'General case' 0 CA--C 1.492 -1.286 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -164.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.262 64.0 m 98.15 106.57 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 125.059 1.475 . . . . 0.0 110.405 178.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -115.32 140.78 48.82 Favored 'General case' 0 C--N 1.359 1.002 0 CA-C-N 113.983 -1.462 . . . . 0.0 110.423 171.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.585 ' HA ' HD13 ' A' ' 49' ' ' LEU . 10.1 ttt -107.38 123.51 48.47 Favored 'General case' 0 N--CA 1.436 -1.144 1 C-N-CA 133.815 4.846 . . . . 0.0 110.002 178.566 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.66 114.76 17.06 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 169.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.7 mm -136.7 135.16 48.82 Favored 'Isoleucine or valine' 0 C--N 1.361 1.106 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.623 HG22 ' O ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -112.35 176.46 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.662 0 CA-C-O 124.423 2.058 . . . . 0.0 107.759 -177.389 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -72.19 103.87 3.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 130.242 3.417 . . . . 0.0 106.024 161.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.42 87.3 p -74.73 77.46 2.06 Favored 'General case' 0 C--N 1.357 0.892 0 N-CA-C 116.155 1.909 . . . . 0.0 116.155 -171.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -79.97 -57.67 3.53 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.31 167.796 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 139' ' ' ARG 0.293 32.7 mtt180 109.56 66.16 0.0 OUTLIER 'General case' 0 C--N 1.365 1.272 1 C-N-CA 143.299 8.64 . . . . 0.0 102.788 -173.741 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.469 HD21 HG21 ' A' ' 136' ' ' ILE . 0.2 OUTLIER -84.35 154.39 62.86 Favored Pre-proline 0 C--N 1.355 0.836 1 N-CA-C 126.158 5.614 . . . . 0.0 126.158 -145.13 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 141' ' ' LEU . 50.0 Cg_exo -75.93 -58.65 0.04 OUTLIER 'Trans proline' 0 C--N 1.372 1.813 1 C-N-CA 125.704 4.269 . . . . 0.0 118.358 -177.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -161.6 178.69 37.39 Favored Glycine 0 N--CA 1.436 -1.315 0 C-N-CA 129.204 3.288 . . . . 0.0 110.886 -169.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 8.6 pttp -84.31 174.57 10.03 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 131.096 3.758 . . . . 0.0 120.595 -171.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -170.52 161.34 7.74 Favored 'General case' 0 C--N 1.372 1.545 0 C-N-CA 127.613 2.365 . . . . 0.0 107.755 173.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . 0.415 85.6 p 78.72 148.55 0.1 Allowed 'General case' 0 C--N 1.367 1.333 0 N-CA-C 118.78 2.882 . . . . 0.0 118.78 178.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -175.28 132.9 0.3 Allowed 'General case' 0 C--N 1.357 0.911 0 C-N-CA 129.091 2.956 . . . . 0.0 103.466 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 170.36 -42.33 0.0 OUTLIER 'General case' 0 C--N 1.357 0.905 0 CA-C-O 124.01 1.862 . . . . 0.0 109.617 -172.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.845 HG22 ' HB ' ' A' ' 150' ' ' ILE 0.256 0.2 OUTLIER -71.7 -74.06 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.654 1 C-N-CA 134.72 5.208 . . . . 0.0 111.946 179.138 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 1.05 HD13 ' HB3' ' A' ' 151' ' ' LYS 0.442 0.3 OUTLIER -129.43 158.67 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.077 1 C-N-CA 147.432 10.293 . . . . 0.0 111.156 -160.742 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 1.05 ' HB3' HD13 ' A' ' 150' ' ' ILE 0.564 0.0 OUTLIER -71.48 147.18 48.06 Favored 'General case' 0 CA--C 1.502 -0.899 1 C-N-CA 140.219 7.408 . . . . 0.0 105.498 -177.464 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.627 ' O ' HG23 ' A' ' 152' ' ' THR 0.473 12.4 t -78.31 93.03 4.59 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 128.318 3.913 . . . . 0.0 117.882 -163.198 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.704 HE21 HD13 ' A' ' 70' ' ' ILE 0.251 2.0 pt20 . . . . . 0 N--CA 1.418 -2.026 0 N-CA-C 102.122 -3.288 . . . . 0.0 102.122 177.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 116.264 1.95 . . . . 0.0 116.264 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -123.42 -164.74 1.24 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 127.323 2.249 . . . . 0.0 108.028 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 mm -78.6 72.97 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.174 0 CA-C-O 126.629 3.109 . . . . 0.0 112.455 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.45 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 0.9 OUTLIER -108.19 12.46 26.62 Favored 'General case' 0 N--CA 1.442 -0.851 2 C-N-CA 132.959 4.503 . . . . 0.0 107.193 174.082 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.68 -61.17 2.23 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 130.151 3.381 . . . . 0.0 114.764 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -75.6 -19.58 59.15 Favored 'General case' 0 C--N 1.376 1.734 0 CA-C-O 122.192 0.996 . . . . 0.0 112.227 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.45 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -74.32 -37.25 44.92 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 C-N-CA 129.912 3.285 . . . . 0.0 111.578 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.61 -44.26 82.57 Favored 'General case' 0 C--N 1.373 1.615 0 C-N-CA 128.731 2.812 . . . . 0.0 108.576 173.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.7 mt -56.43 -43.52 77.91 Favored 'Isoleucine or valine' 0 C--N 1.368 1.381 0 C-N-CA 125.1 1.36 . . . . 0.0 112.847 167.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HB3' HD13 ' A' ' 58' ' ' ILE 0.27 0.9 OUTLIER -62.73 -50.86 69.41 Favored 'General case' 0 CA--C 1.564 1.507 0 C-N-CA 126.39 1.876 . . . . 0.0 115.123 173.184 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.547 ' CD ' HE22 ' A' ' 55' ' ' GLN . 32.6 mtp180 -59.29 -27.63 66.02 Favored 'General case' 0 C--N 1.372 1.546 0 N-CA-C 118.382 2.734 . . . . 0.0 118.382 163.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -77.08 -47.76 19.64 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 128.676 2.79 . . . . 0.0 110.563 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.54 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 9.5 mmpt? -58.77 -29.63 66.94 Favored 'General case' 0 C--N 1.373 1.589 0 C-N-CA 127.161 2.184 . . . . 0.0 109.571 169.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.683 HD13 HG13 ' A' ' 54' ' ' ILE . 0.4 OUTLIER -67.07 -44.49 79.96 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 163.145 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 -60.87 -32.6 72.03 Favored 'General case' 0 C--N 1.358 0.952 0 CA-C-N 122.726 2.512 . . . . 0.0 113.837 171.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.54 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.29 0.5 OUTLIER -72.07 -38.46 69.44 Favored 'General case' 0 C--N 1.385 2.111 0 O-C-N 120.498 -1.376 . . . . 0.0 112.289 171.728 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -65.23 -46.14 81.8 Favored 'General case' 0 C--N 1.386 2.154 0 C-N-CA 128.316 2.646 . . . . 0.0 111.06 172.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.607 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -63.2 -51.1 67.67 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 129.964 3.306 . . . . 0.0 112.201 -177.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -74.31 -42.96 58.64 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 126.983 2.113 . . . . 0.0 115.905 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.7 m -64.93 -42.88 94.28 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 124.428 2.061 . . . . 0.0 112.068 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.563 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.279 41.2 mt-10 -76.41 -29.79 57.2 Favored 'General case' 0 N--CA 1.439 -1.023 0 O-C-N 120.135 -1.603 . . . . 0.0 112.495 172.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -59.55 -31.39 69.38 Favored 'General case' 0 C--N 1.378 1.805 0 CA-C-N 122.348 2.34 . . . . 0.0 112.471 166.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -63.0 -46.26 88.5 Favored 'General case' 0 C--N 1.385 2.116 0 C-N-CA 124.585 1.154 . . . . 0.0 111.126 163.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.415 ' HB3' ' CE1' ' A' ' 68' ' ' HIS . 43.8 tt0 -56.08 -43.24 77.8 Favored 'General case' 0 C--N 1.371 1.53 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 169.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 21' ' ' GLU . 1.7 mt -68.57 -45.79 81.12 Favored 'Isoleucine or valine' 0 C--N 1.357 0.93 0 C-N-CA 125.519 1.528 . . . . 0.0 113.888 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.726 0.1 OUTLIER -73.45 -22.93 60.06 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 174.46 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -67.73 -47.19 70.03 Favored 'General case' 0 C--N 1.377 1.78 0 CA-C-O 116.989 -1.482 . . . . 0.0 112.457 168.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG2' ' CD ' ' A' ' 71' ' ' LYS 0.774 0.2 OUTLIER -69.77 -30.54 68.14 Favored 'General case' 0 C--N 1.406 3.028 0 CA-C-N 124.259 3.209 . . . . 0.0 113.92 171.739 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 6.3 mt -65.47 -37.15 79.35 Favored 'Isoleucine or valine' 0 C--N 1.372 1.578 0 CA-C-N 121.85 2.114 . . . . 0.0 115.274 170.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.6 ttt-85 -70.59 -38.08 73.98 Favored 'General case' 0 C--N 1.364 1.201 0 O-C-N 118.745 -2.472 . . . . 0.0 114.241 175.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -76.3 -41.2 49.43 Favored 'General case' 0 CA--C 1.485 -1.53 0 C-N-CA 126.493 1.917 . . . . 0.0 111.732 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.0 -32.09 45.01 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.369 11.3 p -78.51 -27.98 46.2 Favored 'General case' 0 C--N 1.359 0.987 0 O-C-N 120.823 -1.173 . . . . 0.0 110.125 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -71.36 -52.1 20.55 Favored 'General case' 0 C--N 1.371 1.522 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 158.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.03 -30.16 71.25 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.88 -11.97 60.01 Favored 'General case' 0 C--N 1.375 1.685 0 O-C-N 120.901 -1.124 . . . . 0.0 111.591 170.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.85 17.18 62.0 Favored Glycine 0 C--N 1.383 3.189 0 O-C-N 121.016 -1.052 . . . . 0.0 115.056 171.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.67 HG22 ' H ' ' A' ' 39' ' ' SER . 7.9 p -96.58 178.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.36 0 CA-C-O 125.035 2.35 . . . . 0.0 112.754 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.67 ' H ' HG22 ' A' ' 38' ' ' VAL . 41.9 t -23.88 -69.11 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.386 1 C-N-CA 136.859 6.064 . . . . 0.0 117.522 178.188 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.256 90.9 p 102.57 142.39 0.01 OUTLIER 'General case' 0 C--N 1.357 0.903 0 C-N-CA 131.007 3.723 . . . . 0.0 104.238 -166.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . 0.266 50.4 p90 -141.53 161.9 36.8 Favored 'General case' 0 C--N 1.345 0.399 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -111.12 149.58 30.65 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.847 1.659 . . . . 0.0 112.863 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.353 1.7 pp -126.84 158.38 36.82 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 119.44 -2.038 . . . . 0.0 112.861 167.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -140.41 150.25 43.63 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.347 3.059 . . . . 0.0 103.196 172.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.467 ' CD1' HD13 ' A' ' 50' ' ' LEU . 4.0 p90 -125.2 134.08 52.5 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 105.72 -1.956 . . . . 0.0 105.72 170.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 65.3 m -105.18 128.16 53.27 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 120.99 -1.069 . . . . 0.0 108.516 176.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.433 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.597 0.0 OUTLIER -73.68 -10.54 59.8 Favored 'General case' 0 C--N 1.363 1.187 1 N-CA-C 122.541 4.274 . . . . 0.0 122.541 -169.921 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.27 -45.3 60.7 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 122.966 2.621 . . . . 0.0 111.762 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.0 tp -53.78 -48.61 69.62 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 131.138 3.775 . . . . 0.0 111.977 166.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.607 HD11 ' CE1' ' A' ' 18' ' ' PHE . 8.3 tt -74.83 -28.65 60.78 Favored 'General case' 0 CA--C 1.487 -1.444 0 C-N-CA 125.837 1.655 . . . . 0.0 112.708 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.515 ' HA ' HG22 ' A' ' 54' ' ' ILE . 16.3 t70 -66.72 -30.64 70.92 Favored 'General case' 0 C--N 1.365 1.239 0 CA-C-N 120.177 1.353 . . . . 0.0 108.729 169.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -73.82 -28.69 61.75 Favored 'General case' 0 C--N 1.383 2.062 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 167.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.82 -50.18 25.74 Favored 'General case' 0 C--O 1.207 -1.179 0 O-C-N 119.979 -1.7 . . . . 0.0 113.373 165.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.683 HG13 HD13 ' A' ' 14' ' ' LEU 0.282 0.3 OUTLIER -50.95 -43.35 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.024 1 C-N-CA 132.939 4.496 . . . . 0.0 113.884 -177.297 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.547 HE22 ' CD ' ' A' ' 11' ' ' ARG 0.26 5.3 mm100 -84.18 -31.67 25.01 Favored 'General case' 0 C--N 1.381 1.941 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 171.828 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -99.53 39.1 1.34 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 124.201 1.953 . . . . 0.0 109.456 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . 0.295 2.7 pt-20 -160.71 -52.07 0.05 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 127.946 2.498 . . . . 0.0 110.395 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.605 ' HA ' HD12 ' A' ' 14' ' ' LEU 0.64 0.1 OUTLIER 19.83 108.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.524 3.241 0 C-N-CA 131.518 3.927 . . . . 0.0 113.249 -169.171 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.422 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 69.1 m-20 53.23 44.3 30.37 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 131.59 3.956 . . . . 0.0 112.089 -173.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.663 ' O ' HG12 ' A' ' 63' ' ' VAL 0.652 3.8 tp10 -78.29 79.64 4.72 Favored 'General case' 0 C--N 1.372 1.577 0 CA-C-O 127.22 3.391 . . . . 0.0 110.666 175.024 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.313 62.2 p -78.23 -15.87 58.38 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 127.616 2.366 . . . . 0.0 112.569 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -67.59 -33.29 74.7 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 129.859 3.264 . . . . 0.0 109.33 165.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.663 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -58.57 -44.33 89.15 Favored 'Isoleucine or valine' 0 C--N 1.372 1.551 0 C-N-CA 128.978 2.911 . . . . 0.0 110.332 179.892 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.563 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 41.1 m-85 -64.98 -45.46 85.54 Favored 'General case' 0 CA--C 1.488 -1.434 1 C-N-CA 133.332 4.653 . . . . 0.0 111.229 170.612 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.39 -34.17 77.15 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-N 122.408 2.367 . . . . 0.0 114.187 178.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.961 HD12 HD23 ' A' ' 111' ' ' LEU . 2.9 tm? -76.35 -45.39 32.3 Favored 'General case' 0 N--CA 1.439 -1.004 0 C-N-CA 127.43 2.292 . . . . 0.0 116.522 168.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.47 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.87 0.1 OUTLIER -75.49 -16.36 60.31 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 122.334 2.333 . . . . 0.0 113.514 176.526 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.415 ' CE1' ' HB3' ' A' ' 24' ' ' GLN 0.253 24.9 m-70 -76.81 -36.34 56.99 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 128.669 2.788 . . . . 0.0 110.296 161.637 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -73.88 -18.17 60.95 Favored 'General case' 0 C--N 1.389 2.293 0 CA-C-N 122.335 2.334 . . . . 0.0 114.569 169.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.482 HG21 HH22 ' A' ' 132' ' ' ARG . 26.4 mm -57.8 -70.26 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.379 1.876 0 C-N-CA 129.067 2.947 . . . . 0.0 113.013 173.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.435 ' CD ' ' HG2' ' A' ' 28' ' ' GLU 0.846 0.0 OUTLIER -52.13 -2.1 0.02 OUTLIER 'General case' 0 CA--C 1.48 -1.726 1 C-N-CA 133.015 4.526 . . . . 0.0 120.996 179.163 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -84.26 -18.77 35.34 Favored 'General case' 0 CA--C 1.564 1.483 0 O-C-N 119.944 -1.722 . . . . 0.0 107.409 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -99.16 21.23 12.13 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 130.118 3.367 . . . . 0.0 113.993 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.3 t -38.62 -43.73 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.397 2.652 0 C-N-CA 129.588 3.155 . . . . 0.0 112.99 163.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.93 -39.69 74.97 Favored 'General case' 0 C--O 1.214 -0.8 1 C-N-CA 132.546 4.339 . . . . 0.0 114.096 177.099 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.488 ' HA ' ' HG3' ' A' ' 79' ' ' GLU 0.254 30.8 mt-10 -75.93 -32.11 59.42 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 126.315 1.846 . . . . 0.0 112.594 169.02 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.417 ' HB ' ' CE2' ' A' ' 80' ' ' PHE 0.422 1.8 m -66.98 -31.12 52.02 Favored 'Isoleucine or valine' 0 CA--C 1.59 2.505 0 CA-C-O 127.805 3.669 . . . . 0.0 112.379 168.15 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.521 ' HB2' HG21 ' A' ' 38' ' ' VAL 0.451 0.0 OUTLIER -71.93 -29.56 64.42 Favored 'General case' 0 C--N 1.351 0.67 1 C-N-CA 132.593 4.357 . . . . 0.0 112.067 168.718 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 76' ' ' GLU 0.298 17.7 mt-10 -69.94 -30.11 67.41 Favored 'General case' 0 C--N 1.373 1.602 0 C-N-CA 129.248 3.019 . . . . 0.0 109.574 166.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.417 ' CE2' ' HB ' ' A' ' 77' ' ' VAL . 2.8 m-85 -61.58 -47.26 86.31 Favored 'General case' 0 C--N 1.386 2.157 0 CA-C-N 119.295 0.952 . . . . 0.0 110.553 165.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 125' ' ' LYS 0.53 1.1 tm? -65.55 -10.85 38.62 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 119.612 3.19 . . . . 0.0 119.612 173.122 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 86.2 p -65.39 2.31 0.91 Allowed 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 121.414 3.857 . . . . 0.0 121.414 -169.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.719 ' HE2' HG21 ' A' ' 94' ' ' ILE . 6.6 ttp -124.18 154.0 68.42 Favored Pre-proline 0 N--CA 1.444 -0.731 0 C-N-CA 126.129 1.771 . . . . 0.0 107.259 177.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -62.27 162.31 23.94 Favored 'Trans proline' 0 C--N 1.376 1.975 1 C-N-CA 125.462 4.108 . . . . 0.0 114.14 176.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -57.71 144.98 91.91 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 124.782 3.655 . . . . 0.0 121.571 -161.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.452 ' N ' ' HD2' ' A' ' 87' ' ' PRO 0.42 2.4 mtp85 -79.2 -10.77 0.16 Allowed Pre-proline 0 CA--C 1.557 1.235 0 N-CA-C 121.427 3.862 . . . . 0.0 121.427 179.727 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 86' ' ' ARG . 25.5 Cg_exo -12.69 160.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.37 1.675 2 C-N-CA 129.458 6.772 . . . . 0.0 125.889 158.312 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -62.01 -22.14 65.46 Favored 'General case' 0 C--N 1.359 0.997 1 C-N-CA 132.589 4.356 . . . . 0.0 119.024 -173.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -98.47 111.04 27.18 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.171 0 CA-C-O 125.849 2.738 . . . . 0.0 109.278 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.44 -11.15 59.72 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 130.736 3.614 . . . . 0.0 111.603 177.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -97.03 -27.66 14.51 Favored 'General case' 0 CA--C 1.507 -0.683 0 C-N-CA 126.779 2.032 . . . . 0.0 115.021 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.23 -11.1 10.13 Favored 'General case' 0 CA--C 1.502 -0.869 0 C-N-CA 124.736 1.214 . . . . 0.0 112.256 -176.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -146.01 179.89 7.17 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 122.84 1.305 . . . . 0.0 110.502 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.719 HG21 ' HE2' ' A' ' 83' ' ' MET 0.263 4.3 mt -84.9 131.12 34.84 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.117 1 C-N-CA 135.788 5.635 . . . . 0.0 107.189 175.496 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.1 t0 -147.24 -47.77 0.18 Allowed 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -167.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.33 8.79 58.97 Favored Glycine 0 C--N 1.349 1.282 0 N-CA-C 108.564 -1.814 . . . . 0.0 108.564 175.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.519 ' CG1' HG12 ' A' ' 94' ' ' ILE 0.361 4.5 p -114.96 136.4 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.621 0 C-N-CA 127.048 2.139 . . . . 0.0 112.097 176.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . 0.25 28.2 tt0 73.76 21.2 2.8 Favored 'General case' 0 N--CA 1.436 -1.139 1 C-N-CA 135.758 5.623 . . . . 0.0 108.419 -172.282 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -48.52 50.73 0.0 OUTLIER 'General case' 0 C--N 1.371 1.533 0 N-CA-C 121.763 3.986 . . . . 0.0 121.763 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 68.5 mtt85 -112.48 154.11 44.69 Favored Pre-proline 0 C--N 1.351 0.659 0 C-N-CA 127.83 2.452 . . . . 0.0 108.877 177.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -81.4 144.25 14.27 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 123.71 2.94 . . . . 0.0 111.719 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.55 45.53 0.65 Allowed Glycine 0 C--N 1.364 2.108 0 C-N-CA 126.952 2.215 . . . . 0.0 118.112 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -124.83 139.41 53.87 Favored 'General case' 0 CA--C 1.506 -0.726 0 N-CA-C 103.822 -2.659 . . . . 0.0 103.822 176.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -134.51 139.1 45.2 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -174.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -128.26 130.82 48.49 Favored 'General case' 0 C--N 1.362 1.124 0 N-CA-C 102.564 -3.124 . . . . 0.0 102.564 178.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.407 ' CG2' ' HB3' ' A' ' 151' ' ' LYS . 0.0 OUTLIER -134.33 138.71 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 124.477 1.111 . . . . 0.0 108.115 -171.761 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.2 m -137.6 114.4 10.55 Favored 'General case' 0 C--N 1.38 1.928 0 N-CA-C 116.412 2.005 . . . . 0.0 116.412 -167.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.803 ' HB3' ' H ' ' A' ' 151' ' ' LYS 0.329 0.9 OUTLIER -132.32 -157.99 0.86 Allowed 'General case' 0 C--N 1.386 2.16 0 CA-C-N 122.576 2.444 . . . . 0.0 108.064 177.853 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -47.2 67.06 0.0 OUTLIER Glycine 0 CA--C 1.453 -3.84 1 C-N-CA 134.494 5.807 . . . . 0.0 118.771 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 93.41 5.01 0.05 OUTLIER 'General case' 0 CA--C 1.492 -1.277 1 C-N-CA 134.568 5.147 . . . . 0.0 111.825 169.288 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.961 HD23 HD12 ' A' ' 66' ' ' LEU . 16.0 tp -106.96 133.99 50.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.727 1.211 . . . . 0.0 111.383 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 5.0 m95 -110.59 99.63 8.57 Favored 'General case' 0 C--N 1.366 1.303 0 N-CA-C 102.13 -3.285 . . . . 0.0 102.13 171.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.402 ' HB2' ' HZ1' ' A' ' 151' ' ' LYS . 0.7 OUTLIER -106.76 131.68 53.6 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 124.625 1.17 . . . . 0.0 108.12 -177.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -135.27 138.43 9.98 Favored Glycine 0 C--N 1.348 1.25 0 O-C-N 118.938 -2.351 . . . . 0.0 108.133 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.89 152.81 50.8 Favored 'General case' 0 C--N 1.364 1.203 0 CA-C-N 120.876 2.338 . . . . 0.0 107.182 174.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 p -127.32 140.79 51.96 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 106.33 -1.729 . . . . 0.0 106.33 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.5 t -85.84 134.86 26.24 Favored 'Isoleucine or valine' 0 C--N 1.37 1.461 0 N-CA-C 102.411 -3.181 . . . . 0.0 102.411 169.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.418 14.2 p -14.64 64.41 0.0 OUTLIER 'General case' 0 C--N 1.375 1.705 0 C-N-CA 131.674 3.99 . . . . 0.0 120.29 -171.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.436 2.0 ptmt -15.77 -56.75 0.04 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 137.796 6.439 . . . . 0.0 117.215 -172.201 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -68.94 48.18 0.48 Allowed 'Trans proline' 0 CA--C 1.574 2.508 0 C-N-CA 123.143 2.562 . . . . 0.0 115.174 166.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.402 0.0 OUTLIER 156.45 -171.89 0.0 OUTLIER 'General case' 0 C--N 1.376 1.75 0 C-N-CA 131.356 3.863 . . . . 0.0 110.576 176.159 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -152.35 -77.41 0.12 Allowed 'General case' 0 N--CA 1.423 -1.779 0 N-CA-C 104.569 -2.382 . . . . 0.0 104.569 157.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.502 0.0 OUTLIER 19.35 59.53 0.02 OUTLIER 'General case' 0 C--N 1.356 0.855 1 C-N-CA 135.417 5.487 . . . . 0.0 119.176 -170.496 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 171.14 -168.7 0.02 OUTLIER 'General case' 0 CA--C 1.507 -0.698 1 C-N-CA 132.322 4.249 . . . . 0.0 104.299 -172.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 81' ' ' LEU 0.489 0.0 OUTLIER -125.22 -71.41 0.71 Allowed 'General case' 0 C--N 1.358 0.944 0 CA-C-N 119.457 1.026 . . . . 0.0 113.631 -179.763 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.517 ' H ' HD23 ' A' ' 81' ' ' LEU . 9.3 p-10 -43.71 -59.57 3.37 Favored Pre-proline 0 C--N 1.355 0.831 0 N-CA-C 121.78 3.993 . . . . 0.0 121.78 172.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.619 0.0 OUTLIER 55.49 -178.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.392 2.82 1 N-CA-C 123.061 4.216 . . . . 0.0 123.061 163.648 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 24.6 t -105.26 140.61 38.15 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 102.053 -3.314 . . . . 0.0 102.053 171.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.9 mp -100.29 130.15 46.37 Favored 'General case' 0 C--N 1.347 0.486 1 N-CA-C 99.157 -4.386 . . . . 0.0 99.157 -177.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -123.3 74.29 1.23 Allowed 'General case' 0 CA--C 1.479 -1.756 0 N-CA-C 105.655 -1.979 . . . . 0.0 105.655 -161.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.365 0.5 OUTLIER 95.35 115.65 0.02 OUTLIER 'General case' 0 C--N 1.368 1.389 0 CA-C-O 123.482 1.611 . . . . 0.0 110.598 -176.487 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.482 HH22 HG21 ' A' ' 70' ' ' ILE . 14.3 ptm180 -114.75 129.93 56.76 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 171.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.9 ttt -93.73 122.02 35.76 Favored 'General case' 0 N--CA 1.439 -0.986 1 C-N-CA 132.998 4.519 . . . . 0.0 107.729 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.274 . . -127.91 114.44 17.17 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 103.319 -2.845 . . . . 0.0 103.319 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -144.4 122.04 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 O-C-N 119.849 -1.782 . . . . 0.0 108.634 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.546 HD12 HG23 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -118.14 -179.67 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 C-N-CA 127.67 2.388 . . . . 0.0 112.72 -166.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . 0.326 0.2 OUTLIER -140.23 153.13 46.46 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 111.314 -2.676 . . . . 0.0 109.169 162.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.56 ' HB2' ' HD2' ' A' ' 139' ' ' ARG . 68.0 m -162.5 -122.35 0.02 OUTLIER 'General case' 0 C--N 1.354 0.789 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -169.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.581 ' CG ' ' H ' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -84.76 -81.52 0.19 Allowed 'General case' 0 C--N 1.362 1.138 1 C-N-CA 136.118 5.767 . . . . 0.0 114.661 -171.677 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.581 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 0.5 OUTLIER -87.71 -1.16 57.78 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 129.521 3.128 . . . . 0.0 110.428 171.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 138' ' ' SER . 0.7 OUTLIER -76.62 177.66 2.46 Favored Pre-proline 0 N--CA 1.42 -1.94 0 C-N-CA 125.951 1.7 . . . . 0.0 111.004 -170.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.14 -84.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.727 0 CA-C-N 127.246 3.624 . . . . 0.0 116.472 174.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 133.06 134.9 3.55 Favored Glycine 0 N--CA 1.467 0.762 0 C-N-CA 126.334 1.921 . . . . 0.0 113.461 -171.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' A' ' 145' ' ' ALA . 17.3 tptm -140.89 -173.43 3.71 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.571 2.348 . . . . 0.0 109.136 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.437 ' H ' ' HG3' ' A' ' 144' ' ' LYS . . . -85.88 -162.86 0.78 Allowed 'General case' 0 C--N 1.363 1.155 0 C-N-CA 129.053 2.941 . . . . 0.0 113.904 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 75.5 m -162.99 130.9 3.72 Favored 'General case' 0 C--N 1.353 0.759 0 O-C-N 119.997 -1.69 . . . . 0.0 107.973 175.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.302 8.3 ptpp? -159.14 39.77 0.21 Allowed 'General case' 0 CA--C 1.483 -1.61 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 176.54 148.63 0.12 Allowed 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 103.86 -2.645 . . . . 0.0 103.86 -176.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 4.6 m -145.22 39.66 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.199 0 C-N-CA 125.249 1.42 . . . . 0.0 113.294 -177.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.733 ' CD1' ' H ' ' A' ' 152' ' ' THR . 5.0 tp -130.36 103.04 7.52 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 C-N-CA 125.189 1.396 . . . . 0.0 114.492 170.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.827 ' HE3' HD11 ' A' ' 66' ' ' LEU 0.292 0.0 OUTLIER -127.92 111.24 13.36 Favored 'General case' 0 CA--C 1.459 -2.536 1 O-C-N 115.916 -4.24 . . . . 0.0 115.568 118.886 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.733 ' H ' ' CD1' ' A' ' 150' ' ' ILE 0.28 74.5 p -118.71 99.11 6.57 Favored 'General case' 0 N--CA 1.435 -1.196 1 N-CA-C 97.58 -4.97 . . . . 0.0 97.58 130.755 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.681 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -175.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 117.262 2.319 . . . . 0.0 117.262 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.9 p -104.08 48.87 0.83 Allowed 'General case' 0 C--N 1.353 0.733 0 C-N-CA 129.69 3.196 . . . . 0.0 108.68 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.92 63.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.912 0 C-N-CA 129.401 3.081 . . . . 0.0 117.956 -173.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.631 ' HA ' HG13 ' A' ' 7' ' ' VAL . 15.3 m-80 -71.34 0.62 7.68 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 130.956 3.702 . . . . 0.0 115.964 178.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.5 m -61.22 -55.47 31.72 Favored 'General case' 0 C--N 1.349 0.581 0 C-N-CA 130.458 3.503 . . . . 0.0 112.104 174.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -72.74 -21.16 61.07 Favored 'General case' 0 C--N 1.363 1.188 0 C-N-CA 128.222 2.609 . . . . 0.0 112.656 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.631 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.267 0.7 OUTLIER -82.41 -38.13 15.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.074 0 C-N-CA 126.798 2.039 . . . . 0.0 111.049 178.156 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -65.82 -44.47 85.53 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 129.857 3.263 . . . . 0.0 108.885 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.88 -43.84 89.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 C-N-CA 126.048 1.739 . . . . 0.0 110.765 168.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.266 2.7 tpt85 -62.33 -50.29 72.22 Favored 'General case' 0 C--N 1.371 1.511 0 N-CA-C 116.153 1.909 . . . . 0.0 116.153 170.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -59.11 -29.18 67.18 Favored 'General case' 0 C--N 1.373 1.596 0 N-CA-C 118.486 2.773 . . . . 0.0 118.486 170.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -77.21 -51.45 10.93 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.13 3.372 . . . . 0.0 110.719 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -57.44 -29.21 64.0 Favored 'General case' 0 C--N 1.382 1.993 0 C-N-CA 128.271 2.628 . . . . 0.0 111.042 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.747 HD23 ' HA ' ' A' ' 54' ' ' ILE . 7.9 tp -71.22 -46.68 60.63 Favored 'General case' 0 C--N 1.374 1.648 0 CA-C-N 114.878 -1.056 . . . . 0.0 112.569 167.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.582 ' HA ' HD11 ' A' ' 54' ' ' ILE . 3.3 tmm_? -55.32 -43.43 74.89 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 120.18 1.354 . . . . 0.0 112.722 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -57.91 -47.75 81.91 Favored 'General case' 0 C--N 1.371 1.543 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 165.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -61.01 -50.15 74.53 Favored 'General case' 0 C--N 1.38 1.912 0 C-N-CA 128.28 2.632 . . . . 0.0 115.113 175.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.544 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -65.33 -51.44 60.55 Favored 'General case' 0 C--N 1.357 0.91 1 C-N-CA 131.942 4.097 . . . . 0.0 110.226 177.46 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -72.95 -44.84 60.68 Favored 'General case' 0 C--N 1.381 1.952 0 N-CA-C 117.693 2.479 . . . . 0.0 117.693 176.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.4 m -63.71 -42.93 97.87 Favored 'General case' 0 C--N 1.374 1.654 0 C-N-CA 126.352 1.861 . . . . 0.0 112.792 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.491 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.453 4.9 mp0 -76.75 -28.41 55.74 Favored 'General case' 0 C--N 1.358 0.977 0 O-C-N 120.073 -1.642 . . . . 0.0 111.029 174.163 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.45 -32.53 71.47 Favored 'General case' 0 C--N 1.386 2.156 0 CA-C-N 122.467 2.394 . . . . 0.0 113.023 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -65.12 -45.33 85.54 Favored 'General case' 0 C--N 1.38 1.892 0 C-N-CA 124.347 1.059 . . . . 0.0 111.761 163.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -56.63 -47.04 80.56 Favored 'General case' 0 C--N 1.378 1.806 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 171.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.448 ' CD1' ' CD1' ' A' ' 67' ' ' PHE . 1.2 mt -68.57 -43.85 83.24 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 124.929 1.291 . . . . 0.0 112.767 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.58 1.4 p30 -73.41 -23.95 60.21 Favored 'General case' 0 C--N 1.376 1.75 0 CA-C-N 121.631 2.014 . . . . 0.0 114.001 173.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -70.61 -41.32 72.41 Favored 'General case' 0 C--N 1.382 1.979 0 C-N-CA 125.059 1.343 . . . . 0.0 111.086 169.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -66.01 -37.68 86.54 Favored 'General case' 0 C--N 1.373 1.614 0 O-C-N 119.439 -2.038 . . . . 0.0 112.429 173.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -40.15 87.79 Favored 'Isoleucine or valine' 0 C--N 1.363 1.17 0 C-N-CA 124.619 1.168 . . . . 0.0 113.807 174.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -67.21 -39.96 86.39 Favored 'General case' 0 C--N 1.37 1.469 0 O-C-N 120.604 -1.31 . . . . 0.0 113.265 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -75.7 -38.57 58.51 Favored 'General case' 0 CA--C 1.484 -1.575 0 C-N-CA 126.37 1.868 . . . . 0.0 111.642 -176.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.35 -44.96 67.07 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 124.055 0.942 . . . . 0.0 113.175 174.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.54 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.362 96.5 p -71.41 -31.38 67.18 Favored 'General case' 0 C--N 1.355 0.824 0 O-C-N 121.214 -0.929 . . . . 0.0 113.159 177.1 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -69.69 -48.49 59.47 Favored 'General case' 0 C--N 1.367 1.355 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 164.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.1 67.69 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 126.48 1.912 . . . . 0.0 114.612 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.9 -13.67 62.36 Favored 'General case' 0 C--N 1.378 1.805 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 164.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.22 18.05 30.03 Favored Glycine 0 C--N 1.375 2.731 0 O-C-N 120.823 -1.173 . . . . 0.0 113.576 171.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.674 HG23 HD23 ' A' ' 81' ' ' LEU 0.256 0.8 OUTLIER -113.25 169.08 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 -174.603 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.5 t -30.37 -78.3 0.02 OUTLIER 'General case' 0 C--N 1.357 0.919 1 C-N-CA 132.825 4.45 . . . . 0.0 117.242 178.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.5 m 122.73 146.86 0.0 OUTLIER 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 131.483 3.913 . . . . 0.0 102.521 -169.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.415 ' CE1' HG23 ' A' ' 74' ' ' VAL . 30.5 p90 -122.98 154.6 38.21 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 124.713 1.205 . . . . 0.0 109.012 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -101.3 144.66 29.87 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 106.034 -1.839 . . . . 0.0 106.034 174.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.289 2.5 pp -125.86 159.6 32.07 Favored 'General case' 0 CA--C 1.49 -1.349 0 O-C-N 119.207 -2.183 . . . . 0.0 111.066 174.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -133.79 165.98 23.72 Favored 'General case' 0 CA--C 1.485 -1.537 0 N-CA-C 102.059 -3.311 . . . . 0.0 102.059 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 131' ' ' CYS . 0.1 OUTLIER -152.98 147.2 25.66 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -179.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.7 t -95.24 124.94 39.54 Favored 'General case' 0 C--N 1.359 0.994 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 176.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.464 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.325 0.4 OUTLIER -79.51 -11.03 59.9 Favored 'General case' 0 C--O 1.212 -0.876 0 CA-C-O 117.975 -1.012 . . . . 0.0 113.342 -179.439 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.73 -37.98 48.11 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 127.639 2.375 . . . . 0.0 112.34 176.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.3 tp -62.79 -41.02 99.09 Favored 'General case' 0 C--N 1.359 1.007 0 CA-C-O 126.536 3.065 . . . . 0.0 111.544 168.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.544 HD11 ' CD1' ' A' ' 18' ' ' PHE 0.401 6.8 tt -76.62 -41.43 45.98 Favored 'General case' 0 CA--C 1.473 -1.988 0 CA-C-N 110.299 -3.137 . . . . 0.0 109.231 -172.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.412 ' HA ' HG22 ' A' ' 54' ' ' ILE . 29.9 t70 -54.65 -38.24 66.66 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 129.147 2.979 . . . . 0.0 111.746 165.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -66.23 -42.29 88.85 Favored 'General case' 0 C--N 1.376 1.724 0 O-C-N 119.735 -1.853 . . . . 0.0 112.136 169.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.72 -28.69 67.05 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 118.693 -2.504 . . . . 0.0 116.959 170.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.747 ' HA ' HD23 ' A' ' 14' ' ' LEU 0.401 0.2 OUTLIER -69.29 -41.81 81.15 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.132 0 C-N-CA 131.582 3.953 . . . . 0.0 111.972 179.61 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -105.05 -28.86 10.79 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 171.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -83.54 -27.31 29.41 Favored 'General case' 0 C--N 1.371 1.517 0 CA-C-N 122.277 2.308 . . . . 0.0 111.422 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -103.55 -70.11 0.77 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.931 1.693 . . . . 0.0 111.384 173.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . 0.566 0.0 OUTLIER 83.78 155.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 127.082 2.153 . . . . 0.0 111.568 -179.419 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.514 ' N ' HD22 ' A' ' 14' ' ' LEU 0.257 47.0 p30 31.83 47.43 0.07 Allowed 'General case' 0 N--CA 1.519 3.011 1 C-N-CA 132.483 4.313 . . . . 0.0 116.675 -177.296 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.404 11.3 pt-20 -82.03 69.88 8.83 Favored 'General case' 0 CA--C 1.478 -1.81 0 CA-C-O 125.005 2.336 . . . . 0.0 113.358 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 64' ' ' PHE 0.414 1.2 p -81.67 -19.09 42.35 Favored 'General case' 0 N--CA 1.426 -1.637 0 C-N-CA 131.687 3.995 . . . . 0.0 113.819 164.828 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.601 ' CD2' HD13 ' A' ' 141' ' ' LEU . 0.0 OUTLIER -65.42 -35.53 81.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 130.322 3.449 . . . . 0.0 109.157 171.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.654 ' HA ' HD11 ' A' ' 111' ' ' LEU . 3.0 t -58.71 -46.1 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.845 0 C-N-CA 129.668 3.187 . . . . 0.0 110.442 176.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.491 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.254 60.3 m-85 -60.55 -45.18 94.86 Favored 'General case' 0 C--O 1.212 -0.875 1 C-N-CA 131.812 4.045 . . . . 0.0 114.065 166.91 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -68.32 -37.98 81.1 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 121.507 1.958 . . . . 0.0 114.049 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.597 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.3 tm? -65.1 -52.4 55.69 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 125.116 1.366 . . . . 0.0 112.087 168.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.457 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.677 0.0 OUTLIER -78.44 -17.76 55.89 Favored 'General case' 0 C--N 1.38 1.896 0 CA-C-N 121.967 2.167 . . . . 0.0 116.158 -177.299 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.3 m-70 -78.08 -22.97 48.22 Favored 'General case' 0 C--N 1.355 0.826 0 C-N-CA 128.0 2.52 . . . . 0.0 109.576 165.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -76.91 -36.93 56.28 Favored 'General case' 0 C--N 1.381 1.96 0 O-C-N 120.379 -1.451 . . . . 0.0 110.46 170.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 66' ' ' LEU 0.356 0.0 OUTLIER -92.92 -7.55 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.295 0 N-CA-C 120.74 3.608 . . . . 0.0 120.74 -178.777 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -47.69 -1.45 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 1 C-N-CA 133.725 4.81 . . . . 0.0 116.998 -175.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -83.67 -43.23 15.79 Favored 'General case' 0 C--N 1.362 1.116 1 C-N-CA 139.079 6.952 . . . . 0.0 110.353 172.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.632 ' CG ' ' HA ' ' A' ' 153' ' ' GLN . 0.2 OUTLIER -62.57 -9.76 9.87 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 131.343 3.857 . . . . 0.0 115.895 -174.001 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.415 HG23 ' CE1' ' A' ' 41' ' ' PHE . 10.6 p -60.49 -20.73 21.47 Favored 'Isoleucine or valine' 0 C--N 1.375 1.702 0 C-N-CA 127.937 2.495 . . . . 0.0 110.959 166.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mp -72.99 -35.15 66.8 Favored 'General case' 0 C--N 1.378 1.812 0 C-N-CA 130.339 3.456 . . . . 0.0 111.362 171.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . 0.334 36.2 mt-10 -76.85 -32.61 57.66 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 120.229 -1.544 . . . . 0.0 113.118 170.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.452 HG13 ' O ' ' A' ' 73' ' ' HIS 0.383 0.8 OUTLIER -68.95 -29.94 45.07 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 CA-C-O 126.66 3.124 . . . . 0.0 110.12 167.867 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.55 ' HB3' HG11 ' A' ' 38' ' ' VAL . 11.8 m120 -68.04 -32.5 72.91 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 117.921 -2.987 . . . . 0.0 113.583 165.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.56 -30.03 71.2 Favored 'General case' 0 C--N 1.378 1.82 0 C-N-CA 125.882 1.673 . . . . 0.0 111.534 165.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.458 ' CE2' HG21 ' A' ' 117' ' ' VAL 0.389 6.6 t80 -65.35 -32.05 73.5 Favored 'General case' 0 CA--C 1.583 2.226 0 C-N-CA 126.864 2.066 . . . . 0.0 112.733 164.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.674 HD23 HG23 ' A' ' 38' ' ' VAL . 10.9 tp -63.14 -39.53 94.94 Favored 'General case' 0 N--CA 1.523 3.214 0 CA-C-O 125.09 2.376 . . . . 0.0 114.071 162.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.8 t -65.48 4.19 0.59 Allowed 'General case' 0 CA--C 1.546 0.819 1 N-CA-C 122.208 4.151 . . . . 0.0 122.208 -168.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.4 ' HB3' ' HA ' ' A' ' 95' ' ' ASP . 0.0 OUTLIER -70.51 166.75 32.49 Favored Pre-proline 0 CA--C 1.573 1.859 0 C-N-CA 126.086 1.754 . . . . 0.0 111.386 175.748 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -62.03 161.14 27.12 Favored 'Trans proline' 0 CA--C 1.56 1.785 1 C-N-CA 125.43 4.087 . . . . 0.0 113.89 175.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -69.22 150.79 71.94 Favored 'Trans proline' 0 CA--C 1.555 1.568 1 CA-C-N 129.952 4.59 . . . . 0.0 117.151 -170.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . 0.479 1.6 mmm180 -66.28 -2.43 0.05 OUTLIER Pre-proline 0 CA--C 1.576 1.974 1 N-CA-C 123.745 4.721 . . . . 0.0 123.745 176.641 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -21.99 161.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.371 1.763 2 C-N-CA 129.498 6.799 . . . . 0.0 127.16 161.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -66.77 -23.66 66.1 Favored 'General case' 0 C--N 1.364 1.198 0 C-N-CA 131.505 3.922 . . . . 0.0 116.381 174.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 121.34 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.601 0 C-N-CA 130.622 3.569 . . . . 0.0 112.136 174.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.76 -17.42 64.61 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 129.755 3.222 . . . . 0.0 115.442 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.17 -30.75 60.79 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 127.135 2.174 . . . . 0.0 112.122 172.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -97.49 -65.11 0.98 Allowed 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 125.48 1.512 . . . . 0.0 113.355 176.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.77 80.5 t80 26.68 -47.93 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.565 2 N-CA-C 127.369 6.063 . . . . 0.0 127.369 -173.643 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . 0.254 4.7 pt -119.93 136.13 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.102 0 N-CA-C 117.296 2.332 . . . . 0.0 117.296 -175.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' ' 83' ' ' MET . 0.4 OUTLIER -155.37 161.79 40.96 Favored 'General case' 0 CA--C 1.508 -0.655 1 C-N-CA 138.025 6.53 . . . . 0.0 102.593 176.241 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 41.61 23.83 0.13 Allowed Glycine 0 C--N 1.359 1.822 0 C-N-CA 129.528 3.442 . . . . 0.0 119.671 172.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 1.6 p -68.09 142.3 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.903 0 C-N-CA 130.248 3.419 . . . . 0.0 117.942 -160.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -94.42 16.92 14.0 Favored 'General case' 0 N--CA 1.44 -0.972 1 C-N-CA 132.106 4.162 . . . . 0.0 115.022 -174.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -96.85 -20.89 17.84 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 127.865 2.466 . . . . 0.0 107.835 173.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -112.82 152.39 44.78 Favored Pre-proline 0 C--N 1.353 0.734 0 N-CA-C 102.783 -3.044 . . . . 0.0 102.783 169.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -75.32 138.12 21.88 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.809 3.006 . . . . 0.0 110.229 176.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.47 48.88 3.51 Favored Glycine 0 C--N 1.359 1.835 0 C-N-CA 126.142 1.83 . . . . 0.0 115.155 -172.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -141.06 151.7 44.23 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.286 -1.714 . . . . 0.0 107.902 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.0 mt -109.61 114.11 27.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 103.991 -2.596 . . . . 0.0 103.991 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -128.81 109.42 11.26 Favored 'General case' 0 CA--C 1.496 -1.107 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 -173.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.762 HD12 HD23 ' A' ' 113' ' ' LEU . 1.3 pp -136.63 141.01 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.075 0 C-N-CA 125.752 1.621 . . . . 0.0 111.837 -171.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 2.5 m -117.9 118.47 32.09 Favored 'General case' 0 C--N 1.351 0.641 0 O-C-N 119.652 -1.905 . . . . 0.0 111.873 177.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.263 0.4 OUTLIER -176.6 170.36 2.45 Favored 'General case' 0 CA--C 1.479 -1.762 0 N-CA-C 102.724 -3.065 . . . . 0.0 102.724 172.727 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.597 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 94.0 -34.15 4.83 Favored Glycine 1 CA--C 1.417 -6.074 0 CA-C-O 115.044 -3.087 . . . . 0.0 110.753 -160.863 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 29.9 m-80 100.76 0.71 0.02 OUTLIER 'General case' 0 C--N 1.375 1.684 2 C-N-CA 132.232 4.213 . . . . 0.0 106.381 -157.448 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.654 HD11 ' HA ' ' A' ' 63' ' ' VAL 0.308 1.0 OUTLIER -86.72 137.03 32.79 Favored 'General case' 0 C--N 1.354 0.787 1 C-N-CA 138.103 6.561 . . . . 0.0 114.216 -178.681 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.71 100.64 13.32 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 164.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.762 HD23 HD12 ' A' ' 106' ' ' ILE . 0.3 OUTLIER -96.22 126.82 41.7 Favored 'General case' 0 C--N 1.382 1.981 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 175.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.66 123.71 5.32 Favored Glycine 0 C--N 1.351 1.391 0 N-CA-C 105.899 -2.881 . . . . 0.0 105.899 174.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -122.97 127.3 48.66 Favored 'General case' 0 C--N 1.369 1.446 1 N-CA-C 99.648 -4.204 . . . . 0.0 99.648 174.713 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.1 m -121.18 127.88 51.93 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 -171.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.459 HG13 ' HB3' ' A' ' 127' ' ' PRO . 13.4 t -80.24 138.73 19.31 Favored 'Isoleucine or valine' 0 C--N 1.363 1.185 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.425 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.558 10.9 p -54.41 67.7 0.0 OUTLIER 'General case' 0 C--N 1.378 1.84 0 N-CA-C 120.845 3.646 . . . . 0.0 120.845 -162.06 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.465 11.8 ttmm -22.48 -45.81 0.05 OUTLIER Pre-proline 0 C--N 1.359 0.997 1 C-N-CA 133.999 4.92 . . . . 0.0 121.795 -170.251 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -70.63 60.18 2.12 Favored 'Trans proline' 0 CA--C 1.567 2.13 0 CA-C-N 125.647 3.053 . . . . 0.0 113.595 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 170.07 161.99 0.07 Allowed 'General case' 0 C--N 1.367 1.335 0 C-N-CA 128.038 2.535 . . . . 0.0 113.521 179.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.542 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 2.5 tt0 -85.28 -69.63 0.64 Allowed 'General case' 0 C--N 1.376 1.744 0 N-CA-C 104.979 -2.23 . . . . 0.0 104.979 152.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? 44.37 -10.76 0.0 OUTLIER 'General case' 0 C--N 1.363 1.173 1 C-N-CA 139.648 7.179 . . . . 0.0 118.018 -170.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.542 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 56.4 m-85 -138.9 -163.01 1.4 Allowed 'General case' 0 N--CA 1.414 -2.245 0 N-CA-C 121.212 3.782 . . . . 0.0 121.212 -161.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HB2' HD12 ' A' ' 81' ' ' LEU 0.364 0.0 OUTLIER -167.84 -56.4 0.02 OUTLIER 'General case' 0 C--N 1.359 1.019 2 C-N-CA 139.725 7.21 . . . . 0.0 105.484 179.051 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.581 ' HB3' HD22 ' A' ' 81' ' ' LEU . 1.4 p30 -89.31 85.26 0.13 Allowed Pre-proline 0 C--N 1.357 0.894 1 C-N-CA 131.999 4.119 . . . . 0.0 111.912 171.969 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.459 ' HB3' HG13 ' A' ' 117' ' ' VAL . 2.8 Cg_exo -90.72 -176.08 0.94 Allowed 'Trans proline' 0 CA--C 1.488 -1.782 0 C-N-CA 124.136 3.224 . . . . 0.0 117.297 -161.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 16.6 m -112.41 136.07 52.34 Favored 'General case' 0 N--CA 1.439 -1.006 1 N-CA-C 100.192 -4.003 . . . . 0.0 100.192 162.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.5 mp -100.73 140.83 34.46 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 102.415 -3.18 . . . . 0.0 102.415 -175.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.425 ' HG2' ' HA ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -100.28 -0.58 38.23 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 120.889 -1.132 . . . . 0.0 110.412 -166.592 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 45' ' ' TYR . 8.4 t 174.21 128.92 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.385 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 -170.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -115.59 109.79 18.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 101.309 -3.589 . . . . 0.0 101.309 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 10.3 ttt -104.28 122.66 45.87 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.191 2.196 . . . . 0.0 107.423 177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . 0.301 . . -129.07 113.74 15.51 Favored 'General case' 0 N--CA 1.435 -1.213 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 173.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -144.24 159.98 15.37 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 C-N-CA 125.378 1.471 . . . . 0.0 111.836 -176.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.945 HD13 HD11 ' A' ' 141' ' ' LEU . 0.2 OUTLIER -140.11 -179.08 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 128.236 2.614 . . . . 0.0 108.989 -175.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.409 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -138.12 122.98 18.88 Favored 'General case' 0 CA--C 1.56 1.331 0 N-CA-C 117.938 2.57 . . . . 0.0 117.938 179.168 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.326 46.5 m 172.72 -76.01 0.0 OUTLIER 'General case' 0 C--N 1.366 1.284 0 C-N-CA 128.989 2.915 . . . . 0.0 105.486 177.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.459 ' HG2' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER 168.45 -123.78 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.156 1 N-CA-C 95.722 -5.659 . . . . 0.0 95.722 -172.363 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.459 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 -58.94 -24.72 62.82 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 130.979 3.711 . . . . 0.0 119.682 173.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.945 HD11 HD13 ' A' ' 136' ' ' ILE 0.359 0.0 OUTLIER 63.42 157.98 0.12 Allowed Pre-proline 0 N--CA 1.436 -1.125 2 C-N-CA 135.802 5.641 . . . . 0.0 124.276 178.991 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -72.4 -20.33 24.19 Favored 'Trans proline' 0 C--N 1.366 1.46 1 C-N-CA 126.228 4.619 . . . . 0.0 116.85 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 32.62 55.14 0.48 Allowed Glycine 0 N--CA 1.472 1.058 1 C-N-CA 135.323 6.201 . . . . 0.0 122.583 175.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -141.57 137.96 32.31 Favored 'General case' 0 C--N 1.355 0.817 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 75.8 157.36 0.19 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 128.372 2.669 . . . . 0.0 116.288 -177.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 36.4 t -135.54 130.82 35.16 Favored 'General case' 0 C--N 1.363 1.189 0 O-C-N 119.351 -2.093 . . . . 0.0 105.834 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp 164.05 117.17 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.528 0 C-N-CA 128.726 2.81 . . . . 0.0 107.566 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -158.24 -82.35 0.05 Allowed 'General case' 0 N--CA 1.439 -1.004 0 N-CA-C 105.893 -1.891 . . . . 0.0 105.893 -172.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.8 -77.39 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.206 0 C-N-CA 125.88 1.672 . . . . 0.0 111.694 172.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.411 HG21 HG22 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -103.3 134.78 43.51 Favored 'Isoleucine or valine' 0 CA--C 1.466 -2.251 0 C-N-CA 127.273 2.229 . . . . 0.0 107.637 -161.542 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -77.82 115.24 17.41 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 105.433 -2.062 . . . . 0.0 105.433 176.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 11.0 t -75.38 143.84 42.57 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -124.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.632 ' HA ' ' CG ' ' A' ' 73' ' ' HIS . 3.1 tp60 . . . . . 0 C--O 1.263 1.764 0 C-N-CA 129.235 3.014 . . . . 0.0 109.841 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.0 mtp . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . 0.311 17.8 p 50.1 92.76 0.02 OUTLIER 'General case' 0 C--N 1.361 1.067 0 N-CA-C 121.097 3.74 . . . . 0.0 121.097 176.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.409 ' O ' ' HB ' ' A' ' 7' ' ' VAL . 0.0 OUTLIER -79.86 79.05 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.374 1.652 0 C-N-CA 126.58 1.952 . . . . 0.0 108.808 173.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.462 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.452 2.5 m120 -114.8 10.01 16.42 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 128.661 2.784 . . . . 0.0 114.441 -178.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.88 -58.21 1.92 Allowed 'General case' 0 C--O 1.246 0.906 1 C-N-CA 132.504 4.321 . . . . 0.0 105.465 160.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.436 6.7 mt-10 -63.99 -8.74 12.47 Favored 'General case' 0 C--O 1.205 -1.243 0 O-C-N 119.49 -2.006 . . . . 0.0 115.358 177.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.5 p -67.93 -35.65 72.82 Favored 'Isoleucine or valine' 0 C--N 1.365 1.262 0 C-N-CA 131.488 3.915 . . . . 0.0 113.339 171.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -78.64 -43.81 25.32 Favored 'General case' 0 CA--C 1.497 -1.095 1 C-N-CA 133.062 4.545 . . . . 0.0 107.721 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 64.7 mt -64.39 -44.1 97.11 Favored 'Isoleucine or valine' 0 C--N 1.374 1.658 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.423 166.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' HE ' HD11 ' A' ' 58' ' ' ILE 0.267 26.5 mmm-85 -54.8 -50.34 68.76 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 130.576 3.55 . . . . 0.0 111.536 174.259 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -57.89 -36.72 72.8 Favored 'General case' 0 C--N 1.377 1.798 0 N-CA-C 118.596 2.813 . . . . 0.0 118.596 163.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -76.64 -44.43 34.09 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 118.17 -2.831 . . . . 0.0 113.259 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 30.6 mmmt -63.67 -30.43 71.54 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 131.075 3.75 . . . . 0.0 106.95 172.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.533 HD22 ' CD2' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -67.87 -41.02 83.47 Favored 'General case' 0 C--N 1.373 1.619 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 162.334 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.4 mtp180 -60.15 -38.06 82.01 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.404 2.82 . . . . 0.0 112.425 171.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.8 mmt-85 -63.23 -53.25 55.97 Favored 'General case' 0 C--N 1.374 1.641 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 166.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB2' HD23 ' A' ' 14' ' ' LEU . 8.4 m-70 -59.07 -50.37 74.33 Favored 'General case' 0 C--N 1.385 2.144 0 C-N-CA 130.226 3.41 . . . . 0.0 112.343 177.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.546 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.62 -54.1 49.39 Favored 'General case' 0 C--N 1.378 1.819 0 C-N-CA 130.176 3.391 . . . . 0.0 111.165 176.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -73.57 -38.75 65.08 Favored 'General case' 0 C--N 1.374 1.632 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 177.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -65.59 -43.73 88.8 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 125.438 1.495 . . . . 0.0 112.826 177.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.626 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.257 44.2 mt-10 -75.26 -28.99 60.03 Favored 'General case' 0 C--N 1.361 1.096 0 O-C-N 121.08 -1.012 . . . . 0.0 111.732 171.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.409 ' CE2' ' CD2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -67.89 -28.65 67.69 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 117.883 -3.011 . . . . 0.0 114.827 171.103 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 -69.16 -37.04 78.02 Favored 'General case' 0 C--N 1.372 1.567 0 C-N-CA 125.629 1.572 . . . . 0.0 109.393 165.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.577 HE21 ' CE1' ' A' ' 68' ' ' HIS . 27.8 tt0 -58.9 -43.15 90.97 Favored 'General case' 0 C--N 1.369 1.451 0 N-CA-C 116.49 2.033 . . . . 0.0 116.49 169.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.528 HD13 ' CE1' ' A' ' 68' ' ' HIS . 0.2 OUTLIER -72.42 -46.23 57.01 Favored 'Isoleucine or valine' 0 C--N 1.366 1.32 0 O-C-N 121.267 -0.896 . . . . 0.0 111.626 176.288 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.448 ' HA ' ' CG1' ' A' ' 29' ' ' ILE 0.634 17.7 p30 -71.98 -22.62 61.41 Favored 'General case' 0 C--N 1.372 1.586 0 O-C-N 119.733 -1.855 . . . . 0.0 115.447 175.837 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.4 t-20 -74.37 -43.11 57.92 Favored 'General case' 0 C--N 1.373 1.591 0 O-C-N 119.754 -1.841 . . . . 0.0 110.508 166.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.5 ' CD ' ' HB2' ' A' ' 71' ' ' LYS 0.312 0.3 OUTLIER -64.86 -32.73 74.57 Favored 'General case' 0 C--N 1.395 2.576 0 O-C-N 118.756 -2.465 . . . . 0.0 113.526 173.196 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.549 HG21 HD23 ' A' ' 43' ' ' LEU 0.262 1.5 pp -67.84 -43.45 86.11 Favored 'Isoleucine or valine' 0 C--N 1.375 1.681 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 174.03 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 25.0 ttm105 -62.84 -37.67 87.72 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 119.748 -1.845 . . . . 0.0 115.853 174.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -76.59 -48.66 18.48 Favored 'General case' 0 CA--C 1.478 -1.793 0 C-N-CA 127.756 2.423 . . . . 0.0 111.27 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.473 ' CB ' HG11 ' A' ' 74' ' ' VAL . . . -68.52 -34.74 76.41 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.1 t -73.45 -43.33 60.53 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.281 1.432 . . . . 0.0 110.73 175.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -70.74 -35.72 72.82 Favored 'General case' 0 C--N 1.375 1.711 0 N-CA-C 116.5 2.037 . . . . 0.0 116.5 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.75 -32.7 62.17 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 126.194 1.798 . . . . 0.0 113.748 175.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -16.54 60.54 Favored 'General case' 0 C--N 1.385 2.125 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.56 18.38 28.25 Favored Glycine 0 C--N 1.37 2.426 0 O-C-N 121.123 -0.985 . . . . 0.0 115.289 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.52 HG21 ' CB ' ' A' ' 78' ' ' ASN . 0.6 OUTLIER -104.1 166.93 2.85 Favored 'Isoleucine or valine' 0 C--N 1.357 0.917 0 N-CA-C 101.722 -3.436 . . . . 0.0 101.722 176.03 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.442 ' N ' ' CG2' ' A' ' 38' ' ' VAL 0.298 0.0 OUTLIER -39.18 160.87 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.115 1 C-N-CA 134.417 5.087 . . . . 0.0 118.011 159.925 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.9 p -103.89 117.76 35.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 118.808 -2.433 . . . . 0.0 110.034 -173.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -118.28 153.24 34.28 Favored 'General case' 0 C--N 1.362 1.142 0 CA-C-O 122.034 0.921 . . . . 0.0 110.372 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -113.83 105.8 13.7 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HA ' ' HB2' ' A' ' 129' ' ' LEU 0.356 0.1 OUTLIER -94.58 120.71 35.24 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 118.845 -2.409 . . . . 0.0 111.671 -169.347 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -132.55 145.23 50.97 Favored 'General case' 0 C--N 1.4 2.801 0 CA-C-N 120.64 1.564 . . . . 0.0 109.426 -170.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.547 ' HA ' ' H ' ' A' ' 132' ' ' ARG . 0.0 OUTLIER -92.65 147.32 22.97 Favored 'General case' 0 C--N 1.365 1.24 0 C-N-CA 129.582 3.153 . . . . 0.0 114.897 -179.039 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.4 p -108.45 96.81 6.6 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 128.625 2.77 . . . . 0.0 105.543 175.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.429 ' HG2' ' H ' ' A' ' 47' ' ' GLN . 29.7 mm-40 -48.03 -8.43 0.02 OUTLIER 'General case' 0 C--O 1.2 -1.508 1 C-N-CA 132.056 4.142 . . . . 0.0 119.773 -174.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.68 -48.34 81.43 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 125.383 3.72 . . . . 0.0 116.695 -179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.657 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.2 -38.96 92.93 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 129.726 3.21 . . . . 0.0 112.997 171.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.657 ' H ' HD22 ' A' ' 49' ' ' LEU . 5.9 tt -72.01 -36.59 69.76 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 127.456 2.303 . . . . 0.0 111.062 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.58 -30.41 71.13 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 129.642 3.177 . . . . 0.0 108.82 176.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -69.4 -45.68 68.67 Favored 'General case' 0 C--N 1.37 1.499 0 CA-C-O 124.306 2.003 . . . . 0.0 115.315 164.325 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.518 ' HB1' ' CD ' ' A' ' 60' ' ' GLU . . . -75.52 -27.83 58.89 Favored 'General case' 0 N--CA 1.434 -1.245 0 N-CA-C 117.574 2.435 . . . . 0.0 117.574 -172.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.496 HD12 ' CD2' ' A' ' 50' ' ' LEU . 5.2 tt -74.35 -37.61 45.48 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.845 1 C-N-CA 132.941 4.496 . . . . 0.0 110.587 176.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -107.94 -29.17 9.18 Favored 'General case' 0 C--N 1.38 1.904 0 N-CA-C 117.862 2.541 . . . . 0.0 117.862 175.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.81 -45.32 17.12 Favored 'General case' 0 C--N 1.357 0.933 0 CA-C-N 121.663 2.029 . . . . 0.0 114.35 -172.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.642 ' CG ' HD23 ' A' ' 141' ' ' LEU 0.276 0.0 OUTLIER -103.35 -44.05 5.26 Favored 'General case' 0 CA--C 1.48 -1.749 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 171.423 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.474 HG22 ' O ' ' A' ' 54' ' ' ILE 0.488 0.0 OUTLIER 74.82 -168.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.854 1 C-N-CA 131.984 4.114 . . . . 0.0 112.638 179.132 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.434 ' HA ' ' HG ' ' A' ' 14' ' ' LEU 0.252 50.2 p30 21.94 49.54 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.76 1 C-N-CA 131.909 4.083 . . . . 0.0 117.786 179.002 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.518 ' CD ' ' HB1' ' A' ' 53' ' ' ALA 0.5 11.4 pt-20 -80.76 62.99 5.0 Favored 'General case' 0 C--N 1.362 1.12 0 CA-C-O 127.308 3.432 . . . . 0.0 112.227 -172.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.448 ' HA ' ' HB2' ' A' ' 64' ' ' PHE 0.561 1.4 p -80.64 -15.67 56.0 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.223 2.609 . . . . 0.0 116.994 176.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -71.44 -33.28 69.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.823 2.449 . . . . 0.0 107.871 167.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 136' ' ' ILE . 94.0 t -69.61 -36.21 69.66 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 C-N-CA 128.059 2.544 . . . . 0.0 108.945 175.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 31.5 m-85 -66.92 -34.91 78.82 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 126.498 1.919 . . . . 0.0 115.826 164.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -83.01 -36.72 24.79 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-N 122.032 2.196 . . . . 0.0 112.086 -176.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.836 HD13 HD13 ' A' ' 111' ' ' LEU . 2.8 tt -65.41 -42.61 92.35 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 125.648 1.579 . . . . 0.0 110.934 167.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.926 0.0 OUTLIER -77.84 -15.15 59.27 Favored 'General case' 0 C--N 1.368 1.387 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 173.596 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.577 ' CE1' HE21 ' A' ' 24' ' ' GLN 0.283 41.6 m-70 -83.77 -15.83 47.03 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 127.221 2.209 . . . . 0.0 112.042 166.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.489 0.0 OUTLIER -82.91 -27.49 30.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 119.973 -1.705 . . . . 0.0 109.107 155.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.653 HD12 ' CE1' ' A' ' 73' ' ' HIS . 18.7 mm -67.57 -9.55 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 C-N-CA 127.502 2.321 . . . . 0.0 113.537 170.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.5 ' HB2' ' CD ' ' A' ' 28' ' ' GLU . 62.2 pttt -49.98 -33.84 19.1 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 120.609 3.559 . . . . 0.0 120.609 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.497 ' HA ' HG12 ' A' ' 74' ' ' VAL . 31.4 t70 -101.62 8.41 41.77 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.517 -1.364 . . . . 0.0 107.454 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.762 ' HE1' HD11 ' A' ' 150' ' ' ILE . 10.7 m170 -66.87 -8.88 32.32 Favored 'General case' 0 C--N 1.395 2.569 0 C-N-CA 129.125 2.97 . . . . 0.0 110.988 171.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.497 HG12 ' HA ' ' A' ' 72' ' ' ASP . 9.9 p -41.38 -46.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.377 1.796 0 C-N-CA 128.968 2.907 . . . . 0.0 112.02 157.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 71.5 mt -68.46 -23.88 64.65 Favored 'General case' 0 C--N 1.36 1.045 0 N-CA-C 117.563 2.431 . . . . 0.0 117.563 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -75.47 -46.63 31.34 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.541 1.536 . . . . 0.0 111.686 172.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.39 14.7 p -66.3 -29.0 45.25 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.4 0 C-N-CA 127.474 2.31 . . . . 0.0 110.206 172.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 75' ' ' LEU . 73.0 m-20 -74.19 -38.69 63.55 Favored 'General case' 0 C--N 1.365 1.258 0 C-N-CA 128.285 2.634 . . . . 0.0 116.67 169.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -30.42 71.16 Favored 'General case' 0 C--N 1.372 1.555 0 C-N-CA 126.156 1.782 . . . . 0.0 110.896 172.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -68.22 -38.96 82.42 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 128.577 2.751 . . . . 0.0 112.283 166.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.513 HD11 ' HD2' ' A' ' 127' ' ' PRO . 2.5 tp -73.24 -15.66 61.42 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 128.551 2.74 . . . . 0.0 118.134 171.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.5 t -90.53 2.57 55.63 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 131.143 3.777 . . . . 0.0 115.222 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.437 ' CE ' HG23 ' A' ' 97' ' ' VAL . 3.0 ppp? -110.51 163.79 16.39 Favored Pre-proline 0 C--N 1.356 0.861 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 178.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -69.77 177.66 5.37 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 124.483 3.456 . . . . 0.0 113.258 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -72.8 135.03 22.88 Favored 'Trans proline' 0 C--N 1.358 1.037 0 CA-C-N 125.412 2.969 . . . . 0.0 110.021 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 11.2 mtt180 -45.86 106.69 0.58 Allowed Pre-proline 0 CA--C 1.564 1.507 0 N-CA-C 119.729 3.233 . . . . 0.0 119.729 -174.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 51.1 Cg_exo -61.55 162.62 20.48 Favored 'Trans proline' 0 C--N 1.361 1.22 1 C-N-CA 127.131 5.221 . . . . 0.0 119.809 -174.589 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -102.23 -10.34 19.66 Favored 'General case' 0 C--N 1.375 1.685 0 CA-C-O 123.277 1.513 . . . . 0.0 114.678 -173.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -89.0 -173.36 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 C-N-CA 130.636 3.574 . . . . 0.0 113.975 -176.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -130.94 -12.12 3.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 113.048 -1.887 . . . . 0.0 111.297 177.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -87.02 -48.33 8.19 Favored 'General case' 0 C--N 1.356 0.87 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -177.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -120.57 26.36 9.2 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 127.171 2.188 . . . . 0.0 110.969 -176.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.357 0.0 OUTLIER -69.86 -135.69 0.0 OUTLIER 'General case' 0 C--N 1.363 1.182 1 N-CA-C 122.398 4.221 . . . . 0.0 122.398 -171.719 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.463 HG23 ' CG2' ' A' ' 97' ' ' VAL . 8.2 mt -80.74 128.82 38.39 Favored 'Isoleucine or valine' 0 C--N 1.358 0.954 0 C-N-CA 128.893 2.877 . . . . 0.0 115.462 -177.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -144.18 -47.08 0.26 Allowed 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 113.228 -1.806 . . . . 0.0 111.392 -172.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -87.41 25.84 7.72 Favored Glycine 0 C--N 1.36 1.875 0 O-C-N 120.381 -1.449 . . . . 0.0 113.238 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.463 ' CG2' HG23 ' A' ' 94' ' ' ILE . 70.5 t -111.02 111.0 34.27 Favored 'Isoleucine or valine' 0 C--N 1.351 0.646 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -106.9 7.91 30.32 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 126.181 1.792 . . . . 0.0 112.948 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.418 ' HB3' ' H ' ' A' ' 100' ' ' ARG . 43.9 m-85 -132.46 -137.18 0.19 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.425 1.89 . . . . 0.0 113.917 -173.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.418 ' H ' ' HB3' ' A' ' 99' ' ' TYR . 30.9 mmm180 -113.04 167.67 8.89 Favored Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 127.74 2.416 . . . . 0.0 113.078 -172.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -59.15 70.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 1 C-N-CA 127.051 5.167 . . . . 0.0 122.453 -176.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 95.77 -4.16 65.76 Favored Glycine 0 N--CA 1.467 0.729 0 C-N-CA 127.306 2.384 . . . . 0.0 110.919 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.54 147.63 34.97 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 127.193 2.197 . . . . 0.0 113.975 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.7 tt -135.38 123.74 23.27 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 105.83 -1.915 . . . . 0.0 105.83 178.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -129.54 130.25 45.52 Favored 'General case' 0 C--N 1.365 1.279 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.41 HG22 HG12 ' A' ' 150' ' ' ILE 0.493 0.0 OUTLIER -135.27 140.72 44.4 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 178.294 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.9 t -124.71 143.6 50.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 119.223 -2.173 . . . . 0.0 113.213 -173.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.588 ' HB3' HD21 ' A' ' 66' ' ' LEU . 27.0 t70 -124.64 82.77 2.08 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 120.018 -1.677 . . . . 0.0 108.322 174.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.52 -47.0 0.05 OUTLIER Glycine 0 C--N 1.368 2.339 0 C-N-CA 129.78 3.562 . . . . 0.0 119.419 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -119.24 -49.17 2.4 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 128.219 2.608 . . . . 0.0 107.421 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.836 HD13 HD13 ' A' ' 66' ' ' LEU 0.318 5.6 mp -80.05 134.45 36.21 Favored 'General case' 0 C--N 1.381 1.958 0 CA-C-N 122.382 2.355 . . . . 0.0 117.062 179.234 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -104.81 101.64 11.23 Favored 'General case' 0 C--N 1.366 1.313 0 N-CA-C 104.987 -2.227 . . . . 0.0 104.987 172.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.453 ' HG ' HG13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -102.87 122.01 43.67 Favored 'General case' 0 C--N 1.37 1.469 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 177.616 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.79 135.38 12.49 Favored Glycine 0 C--N 1.356 1.671 0 N-CA-C 106.76 -2.536 . . . . 0.0 106.76 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.9 135.58 48.52 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 103.186 -2.894 . . . . 0.0 103.186 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 48.5 m -135.5 134.62 39.69 Favored 'General case' 0 C--N 1.371 1.523 0 O-C-N 119.049 -2.282 . . . . 0.0 105.248 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.485 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 14.9 m -66.48 166.46 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.572 0 C-N-CA 125.385 1.474 . . . . 0.0 111.936 177.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.371 24.4 p -67.45 63.19 0.07 Allowed 'General case' 0 C--N 1.35 0.63 0 N-CA-C 116.984 2.216 . . . . 0.0 116.984 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -24.43 -47.0 0.09 OUTLIER Pre-proline 0 C--N 1.353 0.756 1 C-N-CA 137.356 6.262 . . . . 0.0 118.988 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -73.72 53.06 2.66 Favored 'Trans proline' 0 CA--C 1.566 2.109 0 C-N-CA 123.718 2.945 . . . . 0.0 113.364 176.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -159.23 152.34 22.22 Favored 'General case' 0 C--N 1.364 1.199 0 C-N-CA 126.914 2.086 . . . . 0.0 110.706 -175.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -126.09 11.25 7.61 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 120.472 1.487 . . . . 0.0 112.465 170.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.314 0.0 OUTLIER -95.34 2.83 54.81 Favored 'General case' 0 C--N 1.364 1.215 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 -176.361 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.536 ' HB2' ' HD3' ' A' ' 125' ' ' LYS 0.53 0.0 OUTLIER -45.66 149.75 0.57 Allowed 'General case' 0 C--N 1.353 0.741 1 N-CA-C 122.074 4.101 . . . . 0.0 122.074 178.427 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.708 ' H ' ' HD3' ' A' ' 127' ' ' PRO 0.816 10.8 mmtt 125.01 92.79 0.0 OUTLIER 'General case' 0 N--CA 1.427 -1.594 1 C-N-CA 134.606 5.162 . . . . 0.0 103.787 169.766 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.414 ' H ' ' HD2' ' A' ' 127' ' ' PRO . 17.8 t70 112.51 13.48 0.0 OUTLIER Pre-proline 0 CA--C 1.592 2.572 1 C-N-CA 131.706 4.002 . . . . 0.0 113.49 -156.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.708 ' HD3' ' H ' ' A' ' 125' ' ' LYS . 85.0 Cg_endo -63.88 -175.44 0.29 Allowed 'Trans proline' 0 C--N 1.387 2.556 2 C-N-CA 127.987 5.791 . . . . 0.0 119.364 175.23 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 38.4 m -101.99 164.52 11.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 109.905 -3.316 . . . . 0.0 104.467 170.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 43' ' ' LEU . 5.8 mp -102.48 143.5 32.11 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 102.406 -3.183 . . . . 0.0 102.406 171.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.02 53.99 1.97 Allowed 'General case' 0 CA--C 1.484 -1.583 0 N-CA-C 104.243 -2.503 . . . . 0.0 104.243 -170.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 1.8 m 147.28 104.2 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.249 0 N-CA-C 104.587 -2.375 . . . . 0.0 104.587 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.547 ' H ' ' HA ' ' A' ' 45' ' ' TYR . 7.9 tpt180 -117.39 112.76 21.12 Favored 'General case' 0 N--CA 1.439 -0.992 1 N-CA-C 99.667 -4.198 . . . . 0.0 99.667 166.953 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.0 ttt -109.07 126.83 53.58 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.28 114.91 17.51 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 171.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.481 HD11 ' CB ' ' A' ' 49' ' ' LEU . 0.5 OUTLIER -137.57 157.58 33.83 Favored 'Isoleucine or valine' 0 C--N 1.357 0.923 0 C-N-CA 126.205 1.802 . . . . 0.0 108.092 178.845 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.662 HD11 HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -142.08 175.08 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.882 0 N-CA-C 100.546 -3.872 . . . . 0.0 100.546 173.177 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -115.08 137.86 51.53 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 129.592 3.157 . . . . 0.0 106.194 168.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.468 ' HB3' ' HG3' ' A' ' 139' ' ' ARG . 17.5 m -140.63 -127.09 0.1 Allowed 'General case' 0 CA--C 1.502 -0.875 0 CA-C-N 121.009 1.731 . . . . 0.0 112.872 -178.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.599 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -92.82 -85.11 0.27 Allowed 'General case' 0 N--CA 1.428 -1.55 1 C-N-CA 134.184 4.994 . . . . 0.0 105.671 179.97 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.599 ' HG2' ' HD3' ' A' ' 139' ' ' ARG . 5.5 ptp180 -94.23 -9.06 37.43 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 128.376 2.67 . . . . 0.0 112.907 174.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.642 HD23 ' CG ' ' A' ' 57' ' ' GLU 0.508 0.4 OUTLIER -69.65 115.52 33.95 Favored Pre-proline 0 C--N 1.382 1.984 0 C-N-CA 129.407 3.083 . . . . 0.0 110.315 -177.688 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -88.1 109.3 0.61 Allowed 'Trans proline' 0 C--N 1.297 -2.173 0 CA-C-N 122.244 1.837 . . . . 0.0 113.479 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -176.86 66.88 0.09 OUTLIER Glycine 0 N--CA 1.477 1.432 0 N-CA-C 117.803 1.881 . . . . 0.0 117.803 163.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.09 114.03 7.0 Favored 'General case' 0 C--N 1.367 1.357 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -175.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 175.1 -173.81 0.08 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 131.437 3.895 . . . . 0.0 101.739 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . 0.314 74.1 m 149.92 134.35 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 129.245 3.018 . . . . 0.0 112.984 174.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 81.7 tttt 177.91 178.83 0.33 Allowed 'General case' 0 C--N 1.368 1.399 1 N-CA-C 99.714 -4.18 . . . . 0.0 99.714 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 59.81 118.42 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.969 1 N-CA-C 124.405 4.965 . . . . 0.0 124.405 156.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 38.2 t -112.62 110.62 32.86 Favored 'Isoleucine or valine' 0 C--N 1.37 1.466 0 O-C-N 118.712 -2.493 . . . . 0.0 115.784 -174.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.762 HD11 ' HE1' ' A' ' 73' ' ' HIS . 0.1 OUTLIER -129.55 117.48 42.49 Favored 'Isoleucine or valine' 0 C--N 1.359 1.006 0 C-N-CA 127.803 2.441 . . . . 0.0 106.483 173.431 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.406 ' HD3' HG22 ' A' ' 152' ' ' THR 0.5 0.0 OUTLIER -122.69 153.88 38.82 Favored 'General case' 0 CA--C 1.478 -1.818 1 C-N-CA 132.527 4.331 . . . . 0.0 104.652 167.956 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.412 ' HB ' ' CD2' ' A' ' 73' ' ' HIS 0.339 9.2 t -70.65 97.9 1.42 Allowed 'General case' 0 N--CA 1.431 -1.375 1 CA-C-O 131.763 5.554 . . . . 0.0 117.932 -150.787 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.591 HE22 ' CE1' ' A' ' 73' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.42 -1.958 3 C-N-CA 148.359 10.663 . . . . 0.0 121.009 166.411 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ptt? . . . . . 0 C--O 1.233 0.21 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.3 m -156.82 133.29 9.97 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 175.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.3 mm -90.34 50.41 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.368 1.382 0 O-C-N 119.4 -2.062 . . . . 0.0 111.504 -175.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.408 ' HA ' HG13 ' A' ' 7' ' ' VAL . 5.1 t-20 -49.41 -3.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.969 1 C-N-CA 135.435 5.494 . . . . 0.0 118.252 -175.169 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -60.81 2.05 Favored 'General case' 0 C--N 1.353 0.72 1 C-N-CA 133.602 4.761 . . . . 0.0 110.253 171.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -73.17 -17.28 61.39 Favored 'General case' 0 C--N 1.373 1.588 0 C-N-CA 126.815 2.046 . . . . 0.0 112.571 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.408 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.253 0.6 OUTLIER -80.7 -36.61 15.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.869 0 C-N-CA 127.133 2.173 . . . . 0.0 110.598 175.153 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -64.63 -46.25 83.39 Favored 'General case' 0 C--N 1.375 1.674 0 C-N-CA 128.344 2.657 . . . . 0.0 108.657 175.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 24.8 mt -54.59 -43.47 65.08 Favored 'Isoleucine or valine' 0 C--N 1.362 1.118 0 C-N-CA 126.279 1.831 . . . . 0.0 112.968 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.38 11.0 ttt180 -67.48 -42.91 82.2 Favored 'General case' 0 CA--C 1.565 1.537 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 171.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -60.27 -27.52 67.32 Favored 'General case' 0 C--N 1.381 1.94 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 165.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -76.91 -50.72 12.66 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 130.315 3.446 . . . . 0.0 109.99 173.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.4 mmtt -57.25 -29.22 63.63 Favored 'General case' 0 C--N 1.378 1.814 0 C-N-CA 128.234 2.614 . . . . 0.0 110.666 170.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' A' ' 54' ' ' ILE . 4.0 tp -72.08 -44.14 63.72 Favored 'General case' 0 C--N 1.365 1.262 0 C-N-CA 124.319 1.048 . . . . 0.0 113.664 168.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -54.9 -43.66 73.46 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.319 -1.488 . . . . 0.0 110.607 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.2 mtp85 -63.39 -46.1 87.99 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 166.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -58.38 -47.84 82.55 Favored 'General case' 0 C--N 1.384 2.077 0 C-N-CA 130.111 3.364 . . . . 0.0 113.268 175.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.613 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -63.91 -46.71 83.6 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 130.407 3.483 . . . . 0.0 110.732 176.212 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.93 -42.66 57.29 Favored 'General case' 0 C--N 1.377 1.765 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.7 m -68.31 -43.09 78.4 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 127.023 2.129 . . . . 0.0 112.281 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.63 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.409 43.8 mt-10 -74.55 -28.72 61.07 Favored 'General case' 0 C--N 1.364 1.208 0 O-C-N 120.442 -1.411 . . . . 0.0 112.223 169.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.256 0.6 OUTLIER -60.71 -34.07 73.83 Favored 'General case' 0 C--N 1.38 1.924 0 O-C-N 119.035 -2.291 . . . . 0.0 112.978 165.384 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.7 mtt85 -66.23 -35.81 81.38 Favored 'General case' 0 C--N 1.369 1.442 0 O-C-N 120.648 -1.283 . . . . 0.0 112.101 166.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.44 ' CG ' ' CE1' ' A' ' 68' ' ' HIS . 8.6 tp-100 -60.8 -46.74 89.32 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 116.879 2.178 . . . . 0.0 116.879 166.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.534 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.2 mt -70.98 -45.07 74.81 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 O-C-N 120.657 -1.277 . . . . 0.0 111.756 178.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.646 0.5 OUTLIER -71.28 -23.68 62.01 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 119.346 -2.097 . . . . 0.0 114.929 175.203 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -73.11 -35.2 66.53 Favored 'General case' 0 C--N 1.384 2.085 0 O-C-N 121.244 -0.91 . . . . 0.0 110.822 169.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -66.51 -39.74 88.84 Favored 'General case' 0 C--N 1.391 2.408 0 O-C-N 119.127 -2.233 . . . . 0.0 112.002 169.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.469 HG13 HG22 ' A' ' 74' ' ' VAL . 1.4 mp -61.99 -46.32 96.75 Favored 'Isoleucine or valine' 0 C--N 1.37 1.457 0 CA-C-N 119.52 1.055 . . . . 0.0 113.567 172.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 -59.46 -39.96 85.33 Favored 'General case' 0 C--N 1.357 0.92 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 173.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -76.49 -44.71 34.19 Favored 'General case' 0 CA--C 1.487 -1.45 0 O-C-N 119.428 -2.045 . . . . 0.0 111.183 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.88 -44.84 60.83 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 124.764 1.226 . . . . 0.0 114.031 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 6.2 t -69.38 -28.8 66.49 Favored 'General case' 0 C--N 1.351 0.649 0 O-C-N 120.106 -1.621 . . . . 0.0 110.899 175.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -75.75 -41.0 54.45 Favored 'General case' 0 C--N 1.389 2.309 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 165.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.22 -31.93 64.45 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 127.059 2.144 . . . . 0.0 114.809 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.67 -12.34 59.99 Favored 'General case' 0 C--N 1.382 1.99 0 O-C-N 121.107 -0.996 . . . . 0.0 111.691 166.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.66 18.16 60.58 Favored Glycine 0 C--N 1.381 3.065 0 O-C-N 120.813 -1.179 . . . . 0.0 114.813 168.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.523 ' HB ' HD12 ' A' ' 81' ' ' LEU 0.394 0.7 OUTLIER -99.2 178.88 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.363 1.168 0 C-N-CA 126.917 2.087 . . . . 0.0 110.344 -172.871 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 t -29.23 -55.11 0.14 Allowed 'General case' 0 N--CA 1.488 1.439 1 C-N-CA 132.127 4.171 . . . . 0.0 116.984 -174.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.29 3.2 t 82.46 111.65 0.06 Allowed 'General case' 0 C--N 1.359 1.009 0 C-N-CA 131.652 3.981 . . . . 0.0 108.638 -174.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.463 ' CZ ' HG11 ' A' ' 77' ' ' VAL . 3.9 p90 -113.24 158.42 20.51 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-O 122.347 1.07 . . . . 0.0 111.065 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -100.72 155.66 17.77 Favored 'General case' 0 C--N 1.349 0.57 0 C-N-CA 127.536 2.334 . . . . 0.0 105.371 175.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -119.34 126.02 50.43 Favored 'General case' 0 CA--C 1.505 -0.783 0 O-C-N 120.442 -1.411 . . . . 0.0 108.596 -174.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -115.27 169.92 8.77 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-O 124.298 1.999 . . . . 0.0 108.038 174.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.636 ' CD2' HD13 ' A' ' 50' ' ' LEU 0.293 14.1 m-30 -107.99 172.13 7.01 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.3 2.24 . . . . 0.0 108.623 176.209 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.34 91.36 3.49 Favored 'General case' 0 C--N 1.345 0.396 0 N-CA-C 101.963 -3.347 . . . . 0.0 101.963 153.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.488 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.321 0.0 OUTLIER -56.25 -10.46 0.88 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 127.631 2.373 . . . . 0.0 115.654 179.858 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.67 -38.74 28.47 Favored 'General case' 0 C--N 1.374 1.652 0 C-N-CA 129.031 2.932 . . . . 0.0 111.222 171.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.599 HD13 ' N ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -62.55 -46.07 90.04 Favored 'General case' 0 C--N 1.372 1.552 0 CA-C-O 125.297 2.475 . . . . 0.0 108.377 167.502 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.673 HD23 ' CG1' ' A' ' 54' ' ' ILE 0.298 0.1 OUTLIER -62.9 -37.54 87.35 Favored 'General case' 0 C--O 1.21 -1.017 0 C-N-CA 127.474 2.31 . . . . 0.0 110.192 172.534 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -54.91 -32.74 61.42 Favored 'General case' 0 C--N 1.37 1.472 0 O-C-N 117.603 -3.186 . . . . 0.0 111.876 168.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -74.94 -58.01 3.55 Favored 'General case' 0 C--N 1.38 1.895 0 N-CA-C 116.387 1.995 . . . . 0.0 116.387 158.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.4 -27.47 66.02 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 119.096 2.999 . . . . 0.0 119.096 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.673 ' CG1' HD23 ' A' ' 50' ' ' LEU . 29.8 mt -75.15 -48.62 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.761 0 C-N-CA 129.977 3.311 . . . . 0.0 110.709 172.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.594 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -106.62 -12.12 15.66 Favored 'General case' 0 C--N 1.366 1.301 0 N-CA-C 119.737 3.236 . . . . 0.0 119.737 -176.443 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -78.44 -3.5 43.66 Favored 'General case' 0 C--N 1.365 1.261 0 CA-C-N 122.347 2.339 . . . . 0.0 114.305 -174.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -157.86 -48.99 0.06 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.766 1.626 . . . . 0.0 111.346 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.594 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.542 0.2 OUTLIER 83.59 160.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.372 1.587 1 C-N-CA 131.97 4.108 . . . . 0.0 112.036 178.142 . . . . . . . . 5 4 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.537 ' N ' HD22 ' A' ' 14' ' ' LEU . 13.5 t70 38.14 54.29 1.7 Allowed 'General case' 0 N--CA 1.513 2.685 0 C-N-CA 131.465 3.906 . . . . 0.0 114.642 -176.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.625 ' HA ' HH22 ' A' ' 139' ' ' ARG 0.484 10.4 pt-20 -75.92 66.03 2.09 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 125.499 2.571 . . . . 0.0 113.822 178.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.374 18.2 p -79.26 -16.85 55.82 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.925 2.89 . . . . 0.0 114.108 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -65.55 -33.95 77.12 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 129.652 3.181 . . . . 0.0 110.188 166.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -65.77 -46.68 88.24 Favored 'Isoleucine or valine' 0 C--N 1.362 1.116 0 C-N-CA 127.567 2.347 . . . . 0.0 109.888 -174.403 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.63 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 48.7 m-85 -62.41 -39.54 93.6 Favored 'General case' 0 C--O 1.21 -0.996 1 C-N-CA 132.572 4.349 . . . . 0.0 112.473 168.031 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -66.53 -45.41 79.54 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.724 2.056 . . . . 0.0 112.787 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.662 HD12 HD21 ' A' ' 111' ' ' LEU . 1.9 tm? -64.79 -49.3 71.22 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.974 1.309 . . . . 0.0 113.104 168.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.455 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.883 0.0 OUTLIER -76.38 -16.55 59.69 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 118.818 -2.426 . . . . 0.0 114.996 -176.908 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.534 ' CE1' HG12 ' A' ' 25' ' ' ILE . 54.5 m-70 -78.69 -27.57 45.1 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 127.729 2.412 . . . . 0.0 110.249 162.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -79.92 -18.98 49.15 Favored 'General case' 0 C--N 1.366 1.317 0 O-C-N 119.578 -1.951 . . . . 0.0 111.972 166.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.282 0.0 OUTLIER -97.62 -16.23 7.17 Favored 'Isoleucine or valine' 0 C--N 1.369 1.444 0 C-N-CA 127.168 2.187 . . . . 0.0 114.052 -177.348 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.3 pttm -52.15 -4.12 0.03 OUTLIER 'General case' 0 C--N 1.363 1.161 1 C-N-CA 133.973 4.909 . . . . 0.0 119.536 -175.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.262 29.7 t70 -95.77 -3.92 44.89 Favored 'General case' 0 N--CA 1.416 -2.146 1 C-N-CA 133.261 4.624 . . . . 0.0 108.373 178.783 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.44 ' CE1' HD13 ' A' ' 106' ' ' ILE . 0.2 OUTLIER -57.56 -8.24 0.81 Allowed 'General case' 0 C--N 1.385 2.113 0 C-N-CA 130.282 3.433 . . . . 0.0 114.149 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.469 HG22 HG13 ' A' ' 29' ' ' ILE . 40.3 t -42.05 -32.04 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 128.654 2.782 . . . . 0.0 115.225 157.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.52 -37.46 50.89 Favored 'General case' 0 C--N 1.379 1.853 0 C-N-CA 127.856 2.462 . . . . 0.0 113.326 174.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -71.08 -35.81 72.0 Favored 'General case' 0 N--CA 1.482 1.148 0 O-C-N 119.471 -2.018 . . . . 0.0 111.21 172.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.463 HG11 ' CZ ' ' A' ' 41' ' ' PHE 0.541 16.4 t -72.33 -28.55 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.581 2.16 0 C-N-CA 129.933 3.293 . . . . 0.0 112.199 173.254 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.406 ' ND2' HG11 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -67.01 -43.89 81.72 Favored 'General case' 0 C--N 1.379 1.876 0 C-N-CA 129.914 3.286 . . . . 0.0 111.278 168.301 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -63.45 -35.77 81.54 Favored 'General case' 0 C--N 1.381 1.973 0 C-N-CA 126.273 1.829 . . . . 0.0 112.182 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.32 -39.14 89.41 Favored 'General case' 0 C--N 1.374 1.644 0 C-N-CA 127.023 2.129 . . . . 0.0 114.539 169.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.523 HD12 ' HB ' ' A' ' 38' ' ' VAL . 2.4 tm? -75.15 -13.91 60.51 Favored 'General case' 0 C--N 1.373 1.591 0 C-N-CA 130.464 3.506 . . . . 0.0 113.559 173.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . 0.307 22.6 p -75.45 -1.48 24.24 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 118.617 2.821 . . . . 0.0 118.617 -171.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.78 144.93 29.27 Favored Pre-proline 0 C--N 1.359 0.988 0 O-C-N 121.049 -1.032 . . . . 0.0 109.887 175.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -64.86 157.17 58.0 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 124.981 3.787 . . . . 0.0 110.291 166.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . 0.281 1.1 Cg_endo -48.83 144.72 14.48 Favored 'Trans proline' 0 C--N 1.36 1.154 1 C-N-CA 125.528 4.152 . . . . 0.0 122.446 -152.469 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 91.4 mtm-85 -114.69 80.94 6.73 Favored Pre-proline 0 C--N 1.361 1.083 0 N-CA-C 114.591 1.33 . . . . 0.0 114.591 177.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -71.9 163.52 38.57 Favored 'Trans proline' 0 C--N 1.36 1.175 1 C-N-CA 128.25 5.967 . . . . 0.0 111.545 168.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -47.57 -22.46 0.49 Allowed 'General case' 0 C--N 1.357 0.914 1 C-N-CA 133.477 4.711 . . . . 0.0 116.491 177.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.2 pt -94.39 87.49 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.905 0 C-N-CA 131.4 3.88 . . . . 0.0 108.543 170.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.42 -8.08 48.12 Favored 'General case' 0 C--N 1.315 -0.901 2 CA-C-N 106.505 -4.861 . . . . 0.0 109.687 170.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -98.24 -31.94 11.81 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 126.268 1.827 . . . . 0.0 115.204 177.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -98.05 -10.94 23.52 Favored 'General case' 0 C--N 1.35 0.603 0 O-C-N 121.342 -0.849 . . . . 0.0 113.048 -177.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -125.38 -51.47 1.63 Allowed 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 -176.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.786 HG23 ' CG1' ' A' ' 97' ' ' VAL 0.299 87.3 mt -78.81 94.3 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 CA-C-O 127.208 3.385 . . . . 0.0 114.355 -172.766 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -139.24 -38.0 0.5 Allowed 'General case' 0 CA--C 1.491 -1.308 1 CA-C-N 107.332 -4.485 . . . . 0.0 110.038 -173.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.51 7.05 65.75 Favored Glycine 0 C--N 1.359 1.845 0 C-N-CA 124.142 0.877 . . . . 0.0 110.943 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.786 ' CG1' HG23 ' A' ' 94' ' ' ILE 0.396 11.3 p -113.41 90.73 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.359 1.006 0 CA-C-O 125.724 2.678 . . . . 0.0 111.248 178.258 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -135.07 16.98 3.47 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 110.643 -2.98 . . . . 0.0 106.221 176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -123.29 -51.74 1.86 Allowed 'General case' 0 C--N 1.346 0.44 0 C-N-CA 126.524 1.93 . . . . 0.0 113.19 -173.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 14.4 mtt-85 -99.5 115.84 65.37 Favored Pre-proline 0 C--N 1.358 0.975 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -170.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -76.2 156.01 37.61 Favored 'Trans proline' 0 C--N 1.363 1.33 1 C-N-CA 125.314 4.009 . . . . 0.0 111.987 171.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.53 -9.94 82.3 Favored Glycine 0 C--N 1.365 2.173 0 C-N-CA 127.062 2.268 . . . . 0.0 117.518 -173.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -141.31 155.14 46.0 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 126.363 1.865 . . . . 0.0 107.483 173.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 6.0 mt -110.66 140.46 44.99 Favored 'General case' 0 C--N 1.348 0.505 0 C-N-CA 127.011 2.125 . . . . 0.0 110.034 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -129.29 110.85 12.29 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 103.877 -2.638 . . . . 0.0 103.877 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.44 HD13 ' CE1' ' A' ' 73' ' ' HIS . 13.9 pt -134.9 139.68 46.91 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 -177.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.4 m -126.69 111.16 13.95 Favored 'General case' 0 C--N 1.367 1.339 0 N-CA-C 104.234 -2.506 . . . . 0.0 104.234 -176.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' A' ' 150' ' ' ILE . 4.0 t0 -136.78 161.18 36.68 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 103.618 -2.734 . . . . 0.0 103.618 -171.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.502 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 82.65 -58.01 5.02 Favored Glycine 0 N--CA 1.484 1.846 0 O-C-N 120.072 -1.642 . . . . 0.0 116.837 169.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 162.11 -29.77 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.276 1 C-N-CA 136.344 5.858 . . . . 0.0 106.691 -167.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.693 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.588 0.9 OUTLIER -79.67 137.42 37.07 Favored 'General case' 0 C--N 1.375 1.714 2 C-N-CA 132.33 4.252 . . . . 0.0 122.131 -176.858 . . . . . . . . 5 4 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -89.74 101.21 13.91 Favored 'General case' 0 CA--C 1.559 1.296 0 N-CA-C 103.668 -2.716 . . . . 0.0 103.668 171.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.343 22.8 mt -94.23 137.49 33.34 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.1 2.16 . . . . 0.0 106.404 -178.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -123.82 132.69 8.51 Favored Glycine 0 C--N 1.349 1.268 0 O-C-N 119.761 -1.837 . . . . 0.0 110.372 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . 0.266 1.7 m-30 -120.47 140.13 51.86 Favored 'General case' 0 C--N 1.368 1.408 0 N-CA-C 101.407 -3.553 . . . . 0.0 101.407 172.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 92.5 m -124.82 151.84 44.7 Favored 'General case' 0 CA--C 1.49 -1.347 1 N-CA-C 99.833 -4.136 . . . . 0.0 99.833 171.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 118' ' ' CYS . 45.4 t -74.33 156.61 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 126.47 1.908 . . . . 0.0 107.931 169.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.545 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.29 72.2 m -68.54 95.49 0.64 Allowed 'General case' 0 C--N 1.362 1.133 0 CA-C-O 123.849 1.785 . . . . 0.0 109.097 164.76 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -71.94 -40.09 7.58 Favored Pre-proline 0 N--CA 1.432 -1.374 0 C-N-CA 130.795 3.638 . . . . 0.0 112.875 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -74.29 59.74 4.69 Favored 'Trans proline' 0 CA--C 1.559 1.73 0 CA-C-N 127.028 3.546 . . . . 0.0 114.122 174.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.361 4.3 p30 -162.54 -80.55 0.04 OUTLIER 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.405 2.282 . . . . 0.0 110.502 173.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . 0.403 23.9 tt0 19.52 88.29 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.7 2 C-N-CA 137.796 6.438 . . . . 0.0 122.498 -174.741 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -118.66 0.51 11.51 Favored 'General case' 0 C--N 1.36 1.043 0 C-N-CA 129.821 3.248 . . . . 0.0 107.661 174.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -114.88 -144.46 0.39 Allowed 'General case' 0 C--N 1.349 0.567 0 C-N-CA 128.298 2.639 . . . . 0.0 112.791 -165.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.264 7.9 mptt -116.84 -73.72 0.63 Allowed 'General case' 0 C--N 1.365 1.248 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 -178.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -152.98 92.03 3.36 Favored Pre-proline 0 C--N 1.353 0.752 0 CA-C-O 112.797 -3.478 . . . . 0.0 109.427 171.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -125.59 17.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.243 1 CA-C-N 130.678 4.849 . . . . 0.0 120.615 -174.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.6 t -147.56 148.21 30.91 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 102.586 -3.116 . . . . 0.0 102.586 156.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.2 mt -103.32 133.11 48.94 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 170.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.545 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 20.8 tt0 -91.29 44.04 1.17 Allowed 'General case' 0 C--N 1.369 1.427 0 CA-C-N 122.247 2.294 . . . . 0.0 112.355 -173.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 30.7 p 129.13 140.39 0.0 OUTLIER 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 129.087 2.955 . . . . 0.0 106.748 -175.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.8 ttm180 -116.02 109.54 17.67 Favored 'General case' 0 N--CA 1.441 -0.914 1 N-CA-C 97.407 -5.034 . . . . 0.0 97.407 157.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.17 132.07 40.52 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 127.501 2.321 . . . . 0.0 107.662 -176.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.16 115.03 17.07 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.8 mt -141.58 129.78 22.35 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 CA-C-O 123.868 1.794 . . . . 0.0 106.397 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.693 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -118.88 179.39 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-O 124.829 2.252 . . . . 0.0 114.27 -170.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.65 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.7 OUTLIER -143.5 136.07 27.27 Favored 'General case' 0 N--CA 1.442 -0.846 2 C-N-CA 134.994 5.318 . . . . 0.0 98.251 171.068 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.592 ' HB2' ' HG ' ' A' ' 141' ' ' LEU . 1.0 OUTLIER -158.71 -110.45 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -169.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.625 HH22 ' HA ' ' A' ' 60' ' ' GLU . 0.0 OUTLIER -113.04 -83.68 0.59 Allowed 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.184 2.593 . . . . 0.0 111.041 -166.403 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.617 ' H ' ' CG ' ' A' ' 139' ' ' ARG . 1.0 OUTLIER -86.16 7.84 23.37 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 131.556 3.942 . . . . 0.0 109.695 169.161 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 138' ' ' SER . 0.2 OUTLIER -76.56 163.65 64.59 Favored Pre-proline 0 CA--C 1.572 1.827 0 CA-C-O 115.82 -2.038 . . . . 0.0 106.741 -169.364 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.57 ' HD2' HD13 ' A' ' 141' ' ' LEU . 19.9 Cg_exo -51.57 -33.84 49.88 Favored 'Trans proline' 0 N--CA 1.477 0.534 3 C-N-CA 125.736 4.291 . . . . 0.0 122.686 179.221 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -174.55 -163.05 27.18 Favored Glycine 0 N--CA 1.432 -1.61 0 C-N-CA 126.198 1.856 . . . . 0.0 109.898 -177.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -120.79 149.42 42.58 Favored 'General case' 0 N--CA 1.433 -1.322 1 C-N-CA 134.209 5.004 . . . . 0.0 111.555 -176.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -126.68 -154.96 0.66 Allowed 'General case' 0 C--N 1.357 0.894 0 C-N-CA 128.446 2.698 . . . . 0.0 110.208 -179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 83.5 p -98.69 -138.38 0.3 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 126.608 1.963 . . . . 0.0 112.668 -177.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -165.35 109.47 0.86 Allowed 'General case' 0 C--N 1.359 0.998 0 O-C-N 119.59 -1.944 . . . . 0.0 108.504 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.331 . . -135.5 32.4 3.07 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 29.3 m -66.69 116.31 5.78 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.072 1 C-N-CA 133.95 4.9 . . . . 0.0 118.199 -169.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 108' ' ' ASP . 1.4 pt -94.37 143.32 11.94 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 C-N-CA 130.411 3.484 . . . . 0.0 106.455 170.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.412 46.4 mtpt -120.56 148.67 43.56 Favored 'General case' 0 CA--C 1.496 -1.115 1 N-CA-C 96.977 -5.194 . . . . 0.0 96.977 162.804 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 6.4 t -74.61 144.06 44.08 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 121.035 3.717 . . . . 0.0 121.035 -131.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 . . . . . 0 C--O 1.264 1.852 2 CA-C-N 105.926 -5.125 . . . . 0.0 110.655 -172.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.8 mtt . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.0 m -69.5 117.74 11.5 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 126.842 2.057 . . . . 0.0 113.755 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.8 mm -81.27 66.61 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.31 0 CA-C-O 125.054 2.359 . . . . 0.0 113.006 -177.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.447 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 6.2 t-20 -97.47 9.37 42.56 Favored 'General case' 0 C--O 1.222 -0.363 1 C-N-CA 133.533 4.733 . . . . 0.0 109.442 178.154 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -64.7 0.84 Allowed 'General case' 0 C--N 1.355 0.826 0 C-N-CA 130.583 3.553 . . . . 0.0 112.058 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -71.45 -12.02 61.18 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 125.554 1.541 . . . . 0.0 113.241 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.447 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 0.6 OUTLIER -81.2 -39.31 17.32 Favored 'Isoleucine or valine' 0 C--N 1.36 1.047 0 C-N-CA 127.829 2.452 . . . . 0.0 110.22 174.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -66.1 -42.81 88.76 Favored 'General case' 0 C--N 1.371 1.505 0 C-N-CA 129.047 2.939 . . . . 0.0 109.114 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.2 -43.36 89.45 Favored 'Isoleucine or valine' 0 C--N 1.377 1.766 0 C-N-CA 125.348 1.459 . . . . 0.0 111.297 165.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.25 0.0 OUTLIER -58.52 -50.61 73.15 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 169.52 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -56.34 -26.14 51.54 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 117.915 -2.991 . . . . 0.0 115.404 166.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -77.12 -38.23 52.57 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 118.928 -2.358 . . . . 0.0 113.731 165.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.609 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 8.4 mmmt -65.07 -27.78 69.01 Favored 'General case' 0 C--N 1.372 1.557 1 CA-C-O 129.078 4.275 . . . . 0.0 107.376 170.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.594 HD12 HG13 ' A' ' 54' ' ' ILE . 0.3 OUTLIER -71.55 -46.38 59.65 Favored 'General case' 0 C--O 1.206 -1.219 0 O-C-N 116.634 -3.791 . . . . 0.0 112.479 166.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -55.76 -27.6 51.67 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.632 2.086 . . . . 0.0 116.632 167.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.609 ' HG3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -69.88 -49.79 48.82 Favored 'General case' 0 C--N 1.397 2.647 0 CA-C-N 121.842 2.11 . . . . 0.0 112.896 168.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.419 ' CD2' ' HB ' ' A' ' 61' ' ' THR . 0.1 OUTLIER -82.55 -28.67 30.83 Favored 'General case' 0 C--N 1.364 1.218 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -177.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -67.67 -53.92 23.81 Favored 'General case' 0 C--O 1.204 -1.339 0 C-N-CA 127.746 2.418 . . . . 0.0 106.547 172.45 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -74.14 -39.77 63.06 Favored 'General case' 0 C--N 1.363 1.186 0 N-CA-C 119.969 3.322 . . . . 0.0 119.969 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.5 t -73.21 -41.94 63.21 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.531 -1.356 . . . . 0.0 113.858 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . 0.522 3.4 tt0 -77.86 -28.51 50.07 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 120.109 -1.62 . . . . 0.0 112.803 176.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.688 ' HB2' ' O ' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -72.6 -27.81 62.4 Favored 'General case' 0 C--N 1.381 1.955 0 O-C-N 118.772 -2.455 . . . . 0.0 112.828 170.152 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.8 mtt85 -66.93 -36.84 83.14 Favored 'General case' 0 C--N 1.378 1.807 0 C-N-CA 125.612 1.565 . . . . 0.0 110.156 164.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -63.02 -43.02 99.89 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.444 HG22 HD12 ' A' ' 29' ' ' ILE . 8.0 mt -69.83 -45.34 77.45 Favored 'Isoleucine or valine' 0 C--N 1.368 1.396 0 CA-C-N 120.009 1.277 . . . . 0.0 111.859 173.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.526 13.2 p30 -69.12 -24.22 64.09 Favored 'General case' 0 C--N 1.379 1.883 0 O-C-N 119.842 -1.786 . . . . 0.0 115.335 177.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -73.84 -47.21 40.01 Favored 'General case' 0 C--N 1.378 1.839 0 C-N-CA 126.926 2.09 . . . . 0.0 110.044 169.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -30.9 70.94 Favored 'General case' 0 C--N 1.398 2.716 0 O-C-N 117.697 -3.127 . . . . 0.0 112.95 174.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.444 HD12 HG22 ' A' ' 25' ' ' ILE . 3.2 mt -63.3 -48.63 86.51 Favored 'Isoleucine or valine' 0 C--N 1.378 1.835 0 C-N-CA 124.675 1.19 . . . . 0.0 112.508 171.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.4 ttt85 -64.37 -37.87 89.03 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 122.34 2.336 . . . . 0.0 115.465 176.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -76.5 -38.16 55.66 Favored 'General case' 0 CA--C 1.473 -1.984 0 C-N-CA 127.157 2.183 . . . . 0.0 112.344 -177.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.56 -43.51 14.43 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 176.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.605 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.391 1.5 p -66.79 -30.73 71.01 Favored 'General case' 0 C--N 1.359 1.01 0 O-C-N 120.583 -1.323 . . . . 0.0 112.85 -179.377 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -72.04 -46.58 56.47 Favored 'General case' 0 C--N 1.375 1.68 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 162.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.72 -26.16 66.02 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 116.058 1.873 . . . . 0.0 116.058 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.57 -14.49 62.87 Favored 'General case' 0 C--N 1.376 1.738 0 C-N-CA 127.031 2.132 . . . . 0.0 112.489 166.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.41 17.63 30.81 Favored Glycine 0 C--N 1.377 2.826 0 O-C-N 121.317 -0.864 . . . . 0.0 113.291 169.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.673 HG23 HD22 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -115.82 164.1 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 -176.479 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.703 ' HB2' HD11 ' A' ' 81' ' ' LEU 0.308 0.3 OUTLIER -26.4 -57.52 0.08 Allowed 'General case' 0 C--N 1.361 1.105 1 C-N-CA 133.764 4.826 . . . . 0.0 119.429 -175.441 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.8 t 103.47 122.19 0.01 OUTLIER 'General case' 0 C--N 1.352 0.686 1 C-N-CA 132.103 4.161 . . . . 0.0 107.263 -172.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -113.65 160.53 18.5 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-O 123.037 1.399 . . . . 0.0 112.558 -173.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -110.79 145.76 37.57 Favored 'General case' 0 C--N 1.352 0.681 0 C-N-CA 127.319 2.248 . . . . 0.0 109.481 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' ' 129' ' ' LEU . 15.8 tp -126.35 154.89 42.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 118.897 -2.377 . . . . 0.0 106.665 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -132.37 172.66 12.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 O-C-N 120.202 -1.561 . . . . 0.0 111.016 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.659 ' CD2' HD13 ' A' ' 50' ' ' LEU 0.269 4.3 m-30 -93.49 172.02 8.53 Favored 'General case' 0 CA--C 1.558 1.262 0 CA-C-O 123.125 1.44 . . . . 0.0 109.197 168.17 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.3 t -127.03 98.62 5.39 Favored 'General case' 0 C--N 1.349 0.551 0 N-CA-C 101.562 -3.495 . . . . 0.0 101.562 157.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 50' ' ' LEU 0.486 0.0 OUTLIER -61.58 -10.54 8.37 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 117.76 2.504 . . . . 0.0 117.76 -177.217 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.05 -46.6 13.69 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.851 2.46 . . . . 0.0 111.001 171.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.634 HD13 ' N ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -60.36 -48.49 81.53 Favored 'General case' 0 C--N 1.373 1.625 0 C-N-CA 127.401 2.28 . . . . 0.0 110.153 170.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.659 HD13 ' CD2' ' A' ' 45' ' ' TYR 0.252 6.2 tt -64.25 -33.4 75.72 Favored 'General case' 0 C--O 1.211 -0.967 0 CA-C-N 112.54 -2.118 . . . . 0.0 112.553 172.56 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -56.82 -30.09 63.4 Favored 'General case' 0 C--N 1.368 1.395 0 CA-C-N 121.033 1.742 . . . . 0.0 112.109 166.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -84.29 -45.14 13.14 Favored 'General case' 0 C--N 1.371 1.502 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 162.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.24 75.18 Favored 'General case' 0 C--N 1.371 1.501 0 CA-C-N 123.05 2.659 . . . . 0.0 114.005 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.594 HG13 HD12 ' A' ' 14' ' ' LEU . 1.2 tt -48.51 -34.45 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 131.075 3.75 . . . . 0.0 116.658 177.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HA ' HG22 ' A' ' 58' ' ' ILE . 9.8 mt-30 -92.16 -9.44 42.41 Favored 'General case' 0 C--N 1.362 1.127 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 173.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -94.28 -47.22 6.71 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 127.213 2.205 . . . . 0.0 108.733 174.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.652 ' HG2' HD11 ' A' ' 136' ' ' ILE . 28.2 mt-10 -85.86 -3.27 58.87 Favored 'General case' 0 CA--C 1.492 -1.287 1 C-N-CA 132.003 4.121 . . . . 0.0 117.997 -176.822 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.447 ' HA ' ' HB2' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -17.82 -3.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.063 2 N-CA-C 125.71 5.448 . . . . 0.0 125.71 -177.738 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.446 ' N ' HD13 ' A' ' 58' ' ' ILE . 44.6 t0 142.86 37.91 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.5 1 C-N-CA 134.798 5.239 . . . . 0.0 105.15 -166.235 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . 0.323 54.7 mm-40 -89.67 85.36 6.43 Favored 'General case' 0 CA--C 1.472 -2.032 0 C-N-CA 131.142 3.777 . . . . 0.0 105.933 175.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.419 ' HB ' ' CD2' ' A' ' 17' ' ' HIS 0.475 0.1 OUTLIER -79.7 -11.32 59.86 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 127.908 2.483 . . . . 0.0 114.086 176.021 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.655 ' HE2' HG21 ' A' ' 136' ' ' ILE 0.281 0.7 OUTLIER -61.83 -34.76 76.53 Favored 'General case' 0 N--CA 1.479 1.021 1 C-N-CA 133.896 4.878 . . . . 0.0 111.347 169.233 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.446 HG22 ' CD1' ' A' ' 111' ' ' LEU 0.303 0.5 OUTLIER -73.42 -49.76 34.85 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 C-N-CA 131.373 3.869 . . . . 0.0 106.993 -167.313 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.556 ' HA ' ' CD2' ' A' ' 67' ' ' PHE 0.257 30.7 m-85 -71.23 -29.82 65.59 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 130.928 3.691 . . . . 0.0 112.899 168.5 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.1 -41.74 94.65 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 122.018 2.19 . . . . 0.0 112.185 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.688 HD11 ' HD3' ' A' ' 151' ' ' LYS . 1.9 tm? -64.17 -40.31 95.85 Favored 'General case' 0 CA--C 1.578 2.024 0 C-N-CA 126.246 1.818 . . . . 0.0 112.113 167.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.556 ' CD2' ' HA ' ' A' ' 64' ' ' PHE . 2.2 m-85 -74.36 -17.53 60.81 Favored 'General case' 0 C--N 1.378 1.83 0 O-C-N 117.925 -2.984 . . . . 0.0 113.351 174.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CD2' ' O ' ' A' ' 64' ' ' PHE 0.355 57.8 m-70 -85.83 -17.04 36.8 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 128.211 2.604 . . . . 0.0 109.671 172.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -75.25 -40.27 59.05 Favored 'General case' 0 C--N 1.371 1.513 0 CA-C-O 118.07 -0.967 . . . . 0.0 111.652 156.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 151' ' ' LYS . 1.6 mm -52.68 -46.24 49.69 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.787 0 C-N-CA 129.251 3.02 . . . . 0.0 114.617 172.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.6 pttp -50.66 -7.95 0.04 OUTLIER 'General case' 0 CA--C 1.491 -1.296 1 C-N-CA 132.591 4.356 . . . . 0.0 121.232 -160.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -106.62 -16.74 14.43 Favored 'General case' 0 N--CA 1.44 -0.975 0 O-C-N 119.932 -1.73 . . . . 0.0 107.854 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.842 ' CD2' ' HB ' ' A' ' 152' ' ' THR 0.286 1.0 OUTLIER -80.57 16.85 1.24 Allowed 'General case' 0 C--N 1.383 2.062 0 C-N-CA 128.229 2.611 . . . . 0.0 113.484 -178.497 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 78.6 t -40.2 -42.64 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.381 1.97 0 C-N-CA 129.658 3.183 . . . . 0.0 112.482 160.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.2 mp -60.64 -31.39 70.6 Favored 'General case' 0 C--N 1.364 1.217 0 C-N-CA 127.354 2.262 . . . . 0.0 116.205 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -76.25 -45.64 31.81 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 129.037 2.935 . . . . 0.0 113.139 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.363 4.9 p -66.3 -29.63 47.26 Favored 'Isoleucine or valine' 0 CA--C 1.585 2.321 0 CA-C-O 126.562 3.077 . . . . 0.0 111.221 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.605 HD21 ' HB2' ' A' ' 33' ' ' SER . 5.5 m120 -73.77 -31.37 63.27 Favored 'General case' 0 C--N 1.354 0.762 0 O-C-N 118.622 -2.548 . . . . 0.0 115.353 169.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -67.08 -30.51 70.57 Favored 'General case' 0 C--N 1.37 1.469 0 CA-C-N 120.734 1.606 . . . . 0.0 110.697 168.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.28 -36.33 83.76 Favored 'General case' 0 CA--C 1.572 1.812 0 C-N-CA 125.029 1.332 . . . . 0.0 113.205 167.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.713 HD12 ' HA ' ' A' ' 126' ' ' ASP . 10.1 tt -75.37 -44.58 44.19 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 118.018 2.599 . . . . 0.0 118.018 168.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.8 m -64.9 3.43 0.56 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 120.623 3.564 . . . . 0.0 120.623 -162.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.416 ' CE ' ' H ' ' A' ' 96' ' ' GLY . 5.8 ptm -68.33 166.77 22.32 Favored Pre-proline 0 CA--C 1.563 1.48 0 C-N-CA 127.586 2.355 . . . . 0.0 114.498 174.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -64.25 -178.35 0.62 Allowed 'Trans proline' 0 CA--C 1.564 1.977 1 C-N-CA 126.483 4.789 . . . . 0.0 111.933 167.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -60.1 134.26 55.1 Favored 'Trans proline' 0 C--N 1.382 2.309 1 CA-C-N 134.504 6.216 . . . . 0.0 113.868 -171.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.5 tpt180 -26.8 -55.37 0.21 Allowed Pre-proline 0 C--N 1.367 1.34 1 C-N-CA 131.877 4.071 . . . . 0.0 116.168 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 66.6 Cg_endo -72.76 162.61 40.73 Favored 'Trans proline' 0 N--CA 1.447 -1.216 1 C-N-CA 125.578 4.185 . . . . 0.0 122.322 172.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . 0.269 0.5 OUTLIER -107.95 -45.51 3.96 Favored 'General case' 0 N--CA 1.47 0.53 1 CA-C-N 106.404 -4.907 . . . . 0.0 106.259 134.288 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.405 ' H ' ' HB2' ' A' ' 93' ' ' PHE . 2.3 mt -119.73 -22.33 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.0 1 C-N-CA 132.798 4.439 . . . . 0.0 114.126 -178.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 12.7 t70 75.44 -39.67 0.4 Allowed 'General case' 0 C--N 1.317 -0.822 1 C-N-CA 133.433 4.693 . . . . 0.0 112.657 -170.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -87.18 -22.48 25.27 Favored 'General case' 0 C--N 1.36 1.024 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -175.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -123.17 -4.14 8.46 Favored 'General case' 0 N--CA 1.436 -1.161 0 C-N-CA 125.066 1.346 . . . . 0.0 110.74 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.411 ' O ' ' HA ' ' A' ' 87' ' ' PRO . 14.4 m-85 -147.91 110.4 4.67 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 124.122 0.969 . . . . 0.0 113.497 -174.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.563 HG22 ' HB ' ' A' ' 97' ' ' VAL 0.385 31.5 mt -116.31 89.45 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.496 -1.113 0 C-N-CA 130.018 3.327 . . . . 0.0 103.218 170.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -45.32 -56.15 5.22 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 121.101 3.741 . . . . 0.0 121.101 -167.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.416 ' H ' ' CE ' ' A' ' 83' ' ' MET . . . -102.42 33.77 6.28 Favored Glycine 0 C--N 1.347 1.175 0 C-N-CA 125.84 1.685 . . . . 0.0 110.463 172.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.563 ' HB ' HG22 ' A' ' 94' ' ' ILE 0.26 0.4 OUTLIER -113.69 142.27 26.81 Favored 'Isoleucine or valine' 0 C--N 1.365 1.246 0 CA-C-O 123.909 1.814 . . . . 0.0 109.788 174.928 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -64.44 22.95 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.687 1 C-N-CA 133.036 4.534 . . . . 0.0 116.906 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.419 13.8 p90 50.31 31.3 5.14 Favored 'General case' 0 C--N 1.356 0.887 1 C-N-CA 132.299 4.24 . . . . 0.0 118.742 175.621 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -112.06 168.04 8.24 Favored Pre-proline 0 N--CA 1.442 -0.864 0 C-N-CA 129.631 3.172 . . . . 0.0 106.252 176.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.71 152.13 47.28 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.063 3.175 . . . . 0.0 111.444 169.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -69.92 45.3 0.55 Allowed Glycine 0 C--N 1.358 1.778 0 C-N-CA 127.22 2.343 . . . . 0.0 118.15 -172.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -131.36 140.31 49.68 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 126.544 1.938 . . . . 0.0 108.877 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mp -122.56 150.63 42.34 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 127.7 2.4 . . . . 0.0 113.451 -173.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -129.52 113.08 14.42 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 127.432 2.293 . . . . 0.0 105.397 -174.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.655 HG21 ' HG2' ' A' ' 153' ' ' GLN 0.283 1.2 pt -134.85 132.83 53.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -175.045 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . 0.255 0.4 OUTLIER -139.73 127.59 22.05 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 119.973 -1.704 . . . . 0.0 111.416 -175.211 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 171.41 169.62 0.09 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 101.431 -3.544 . . . . 0.0 101.431 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.581 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.97 -33.97 4.62 Favored Glycine 0 N--CA 1.491 2.328 0 O-C-N 120.038 -1.663 . . . . 0.0 112.855 -173.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 121.05 -13.47 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.17 1 C-N-CA 137.659 6.384 . . . . 0.0 108.004 -168.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.774 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.788 0.0 OUTLIER -83.12 135.19 34.91 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 119.752 3.241 . . . . 0.0 119.752 -179.036 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -91.87 100.78 13.39 Favored 'General case' 0 C--N 1.371 1.532 0 N-CA-C 104.872 -2.269 . . . . 0.0 104.872 171.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.546 HD11 ' CE1' ' A' ' 67' ' ' PHE 0.269 3.5 mm? -95.98 132.89 40.83 Favored 'General case' 0 CA--C 1.558 1.268 0 N-CA-C 106.247 -1.76 . . . . 0.0 106.247 174.28 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -118.36 128.78 7.88 Favored Glycine 0 C--N 1.351 1.392 0 N-CA-C 105.131 -3.188 . . . . 0.0 105.131 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.554 ' CE1' HD11 ' A' ' 106' ' ' ILE 0.258 6.0 m-30 -125.92 151.33 47.1 Favored 'General case' 0 C--N 1.366 1.289 0 CA-C-N 122.465 3.133 . . . . 0.0 102.797 -179.437 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.8 m -151.02 131.67 13.96 Favored 'General case' 0 CA--C 1.481 -1.697 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' A' ' 129' ' ' LEU . 13.6 t -69.05 142.85 15.63 Favored 'Isoleucine or valine' 0 C--N 1.371 1.511 0 C-N-CA 128.871 2.869 . . . . 0.0 107.494 172.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.481 ' HA ' ' HB2' ' A' ' 130' ' ' GLN 0.362 87.4 m -51.05 110.91 0.48 Allowed 'General case' 0 C--N 1.375 1.692 0 CA-C-O 125.317 2.484 . . . . 0.0 116.99 -177.443 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.04 -39.12 7.89 Favored Pre-proline 0 N--CA 1.442 -0.863 0 CA-C-O 115.45 -2.214 . . . . 0.0 114.072 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -78.95 52.37 4.23 Favored 'Trans proline' 0 CA--C 1.556 1.601 0 CA-C-N 127.049 3.553 . . . . 0.0 114.786 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.97 177.22 3.8 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -173.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.5 -67.25 0.84 Allowed 'General case' 0 C--N 1.371 1.526 0 N-CA-C 105.027 -2.212 . . . . 0.0 105.027 156.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.43 ' HB3' ' HG3' ' A' ' 127' ' ' PRO 0.441 5.3 mptp? 50.39 -19.28 0.0 OUTLIER 'General case' 0 N--CA 1.424 -1.732 1 C-N-CA 138.666 6.786 . . . . 0.0 118.421 -178.668 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER 107.34 -143.13 0.0 OUTLIER 'General case' 0 C--N 1.369 1.423 1 C-N-CA 132.754 4.422 . . . . 0.0 109.734 175.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.477 ' HB2' ' HG ' ' A' ' 81' ' ' LEU 0.495 0.0 OUTLIER -102.82 -54.37 2.65 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 125.58 1.552 . . . . 0.0 110.481 -177.057 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.713 ' HA ' HD12 ' A' ' 81' ' ' LEU 0.333 0.0 OUTLIER -26.73 -74.96 0.03 OUTLIER Pre-proline 0 C--N 1.368 1.405 1 C-N-CA 133.786 4.834 . . . . 0.0 117.858 166.145 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.43 ' HG3' ' HB3' ' A' ' 123' ' ' LYS 0.659 0.0 OUTLIER 52.45 -177.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.384 2.406 1 N-CA-C 122.97 4.181 . . . . 0.0 122.97 145.328 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 2.1 p -124.88 152.7 43.69 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 177.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.538 ' HB2' HD12 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -102.03 128.69 48.36 Favored 'General case' 0 C--N 1.359 1.021 1 N-CA-C 97.105 -5.146 . . . . 0.0 97.105 172.641 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 118' ' ' CYS . 30.9 tt0 -80.6 1.81 28.25 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 128.048 2.539 . . . . 0.0 113.11 -154.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 21.8 p 163.49 146.08 0.01 OUTLIER 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 -170.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 32.8 ttt85 -115.05 122.04 44.93 Favored 'General case' 0 N--CA 1.429 -1.484 1 N-CA-C 99.892 -4.114 . . . . 0.0 99.892 162.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 3.6 ttt -93.14 125.28 37.66 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 102.192 -3.262 . . . . 0.0 102.192 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.18 112.84 14.98 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.77 144.48 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.131 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.858 HD13 HD12 ' A' ' 141' ' ' LEU . 0.1 OUTLIER -140.89 175.84 5.51 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 N-CA-C 115.629 1.715 . . . . 0.0 115.629 -170.482 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.726 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -158.94 71.76 0.54 Allowed 'General case' 0 C--N 1.367 1.354 1 C-N-CA 136.694 5.998 . . . . 0.0 108.105 172.546 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 7.5 t -67.7 -50.0 59.8 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-O 124.038 1.875 . . . . 0.0 110.085 174.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.445 ' HD3' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -168.27 -56.63 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 110.648 -2.978 . . . . 0.0 109.267 -175.059 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.493 ' HG3' HD22 ' A' ' 141' ' ' LEU . 8.6 ptp180 -109.21 14.98 23.53 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.183 2.593 . . . . 0.0 115.603 -173.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.858 HD12 HD13 ' A' ' 136' ' ' ILE . 0.1 OUTLIER -103.95 102.6 32.54 Favored Pre-proline 0 C--N 1.369 1.437 0 C-N-CA 128.01 2.524 . . . . 0.0 107.163 -163.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 141' ' ' LEU . 0.3 OUTLIER -68.3 49.71 0.48 Allowed 'Trans proline' 0 CA--C 1.541 0.872 1 C-N-CA 126.578 4.852 . . . . 0.0 121.181 -166.997 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -93.62 -121.07 3.16 Favored Glycine 0 C--N 1.313 -0.747 1 C-N-CA 131.619 4.438 . . . . 0.0 117.425 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -109.18 -178.27 3.52 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 127.039 2.136 . . . . 0.0 112.744 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -138.31 97.75 3.45 Favored 'General case' 0 C--N 1.357 0.921 0 O-C-N 120.275 -1.515 . . . . 0.0 106.966 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 22.5 t -179.85 -166.63 0.08 Allowed 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 -175.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 54.0 tttp 173.02 133.62 0.03 OUTLIER 'General case' 0 C--N 1.349 0.576 1 C-N-CA 132.8 4.44 . . . . 0.0 103.583 178.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -150.53 -80.3 0.12 Allowed 'General case' 0 C--N 1.359 0.984 0 N-CA-C 117.87 2.544 . . . . 0.0 117.87 -169.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . 0.311 29.1 m -90.32 -142.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.367 1.334 0 N-CA-C 118.833 2.901 . . . . 0.0 118.833 -172.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.74 HD13 ' H ' ' A' ' 152' ' ' THR . 0.0 OUTLIER -131.16 127.14 60.26 Favored 'Isoleucine or valine' 0 C--N 1.376 1.722 0 N-CA-C 121.25 3.796 . . . . 0.0 121.25 -178.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.688 ' HD3' HD11 ' A' ' 66' ' ' LEU 0.458 0.0 OUTLIER -123.15 101.51 7.44 Favored 'General case' 0 C--N 1.401 2.813 2 N-CA-C 126.64 5.792 . . . . 0.0 126.64 153.488 . . . . . . . . 5 4 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.842 ' HB ' ' CD2' ' A' ' 73' ' ' HIS 0.451 68.2 p -121.8 100.57 7.07 Favored 'General case' 0 CA--C 1.457 -2.621 2 O-C-N 115.382 -4.574 . . . . 0.0 105.764 152.316 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.655 ' HG2' HG21 ' A' ' 106' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.389 -3.5 0 N-CA-C 103.759 -2.682 . . . . 0.0 103.759 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.5 mtt . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 106.44 -1.689 . . . . 0.0 106.44 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.9 p -85.95 81.49 8.5 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.506 2.323 . . . . 0.0 113.757 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.4 mm -84.77 -57.03 4.73 Favored 'Isoleucine or valine' 0 C--N 1.367 1.337 0 N-CA-C 117.084 2.253 . . . . 0.0 117.084 -171.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.564 ' HA ' ' CG1' ' A' ' 7' ' ' VAL . 13.2 m-80 24.28 16.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 2 C-N-CA 137.666 6.386 . . . . 0.0 122.228 -178.047 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.2 p -91.25 -68.17 0.81 Allowed 'General case' 0 N--CA 1.466 0.34 1 C-N-CA 133.071 4.548 . . . . 0.0 112.702 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.64 -13.51 62.11 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 127.261 2.225 . . . . 0.0 111.858 176.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.564 ' CG1' ' HA ' ' A' ' 4' ' ' ASN . 1.6 m -82.19 -36.26 13.74 Favored 'Isoleucine or valine' 0 C--N 1.359 1.006 0 C-N-CA 129.814 3.246 . . . . 0.0 108.965 175.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -68.07 -42.67 80.1 Favored 'General case' 0 C--N 1.373 1.627 0 C-N-CA 128.553 2.741 . . . . 0.0 109.144 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.3 mt -61.64 -43.1 96.52 Favored 'Isoleucine or valine' 0 C--N 1.368 1.386 0 C-N-CA 126.945 2.098 . . . . 0.0 110.722 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.315 0.7 OUTLIER -62.88 -44.66 95.52 Favored 'General case' 0 C--N 1.366 1.325 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 171.279 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -62.97 -30.38 71.54 Favored 'General case' 0 C--N 1.369 1.427 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 166.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -76.65 -50.97 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 128.316 2.646 . . . . 0.0 111.794 175.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.659 ' HA ' ' HG3' ' A' ' 16' ' ' ARG . 28.4 mmtt -62.32 -29.71 70.64 Favored 'General case' 0 C--N 1.376 1.727 0 C-N-CA 128.518 2.727 . . . . 0.0 109.92 174.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.764 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.7 OUTLIER -66.64 -51.79 52.32 Favored 'General case' 0 C--N 1.369 1.442 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.789 164.475 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -54.62 -37.77 66.01 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 120.173 1.351 . . . . 0.0 112.63 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.659 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.28 0.9 OUTLIER -71.88 -41.64 67.75 Favored 'General case' 0 C--N 1.392 2.44 0 O-C-N 120.407 -1.433 . . . . 0.0 112.508 171.48 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -57.92 -44.64 86.99 Favored 'General case' 0 C--N 1.388 2.242 0 C-N-CA 129.116 2.966 . . . . 0.0 111.775 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.556 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -66.54 -55.28 16.25 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 128.773 2.829 . . . . 0.0 111.513 -178.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 22' ' ' PHE . 51.5 mt-10 -75.12 -32.98 61.53 Favored 'General case' 0 C--N 1.364 1.21 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.9 m -73.68 -40.81 63.39 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 126.047 1.739 . . . . 0.0 113.513 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.504 ' HB3' ' CD2' ' A' ' 64' ' ' PHE . 0.8 OUTLIER -73.42 -28.78 62.17 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 125.666 1.586 . . . . 0.0 108.626 170.372 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.486 ' HB2' ' HA ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -57.24 -42.27 81.16 Favored 'General case' 0 C--N 1.377 1.774 0 C-N-CA 124.789 1.236 . . . . 0.0 113.901 165.545 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -59.56 -37.92 79.72 Favored 'General case' 0 C--N 1.377 1.803 0 C-N-CA 124.613 1.165 . . . . 0.0 111.612 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -58.3 -49.27 77.75 Favored 'General case' 0 C--N 1.372 1.581 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 167.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 21' ' ' GLU . 2.0 mt -66.32 -42.52 90.85 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 O-C-N 120.53 -1.356 . . . . 0.0 111.709 176.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -73.97 -27.08 60.81 Favored 'General case' 0 C--N 1.372 1.561 0 O-C-N 121.459 -0.776 . . . . 0.0 111.652 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -70.82 -35.98 72.73 Favored 'General case' 0 C--N 1.375 1.703 0 C-N-CA 126.084 1.754 . . . . 0.0 110.687 172.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.475 ' HG2' ' HG3' ' A' ' 71' ' ' LYS . 17.7 tp10 -69.83 -37.29 76.17 Favored 'General case' 0 C--N 1.383 2.058 0 O-C-N 120.722 -1.236 . . . . 0.0 113.538 170.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.468 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 5.2 mt -65.11 -50.29 75.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.198 0 C-N-CA 124.707 1.203 . . . . 0.0 113.322 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -63.01 -32.79 74.23 Favored 'General case' 0 C--N 1.361 1.101 0 CA-C-N 121.778 2.081 . . . . 0.0 114.429 174.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 21.5 pt-20 -77.33 -43.64 32.33 Favored 'General case' 0 C--N 1.376 1.748 0 O-C-N 118.521 -2.612 . . . . 0.0 111.699 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.12 -41.05 64.42 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 124.316 1.046 . . . . 0.0 113.643 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 t -71.42 -28.84 64.27 Favored 'General case' 0 C--N 1.352 0.705 0 C-N-CA 125.484 1.513 . . . . 0.0 111.448 175.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -77.92 -38.29 45.85 Favored 'General case' 0 C--N 1.387 2.234 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 166.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.14 -30.86 62.48 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 126.838 2.055 . . . . 0.0 114.592 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.8 -10.04 59.1 Favored 'General case' 0 C--N 1.381 1.956 0 C-N-CA 124.531 1.133 . . . . 0.0 111.753 166.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.11 17.96 56.67 Favored Glycine 0 C--N 1.379 2.93 0 O-C-N 121.122 -0.986 . . . . 0.0 114.675 167.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.575 HG21 ' ND2' ' A' ' 78' ' ' ASN 0.504 0.6 OUTLIER -94.37 -179.46 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.74 0 C-N-CA 125.814 1.646 . . . . 0.0 114.169 -173.346 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -43.87 -50.43 7.98 Favored 'General case' 0 C--N 1.363 1.184 0 C-N-CA 130.645 3.578 . . . . 0.0 115.658 -177.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.313 1.5 t 90.51 125.82 0.03 OUTLIER 'General case' 0 C--N 1.36 1.039 1 C-N-CA 133.492 4.717 . . . . 0.0 110.489 -177.548 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.468 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 3.5 p90 -112.6 154.0 26.69 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 124.701 1.2 . . . . 0.0 109.308 -174.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.79 162.93 23.23 Favored 'General case' 0 CA--C 1.494 -1.19 0 CA-C-O 122.868 1.318 . . . . 0.0 111.133 -177.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.66 138.17 52.8 Favored 'General case' 0 CA--C 1.505 -0.766 0 O-C-N 120.983 -1.073 . . . . 0.0 109.373 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -132.04 141.85 49.36 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 165.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.73 ' CE1' HD12 ' A' ' 50' ' ' LEU . 1.8 m-85 -101.11 153.8 19.27 Favored 'General case' 0 C--N 1.364 1.198 0 CA-C-O 123.395 1.569 . . . . 0.0 109.563 175.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 72.6 m -131.8 90.03 2.78 Favored 'General case' 0 CA--C 1.499 -0.993 1 N-CA-C 99.495 -4.261 . . . . 0.0 99.495 168.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 51' ' ' ASP . 0.0 OUTLIER -47.79 -9.59 0.02 OUTLIER 'General case' 0 C--O 1.191 -2.025 0 CA-C-O 112.764 -3.493 . . . . 0.0 119.781 -168.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.05 61.45 Favored 'General case' 0 N--CA 1.5 2.032 1 CA-C-N 129.487 5.585 . . . . 0.0 119.933 -176.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.741 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.12 -42.77 96.71 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 130.646 3.578 . . . . 0.0 111.622 172.402 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.912 HD23 HD11 ' A' ' 54' ' ' ILE . 1.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--O 1.199 -1.576 0 C-N-CA 129.381 3.072 . . . . 0.0 109.099 171.287 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 47' ' ' GLN . 98.7 m-20 -58.89 -33.96 71.1 Favored 'General case' 0 C--N 1.365 1.268 0 C-N-CA 130.856 3.663 . . . . 0.0 110.699 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -74.71 -33.11 62.34 Favored 'General case' 0 C--N 1.364 1.225 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 164.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.41 -33.21 58.83 Favored 'General case' 0 C--N 1.352 0.699 0 O-C-N 119.096 -2.252 . . . . 0.0 116.504 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.912 HD11 HD23 ' A' ' 50' ' ' LEU . 54.2 mt -63.34 -44.4 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.626 1 C-N-CA 133.746 4.818 . . . . 0.0 111.38 175.506 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.427 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -108.2 -24.91 11.32 Favored 'General case' 0 C--N 1.366 1.288 0 N-CA-C 119.125 3.009 . . . . 0.0 119.125 173.385 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -83.58 -17.09 42.88 Favored 'General case' 0 C--N 1.363 1.179 0 CA-C-N 123.528 2.876 . . . . 0.0 114.292 -173.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' A' ' 60' ' ' GLU . 15.0 pm0 -131.98 -50.62 0.96 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.223 1.409 . . . . 0.0 110.788 175.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 54' ' ' ILE 0.456 0.1 OUTLIER 73.8 156.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 C-N-CA 125.62 1.568 . . . . 0.0 111.033 177.55 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.488 ' HA ' HD23 ' A' ' 14' ' ' LEU . 14.4 t70 30.69 50.11 0.09 Allowed 'General case' 0 N--CA 1.52 3.049 0 C-N-CA 131.123 3.769 . . . . 0.0 115.458 -178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.553 ' HG3' ' HG3' ' A' ' 57' ' ' GLU 0.446 60.7 mm-40 -86.26 79.61 9.01 Favored 'General case' 0 CA--C 1.485 -1.529 0 CA-C-O 126.949 3.262 . . . . 0.0 109.742 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.309 33.2 p -78.44 -15.56 58.52 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 128.742 2.817 . . . . 0.0 112.769 177.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.65 ' HE2' HG21 ' A' ' 136' ' ' ILE . 1.1 t80 -68.95 -34.25 75.03 Favored 'General case' 0 C--N 1.358 0.961 1 C-N-CA 131.82 4.048 . . . . 0.0 110.45 169.002 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.521 HG13 ' CZ ' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -64.86 -45.94 93.39 Favored 'Isoleucine or valine' 0 C--N 1.358 0.953 0 C-N-CA 130.901 3.68 . . . . 0.0 106.789 -178.698 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.504 ' CD2' ' HB3' ' A' ' 21' ' ' GLU 0.316 57.5 m-85 -62.57 -41.54 98.98 Favored 'General case' 0 C--O 1.21 -1.006 0 C-N-CA 130.322 3.449 . . . . 0.0 114.778 165.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -64.28 -43.04 96.02 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 123.898 3.044 . . . . 0.0 113.575 177.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.734 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 1.2 tm? -68.14 -41.62 81.33 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 125.064 1.346 . . . . 0.0 114.468 171.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.521 ' CZ ' HG13 ' A' ' 63' ' ' VAL 0.886 0.1 OUTLIER -77.76 -17.06 57.94 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 118.394 -2.691 . . . . 0.0 115.512 172.878 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -78.3 -18.98 54.52 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 127.845 2.458 . . . . 0.0 108.349 163.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -78.13 -33.17 50.57 Favored 'General case' 0 CA--C 1.567 1.611 0 O-C-N 119.978 -1.702 . . . . 0.0 112.085 159.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 mm -58.0 -46.08 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.914 0 C-N-CA 128.155 2.582 . . . . 0.0 113.342 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.475 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 14.0 pttm -52.46 -16.92 1.0 Allowed 'General case' 0 CA--C 1.502 -0.898 0 C-N-CA 130.512 3.525 . . . . 0.0 118.272 -176.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.277 60.7 m-20 -101.24 -14.14 17.8 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.974 2.109 . . . . 0.0 109.718 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.97 11.93 16.85 Favored 'General case' 0 C--N 1.369 1.448 0 C-N-CA 129.823 3.249 . . . . 0.0 113.059 -171.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.544 ' HA ' HG13 ' A' ' 77' ' ' VAL . 99.5 t -37.89 -31.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.384 2.067 0 C-N-CA 129.103 2.961 . . . . 0.0 115.996 166.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.46 ' H ' HD22 ' A' ' 75' ' ' LEU . 0.4 OUTLIER -69.5 -38.09 77.47 Favored 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 130.388 3.475 . . . . 0.0 114.404 175.311 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -76.43 -33.04 58.8 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.581 1.952 . . . . 0.0 112.101 172.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.544 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.744 0.1 OUTLIER -71.51 -26.77 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.787 0 CA-C-O 126.786 3.184 . . . . 0.0 112.517 169.83 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.575 ' ND2' HG21 ' A' ' 38' ' ' VAL . 5.9 m120 -70.44 -32.57 70.21 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 128.821 2.848 . . . . 0.0 111.997 163.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -63.72 -30.26 71.38 Favored 'General case' 0 C--N 1.377 1.784 0 C-N-CA 125.336 1.454 . . . . 0.0 112.372 161.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.08 -41.29 98.03 Favored 'General case' 0 CA--C 1.581 2.14 0 C-N-CA 124.944 1.298 . . . . 0.0 112.611 163.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 125' ' ' LYS . 0.9 OUTLIER -75.4 -13.68 60.41 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 127.628 2.371 . . . . 0.0 115.575 173.458 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 49.1 m -78.81 2.51 19.65 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 128.765 2.826 . . . . 0.0 114.43 -175.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.831 ' CE ' HG23 ' A' ' 97' ' ' VAL . 14.1 tpt -73.62 131.48 82.2 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 131.279 3.832 . . . . 0.0 111.023 176.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.68 151.84 77.85 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 125.241 3.961 . . . . 0.0 112.557 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -47.34 139.5 16.55 Favored 'Trans proline' 0 C--N 1.361 1.215 1 C-N-CA 126.918 5.079 . . . . 0.0 118.845 -162.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.448 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 11.8 mmm180 -83.96 95.32 0.31 Allowed Pre-proline 0 CA--C 1.568 1.668 0 N-CA-C 116.125 1.898 . . . . 0.0 116.125 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 86' ' ' ARG . 9.8 Cg_endo -113.3 165.76 0.04 OUTLIER 'Trans proline' 0 C--N 1.367 1.531 1 C-N-CA 127.659 5.573 . . . . 0.0 112.702 -164.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.89 -25.61 68.23 Favored 'General case' 0 C--N 1.368 1.392 0 C-N-CA 128.196 2.598 . . . . 0.0 114.323 170.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.496 HD12 ' HB2' ' A' ' 92' ' ' ASP 0.262 0.0 OUTLIER -89.67 157.43 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 1 C-N-CA 132.294 4.237 . . . . 0.0 111.498 171.839 . . . . . . . . 5 4 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -113.5 -41.7 3.6 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-N 110.156 -3.202 . . . . 0.0 110.127 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -82.61 -18.64 40.52 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 120.521 3.526 . . . . 0.0 120.521 -171.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.496 ' HB2' HD12 ' A' ' 89' ' ' ILE . 17.8 m-20 -104.04 -3.38 24.66 Favored 'General case' 0 CA--C 1.494 -1.189 0 O-C-N 121.572 -0.705 . . . . 0.0 111.875 -173.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -145.7 -58.51 0.32 Allowed 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -175.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.451 ' HB ' ' HB ' ' A' ' 97' ' ' VAL 0.318 2.5 pt -87.4 87.58 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 CA-C-O 127.784 3.659 . . . . 0.0 115.868 -170.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -97.03 -22.84 16.57 Favored 'General case' 0 N--CA 1.436 -1.154 2 CA-C-N 104.745 -5.661 . . . . 0.0 109.032 175.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -90.64 -6.84 67.4 Favored Glycine 0 C--N 1.367 2.259 0 C-N-CA 124.424 1.012 . . . . 0.0 111.509 174.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.831 HG23 ' CE ' ' A' ' 83' ' ' MET . 89.6 t -113.01 94.84 3.37 Favored 'Isoleucine or valine' 0 C--N 1.357 0.924 0 N-CA-C 105.506 -2.035 . . . . 0.0 105.506 176.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -117.02 24.26 11.31 Favored 'General case' 0 N--CA 1.436 -1.147 0 C-N-CA 130.685 3.594 . . . . 0.0 108.816 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.6 t80 82.87 57.35 0.01 OUTLIER 'General case' 0 C--N 1.36 1.028 0 C-N-CA 130.03 3.332 . . . . 0.0 110.576 -175.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 85.9 mmt-85 -111.08 109.54 57.01 Favored Pre-proline 0 C--N 1.357 0.921 0 C-N-CA 125.597 1.559 . . . . 0.0 109.297 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -63.63 152.8 78.69 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 125.3 4.0 . . . . 0.0 116.421 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.37 43.65 2.93 Favored Glycine 0 C--N 1.359 1.834 0 C-N-CA 126.163 1.84 . . . . 0.0 114.854 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -131.71 145.82 51.84 Favored 'General case' 0 CA--C 1.506 -0.719 0 O-C-N 119.35 -2.264 . . . . 0.0 110.141 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.8 tp -115.82 135.79 53.67 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 126.865 2.066 . . . . 0.0 109.886 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -129.4 110.69 12.11 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 103.367 -2.827 . . . . 0.0 103.367 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.486 HD11 ' CE1' ' A' ' 115' ' ' PHE . 21.6 pt -134.52 140.92 44.79 Favored 'Isoleucine or valine' 0 C--N 1.35 0.592 0 C-N-CA 124.776 1.231 . . . . 0.0 110.774 -173.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.574 HG21 ' HB3' ' A' ' 148' ' ' ALA . 23.3 m -127.48 130.58 49.46 Favored 'General case' 0 C--N 1.363 1.179 0 O-C-N 120.1 -1.625 . . . . 0.0 112.131 -176.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.445 ' HB3' ' HB ' ' A' ' 152' ' ' THR . 33.0 t0 -173.75 166.51 4.47 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 102.8 -3.037 . . . . 0.0 102.8 -178.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.734 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 91.33 -38.51 3.2 Favored Glycine 0 C--N 1.351 1.411 0 CA-C-O 123.661 1.701 . . . . 0.0 111.072 172.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 108' ' ' ASP . 29.1 m-80 121.23 -8.85 0.0 OUTLIER 'General case' 0 N--CA 1.422 -1.849 1 C-N-CA 139.497 7.119 . . . . 0.0 108.453 -168.213 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.749 ' HA ' HG23 ' A' ' 136' ' ' ILE 0.641 0.0 OUTLIER -79.26 136.01 36.92 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 130.24 3.416 . . . . 0.0 116.596 177.245 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -97.21 100.48 11.95 Favored 'General case' 0 C--N 1.37 1.463 0 N-CA-C 100.26 -3.978 . . . . 0.0 100.26 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.428 HD22 ' HG ' ' A' ' 111' ' ' LEU . 1.3 pt? -119.25 123.06 43.36 Favored 'General case' 0 C--N 1.361 1.086 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -117.36 142.95 17.7 Favored Glycine 0 C--N 1.355 1.621 0 N-CA-C 106.596 -2.602 . . . . 0.0 106.596 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.486 ' CE1' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -131.85 142.22 49.64 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 176.091 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 31.4 m -125.05 129.63 50.65 Favored 'General case' 0 CA--C 1.485 -1.544 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 -173.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.0 t -59.0 144.05 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 127.147 2.179 . . . . 0.0 108.884 169.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 130' ' ' GLN 0.309 86.4 m -56.87 107.5 0.41 Allowed 'General case' 0 C--N 1.379 1.867 0 CA-C-N 120.9 1.682 . . . . 0.0 111.593 179.697 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.252 22.7 ttmm -68.81 -40.02 15.94 Favored Pre-proline 0 N--CA 1.444 -0.73 0 CA-C-O 116.057 -1.925 . . . . 0.0 115.28 -170.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.48 59.46 5.51 Favored 'Trans proline' 0 CA--C 1.56 1.778 0 CA-C-N 126.042 3.194 . . . . 0.0 113.071 171.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.258 0.0 OUTLIER 163.71 124.24 0.01 OUTLIER 'General case' 0 C--N 1.367 1.359 0 C-N-CA 129.648 3.179 . . . . 0.0 111.47 178.15 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -146.46 67.15 1.18 Allowed 'General case' 0 N--CA 1.432 -1.341 0 O-C-N 117.331 -3.356 . . . . 0.0 111.241 168.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -105.42 11.99 32.03 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 126.339 1.855 . . . . 0.0 107.832 173.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -128.31 150.75 49.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 128.088 2.555 . . . . 0.0 113.354 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.515 ' HB2' HD22 ' A' ' 81' ' ' LEU 0.266 2.4 mppt? -101.82 -45.62 5.16 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.417 1.487 . . . . 0.0 111.183 178.348 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.3 85.25 6.77 Favored Pre-proline 0 C--N 1.367 1.346 0 C-N-CA 129.058 2.943 . . . . 0.0 108.018 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -81.49 -173.12 1.68 Allowed 'Trans proline' 0 CA--C 1.497 -1.342 1 C-N-CA 132.652 8.901 . . . . 0.0 114.106 -177.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.6 p -98.44 138.94 34.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 100.375 -3.935 . . . . 0.0 100.375 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.7 134.91 42.97 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 121.136 1.789 . . . . 0.0 106.629 -167.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.419 ' HG2' ' HA ' ' A' ' 118' ' ' CYS 0.252 1.1 pt20 -95.85 66.59 2.65 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 125.486 1.514 . . . . 0.0 109.538 -169.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.309 2.1 p 98.68 148.65 0.02 OUTLIER 'General case' 0 C--N 1.364 1.196 0 C-N-CA 126.409 1.884 . . . . 0.0 109.669 -174.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -115.09 124.16 50.85 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 101.164 -3.643 . . . . 0.0 101.164 165.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.486 ' HA ' ' HG ' ' A' ' 49' ' ' LEU . 4.3 ttp -102.95 108.25 19.36 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -121.72 115.16 22.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.605 1.162 . . . . 0.0 108.439 -175.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.7 mm -139.1 136.38 42.16 Favored 'Isoleucine or valine' 0 C--N 1.363 1.186 0 N-CA-C 105.658 -1.979 . . . . 0.0 105.658 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -133.65 -179.39 3.31 Favored 'Isoleucine or valine' 0 C--N 1.351 0.651 0 C-N-CA 127.196 2.198 . . . . 0.0 112.822 -172.706 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.647 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.0 OUTLIER -135.53 149.52 49.49 Favored 'General case' 0 CA--C 1.557 1.224 1 C-N-CA 135.418 5.487 . . . . 0.0 106.972 167.199 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.436 ' HB2' HD23 ' A' ' 141' ' ' LEU . 51.4 m -164.67 -103.54 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.65 ' CD ' ' HG2' ' A' ' 140' ' ' ARG 0.258 0.0 OUTLIER -118.15 -66.69 1.05 Allowed 'General case' 0 C--N 1.355 0.815 0 C-N-CA 129.671 3.188 . . . . 0.0 113.608 -160.264 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.65 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 12.2 ptp180 -105.66 2.14 27.85 Favored 'General case' 0 CA--C 1.497 -1.079 1 C-N-CA 133.684 4.794 . . . . 0.0 108.659 174.617 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.556 HD13 ' HD2' ' A' ' 142' ' ' PRO . 0.2 OUTLIER -82.61 142.48 46.04 Favored Pre-proline 0 CA--C 1.574 1.895 0 CA-C-O 114.514 -2.66 . . . . 0.0 106.387 -152.463 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.556 ' HD2' HD13 ' A' ' 141' ' ' LEU . 17.2 Cg_exo -45.15 -50.41 8.91 Favored 'Trans proline' 0 N--CA 1.48 0.702 2 C-N-CA 127.051 5.167 . . . . 0.0 125.441 -167.569 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -126.67 -165.51 11.98 Favored Glycine 0 CA--C 1.492 -1.376 0 C-N-CA 126.281 1.896 . . . . 0.0 111.883 -177.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -152.11 136.69 16.92 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 127.926 2.49 . . . . 0.0 111.842 -177.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 163.07 120.86 0.0 OUTLIER 'General case' 0 C--N 1.36 1.047 0 C-N-CA 129.725 3.21 . . . . 0.0 111.902 176.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 75.6 m -141.86 119.66 11.88 Favored 'General case' 0 C--N 1.368 1.386 0 O-C-N 120.258 -1.526 . . . . 0.0 108.624 174.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -162.97 83.51 0.5 Allowed 'General case' 0 CA--C 1.498 -1.044 0 C-N-CA 125.338 1.455 . . . . 0.0 111.959 178.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.574 ' HB3' HG21 ' A' ' 107' ' ' THR . . . 164.32 144.89 0.01 OUTLIER 'General case' 0 C--N 1.373 1.596 0 C-N-CA 128.042 2.537 . . . . 0.0 104.925 -176.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -148.88 108.21 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.259 0 CA-C-N 121.756 2.071 . . . . 0.0 112.649 -178.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.752 HD11 ' H ' ' A' ' 153' ' ' GLN . 0.4 OUTLIER -129.3 146.59 33.98 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 131.173 3.789 . . . . 0.0 104.946 173.292 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.354 21.3 mttp -93.42 137.13 33.03 Favored 'General case' 0 C--N 1.381 1.974 0 CA-C-N 123.717 2.962 . . . . 0.0 104.382 153.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.445 ' HB ' ' HB3' ' A' ' 108' ' ' ASP 0.355 1.0 OUTLIER -79.17 116.1 19.24 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 120.033 3.346 . . . . 0.0 120.033 -140.332 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.752 ' H ' HD11 ' A' ' 150' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.433 2 C-N-CA 135.765 5.626 . . . . 0.0 122.93 -173.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.0 ttm . . . . . 0 N--CA 1.452 -0.354 0 N-CA-C 104.78 -2.304 . . . . 0.0 104.78 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 77.7 p -89.46 148.19 23.58 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 128.019 2.528 . . . . 0.0 115.819 -173.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 8.6 mt -112.34 50.0 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.042 0 C-N-CA 127.7 2.4 . . . . 0.0 110.248 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.521 ' HA ' HG13 ' A' ' 7' ' ' VAL . 5.3 m120 -47.26 -4.29 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 1 C-N-CA 132.031 4.132 . . . . 0.0 120.26 -175.632 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.74 -58.37 4.31 Favored 'General case' 0 C--O 1.24 0.589 1 C-N-CA 133.172 4.589 . . . . 0.0 111.048 173.004 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -73.55 -13.62 61.06 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.096 1.759 . . . . 0.0 113.07 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.521 HG13 ' HA ' ' A' ' 4' ' ' ASN . 0.7 OUTLIER -84.88 -31.61 7.19 Favored 'Isoleucine or valine' 0 C--N 1.358 0.946 0 C-N-CA 127.808 2.443 . . . . 0.0 110.214 176.605 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.3 -38.39 71.76 Favored 'General case' 0 C--N 1.367 1.358 0 C-N-CA 127.567 2.347 . . . . 0.0 108.413 174.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.8 mt -61.07 -44.65 98.69 Favored 'Isoleucine or valine' 0 C--N 1.368 1.398 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.887 164.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 1.2 mmp_? -61.4 -47.46 85.7 Favored 'General case' 0 C--N 1.379 1.849 0 CA-C-N 120.951 1.705 . . . . 0.0 113.916 171.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -56.83 -27.29 59.94 Favored 'General case' 0 C--N 1.376 1.736 0 N-CA-C 118.007 2.595 . . . . 0.0 118.007 164.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -76.77 -50.68 12.96 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 119.486 -2.009 . . . . 0.0 111.877 171.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -56.83 -28.4 61.5 Favored 'General case' 0 C--N 1.376 1.721 0 C-N-CA 126.828 2.051 . . . . 0.0 112.754 171.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.452 ' O ' HD22 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -73.62 -46.56 46.13 Favored 'General case' 0 C--O 1.205 -1.251 0 CA-C-N 113.755 -1.566 . . . . 0.0 111.621 170.256 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.434 4.2 ptp180 -58.22 -36.28 72.92 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 120.16 -1.587 . . . . 0.0 114.586 173.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 71.9 mtt180 -64.19 -41.96 96.87 Favored 'General case' 0 C--N 1.384 2.069 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 162.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.502 ' CD2' HG22 ' A' ' 61' ' ' THR 0.251 3.0 t60 -62.22 -47.97 82.08 Favored 'General case' 0 C--N 1.383 2.024 0 C-N-CA 127.941 2.496 . . . . 0.0 114.392 174.473 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -59.06 -53.77 54.62 Favored 'General case' 0 C--N 1.369 1.449 1 C-N-CA 132.883 4.473 . . . . 0.0 108.8 177.885 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -70.65 -46.64 62.9 Favored 'General case' 0 C--N 1.37 1.48 0 N-CA-C 118.556 2.799 . . . . 0.0 118.556 173.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.9 m -66.29 -38.58 88.11 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 119.597 -1.94 . . . . 0.0 114.053 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.541 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.327 4.6 mp0 -77.11 -29.15 54.68 Favored 'General case' 0 C--N 1.362 1.113 0 O-C-N 120.708 -1.245 . . . . 0.0 111.013 172.207 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.3 -36.81 83.27 Favored 'General case' 0 C--N 1.387 2.202 0 O-C-N 120.178 -1.576 . . . . 0.0 114.137 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -68.09 -34.91 77.29 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 124.745 1.218 . . . . 0.0 110.47 169.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.609 HE21 ' CE1' ' A' ' 68' ' ' HIS . 19.6 tt0 -63.49 -45.75 89.26 Favored 'General case' 0 C--N 1.364 1.223 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 169.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.521 HG12 ' CE1' ' A' ' 68' ' ' HIS . 2.1 mt -71.3 -45.48 69.87 Favored 'Isoleucine or valine' 0 C--N 1.366 1.294 0 O-C-N 119.277 -2.14 . . . . 0.0 111.795 175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.539 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.336 3.5 m120 -75.03 -23.75 58.22 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 120.87 -1.144 . . . . 0.0 112.391 -177.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -75.84 -38.46 58.02 Favored 'General case' 0 C--N 1.382 2.012 0 CA-C-O 116.768 -1.587 . . . . 0.0 110.561 165.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.491 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 16.4 tp10 -65.97 -35.68 81.25 Favored 'General case' 0 C--N 1.382 2.013 0 CA-C-N 122.965 2.621 . . . . 0.0 115.793 172.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.542 HD13 ' CE2' ' A' ' 41' ' ' PHE 0.38 0.7 OUTLIER -73.06 -39.68 57.63 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 115.135 1.532 . . . . 0.0 115.135 174.625 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -74.4 -31.81 62.47 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 171.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.491 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 8.6 pt-20 -77.38 -38.06 50.76 Favored 'General case' 0 C--N 1.374 1.637 0 O-C-N 118.282 -2.762 . . . . 0.0 110.81 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.58 ' HB3' HG21 ' A' ' 74' ' ' VAL . . . -77.27 -36.5 54.31 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 124.428 1.091 . . . . 0.0 111.899 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.1 t -68.28 -35.45 77.88 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 121.213 -0.929 . . . . 0.0 110.346 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -72.05 -39.42 69.07 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 167.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.83 -28.38 61.58 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 126.48 1.912 . . . . 0.0 115.375 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.95 -15.58 58.11 Favored 'General case' 0 C--N 1.385 2.141 0 C-N-CA 124.75 1.22 . . . . 0.0 110.943 171.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.98 17.53 59.34 Favored Glycine 0 C--N 1.376 2.779 0 N-CA-C 114.994 0.757 . . . . 0.0 114.994 166.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.505 HG21 ' HB3' ' A' ' 78' ' ' ASN . 0.4 OUTLIER -109.82 151.76 12.01 Favored 'Isoleucine or valine' 0 C--N 1.36 1.023 0 N-CA-C 104.004 -2.591 . . . . 0.0 104.004 178.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.453 ' HB2' ' CD1' ' A' ' 81' ' ' LEU 0.52 7.7 m -20.74 -47.72 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.743 2 N-CA-C 125.715 5.45 . . . . 0.0 125.715 -167.267 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.343 93.7 p 87.35 137.59 0.04 OUTLIER 'General case' 0 CA--C 1.501 -0.919 1 C-N-CA 131.758 4.023 . . . . 0.0 109.543 -178.502 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.542 ' CE2' HD13 ' A' ' 29' ' ' ILE . 9.7 p90 -112.51 140.53 47.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 -175.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.423 ' O ' ' HA ' ' A' ' 128' ' ' SER . 71.1 m80 -101.96 104.61 15.31 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 -175.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.401 HD13 HD12 ' A' ' 129' ' ' LEU 0.294 0.3 OUTLIER -105.68 161.18 14.61 Favored 'General case' 0 CA--C 1.504 -0.791 0 O-C-N 116.863 -3.648 . . . . 0.0 115.451 -175.529 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -135.75 153.37 51.58 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.416 3.0 p90 -108.36 135.36 49.78 Favored 'General case' 0 C--N 1.36 1.03 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 167.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.449 ' O ' HD21 ' A' ' 49' ' ' LEU . 15.9 m -106.35 133.41 51.08 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 103.964 -2.606 . . . . 0.0 103.964 174.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -80.82 -10.76 59.69 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 121.717 3.969 . . . . 0.0 121.717 -170.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.47 -48.03 74.05 Favored 'General case' 0 N--CA 1.495 1.778 1 CA-C-N 126.582 4.265 . . . . 0.0 117.054 -175.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.83 HD22 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.47 -34.81 78.58 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-O 128.031 3.777 . . . . 0.0 113.804 174.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.83 ' H ' HD22 ' A' ' 49' ' ' LEU . 0.2 OUTLIER -72.84 -44.87 60.88 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 109.729 -3.396 . . . . 0.0 108.887 171.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.463 ' HA ' ' CG2' ' A' ' 54' ' ' ILE . 19.6 t70 -55.77 -30.03 60.6 Favored 'General case' 0 C--N 1.37 1.467 0 C-N-CA 127.818 2.447 . . . . 0.0 109.665 -179.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.4 ttm-85 -68.16 -55.96 10.48 Favored 'General case' 0 C--N 1.375 1.714 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 157.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.26 -30.35 71.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 120.603 3.557 . . . . 0.0 120.603 -177.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.724 HD12 HD21 ' A' ' 50' ' ' LEU . 5.4 tt -75.36 -39.65 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.723 1 C-N-CA 131.962 4.105 . . . . 0.0 110.619 178.635 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.569 ' HG2' HG23 ' A' ' 54' ' ' ILE . 19.3 mm-40 -107.82 -22.43 12.46 Favored 'General case' 0 C--N 1.373 1.617 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -86.5 10.11 16.28 Favored 'General case' 0 C--N 1.377 1.768 0 CA-C-N 122.597 2.453 . . . . 0.0 113.82 -172.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -155.13 -52.85 0.09 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 125.794 1.638 . . . . 0.0 108.88 179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.403 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.507 0.0 OUTLIER 75.85 160.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.373 1.629 0 C-N-CA 126.565 1.946 . . . . 0.0 110.125 -179.727 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.451 ' N ' ' HG ' ' A' ' 14' ' ' LEU . 20.8 t70 34.87 45.63 0.16 Allowed 'General case' 0 N--CA 1.512 2.629 1 C-N-CA 131.821 4.048 . . . . 0.0 113.045 -175.244 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.43 ' O ' HG12 ' A' ' 63' ' ' VAL 0.622 0.0 OUTLIER -83.38 68.64 9.79 Favored 'General case' 0 C--O 1.206 -1.201 0 C-N-CA 128.018 2.527 . . . . 0.0 109.971 -178.233 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.502 HG22 ' CD2' ' A' ' 17' ' ' HIS 0.292 23.4 p -79.51 -18.19 52.44 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 130.354 3.461 . . . . 0.0 112.896 177.785 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -65.26 -33.72 76.66 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 131.467 3.907 . . . . 0.0 111.009 170.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.594 HG23 HD21 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -60.07 -47.43 91.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.24 0 C-N-CA 130.712 3.605 . . . . 0.0 108.351 -179.524 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.541 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.297 29.2 m-85 -64.61 -40.63 95.84 Favored 'General case' 0 CA--C 1.494 -1.174 1 C-N-CA 134.569 5.148 . . . . 0.0 113.628 171.585 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -65.35 -45.26 84.9 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 127.565 2.346 . . . . 0.0 114.414 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.562 HD12 HD21 ' A' ' 113' ' ' LEU . 3.2 tm? -66.57 -51.04 60.83 Favored 'General case' 0 CA--C 1.567 1.617 0 C-N-CA 124.888 1.275 . . . . 0.0 112.166 171.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.749 0.0 OUTLIER -72.08 -14.71 61.92 Favored 'General case' 0 C--N 1.379 1.864 1 O-C-N 116.155 -4.091 . . . . 0.0 112.417 177.476 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.609 ' CE1' HE21 ' A' ' 24' ' ' GLN . 21.2 m-70 -75.82 -27.6 57.97 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 129.124 2.969 . . . . 0.0 111.136 165.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.336 43.6 mmtm -69.1 -27.02 65.23 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.269 -1.52 . . . . 0.0 109.836 159.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 153' ' ' GLN 0.495 5.5 mt -70.39 -9.08 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 N-CA-C 119.296 3.072 . . . . 0.0 119.296 166.544 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.445 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 16.3 pttm -75.21 -13.38 60.44 Favored 'General case' 0 CA--C 1.512 -0.517 1 O-C-N 116.027 -4.171 . . . . 0.0 114.054 177.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.381 70.4 m-20 -92.84 -27.31 17.22 Favored 'General case' 0 N--CA 1.432 -1.369 0 C-N-CA 129.422 3.089 . . . . 0.0 112.694 -178.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.457 ' CD2' HG12 ' A' ' 70' ' ' ILE . 3.6 t-80 -70.93 -1.09 10.76 Favored 'General case' 0 CA--C 1.493 -1.228 1 C-N-CA 135.012 5.325 . . . . 0.0 115.544 -170.773 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.58 HG21 ' HB3' ' A' ' 32' ' ' ALA . 55.0 t -27.33 -45.25 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.361 1.075 1 C-N-CA 132.104 4.162 . . . . 0.0 117.502 169.424 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.13 -31.39 62.73 Favored 'General case' 0 C--N 1.371 1.543 0 C-N-CA 127.458 2.303 . . . . 0.0 112.753 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -75.38 -43.26 51.16 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 126.415 1.886 . . . . 0.0 111.926 176.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.306 8.6 p -70.15 -31.2 46.59 Favored 'Isoleucine or valine' 0 C--N 1.373 1.595 0 C-N-CA 126.709 2.004 . . . . 0.0 110.804 172.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.505 ' HB3' HG21 ' A' ' 38' ' ' VAL . 49.0 m-20 -71.9 -30.65 65.6 Favored 'General case' 0 C--N 1.357 0.93 0 O-C-N 119.293 -2.13 . . . . 0.0 115.373 169.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -68.89 -34.62 75.72 Favored 'General case' 0 C--N 1.37 1.484 0 O-C-N 118.08 -2.887 . . . . 0.0 109.551 165.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . 0.49 9.6 t80 -73.53 -4.39 33.61 Favored 'General case' 0 C--N 1.367 1.338 1 C-N-CA 131.779 4.032 . . . . 0.0 115.678 171.634 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.628 HD13 ' HB3' ' A' ' 125' ' ' LYS . 2.1 mt -40.65 -44.02 2.05 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 130.867 3.667 . . . . 0.0 113.152 -172.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.582 ' O ' HG11 ' A' ' 117' ' ' VAL 0.322 1.1 t -112.38 -43.25 3.54 Favored 'General case' 0 C--N 1.381 1.952 0 CA-C-N 123.755 2.979 . . . . 0.0 115.854 151.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.54 ' HE3' HG23 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -129.73 166.73 23.92 Favored Pre-proline 0 C--N 1.359 0.985 0 N-CA-C 100.949 -3.723 . . . . 0.0 100.949 166.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -60.84 119.5 6.71 Favored 'Trans proline' 0 CA--C 1.565 2.05 0 CA-C-N 126.909 3.503 . . . . 0.0 109.618 162.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.529 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 87.0 Cg_exo 39.29 135.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.29 1 C-N-CA 129.896 7.064 . . . . 0.0 121.871 -154.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.408 ' HD2' ' HB3' ' A' ' 85' ' ' PRO 0.444 0.0 OUTLIER -6.03 6.07 0.0 OUTLIER Pre-proline 0 CA--C 1.595 2.683 3 N-CA-C 139.969 10.729 . . . . 0.0 139.969 167.497 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.529 ' HD3' ' O ' ' A' ' 85' ' ' PRO . 19.1 Cg_endo -131.5 160.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.894 2 CA-C-N 137.453 7.269 . . . . 0.0 116.448 -134.589 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.33 -13.33 15.7 Favored 'General case' 0 C--N 1.365 1.269 0 CA-C-O 124.735 2.207 . . . . 0.0 110.114 177.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -122.64 113.68 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.12 0 C-N-CA 130.082 3.353 . . . . 0.0 107.785 -176.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -94.56 -1.94 52.44 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 127.679 2.392 . . . . 0.0 110.133 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -100.02 -18.41 17.04 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 126.119 1.768 . . . . 0.0 112.853 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -127.89 -21.05 3.75 Favored 'General case' 0 CA--C 1.495 -1.144 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 -171.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -131.39 2.44 4.2 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 119.309 3.077 . . . . 0.0 119.309 -168.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.71 HD12 ' HB ' ' A' ' 97' ' ' VAL . 36.7 pt -88.45 138.57 18.89 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 N-CA-C 116.054 1.872 . . . . 0.0 116.054 -178.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -143.25 -25.65 0.59 Allowed 'General case' 0 CA--C 1.504 -0.813 0 CA-C-N 112.235 -2.257 . . . . 0.0 111.541 -176.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.22 -2.28 60.67 Favored Glycine 0 C--N 1.354 1.561 0 C-N-CA 124.235 0.921 . . . . 0.0 111.166 175.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.71 ' HB ' HD12 ' A' ' 94' ' ' ILE . 97.2 t -95.53 114.61 32.56 Favored 'Isoleucine or valine' 0 C--N 1.368 1.388 0 CA-C-O 124.184 1.945 . . . . 0.0 112.726 -178.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -92.76 19.35 7.64 Favored 'General case' 0 CA--C 1.542 0.654 1 C-N-CA 132.504 4.322 . . . . 0.0 114.74 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 60.61 35.37 19.97 Favored 'General case' 0 N--CA 1.473 0.68 1 C-N-CA 131.767 4.027 . . . . 0.0 116.018 -177.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 70.2 mtm180 -113.05 168.02 8.34 Favored Pre-proline 0 C--N 1.355 0.833 0 C-N-CA 129.859 3.264 . . . . 0.0 110.328 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -60.13 174.58 1.34 Allowed 'Trans proline' 0 C--N 1.359 1.099 1 C-N-CA 126.469 4.78 . . . . 0.0 117.583 173.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.32 20.95 6.45 Favored Glycine 0 C--N 1.356 1.644 0 C-N-CA 127.114 2.292 . . . . 0.0 117.154 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.573 ' HE ' ' HG2' ' A' ' 120' ' ' PRO . 93.6 mtt180 -132.95 144.05 49.87 Favored 'General case' 0 C--N 1.351 0.668 0 N-CA-C 100.336 -3.95 . . . . 0.0 100.336 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.5 pp -120.79 147.94 44.67 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 121.201 -0.937 . . . . 0.0 112.333 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.422 ' HA ' ' HA2' ' A' ' 114' ' ' GLY . 41.2 tt0 -130.24 120.64 24.77 Favored 'General case' 0 C--N 1.368 1.397 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 178.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 6.3 pt -134.64 138.23 49.85 Favored 'Isoleucine or valine' 0 C--N 1.35 0.604 0 C-N-CA 125.089 1.355 . . . . 0.0 109.723 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.627 HG22 ' HB3' ' A' ' 148' ' ' ALA . 5.4 t -118.62 129.22 55.2 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 -178.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.403 ' HB2' HG13 ' A' ' 150' ' ' ILE . 6.4 t0 -154.5 -174.74 5.09 Favored 'General case' 0 C--N 1.367 1.346 0 N-CA-C 102.253 -3.24 . . . . 0.0 102.253 174.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 83.0 -66.65 3.9 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 119.23 -2.169 . . . . 0.0 113.547 173.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 159.64 -31.4 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.066 1 C-N-CA 139.902 7.281 . . . . 0.0 104.209 -163.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.833 ' HG ' HG23 ' A' ' 136' ' ' ILE . 4.5 mp -78.53 137.23 37.81 Favored 'General case' 0 C--N 1.368 1.393 1 C-N-CA 133.845 4.858 . . . . 0.0 121.064 -171.129 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -94.2 103.34 15.38 Favored 'General case' 0 C--N 1.375 1.676 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 164.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.562 HD21 HD12 ' A' ' 66' ' ' LEU . 3.1 mm? -100.12 133.51 44.41 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 105' ' ' GLU . . . -110.21 141.52 16.28 Favored Glycine 0 C--N 1.343 0.937 0 N-CA-C 105.56 -3.016 . . . . 0.0 105.56 173.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -129.16 133.91 47.8 Favored 'General case' 0 C--N 1.353 0.755 1 N-CA-C 99.403 -4.295 . . . . 0.0 99.403 179.041 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 42.1 p -134.37 137.65 44.28 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 -171.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.582 HG11 ' O ' ' A' ' 82' ' ' SER 0.27 1.6 p -92.02 151.72 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 C-N-CA 125.39 1.476 . . . . 0.0 112.602 179.526 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 15.5 p -58.73 97.94 0.03 OUTLIER 'General case' 0 C--N 1.39 2.348 0 C-N-CA 128.063 2.545 . . . . 0.0 113.583 -177.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.597 17.8 ptpt 46.52 86.66 0.13 Allowed Pre-proline 0 C--N 1.351 0.651 0 C-N-CA 129.1 2.96 . . . . 0.0 115.501 -165.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.573 ' HG2' ' HE ' ' A' ' 103' ' ' ARG . 4.9 Cg_exo -45.33 108.87 0.15 Allowed 'Trans proline' 0 C--N 1.364 1.368 1 C-N-CA 125.914 4.409 . . . . 0.0 118.863 -159.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.434 HD22 ' N ' ' A' ' 121' ' ' ASN . 0.0 OUTLIER -157.95 149.76 21.82 Favored 'General case' 0 C--N 1.364 1.216 0 C-N-CA 130.056 3.342 . . . . 0.0 109.268 -169.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -146.52 100.47 3.35 Favored 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 123.181 1.467 . . . . 0.0 110.11 166.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -108.1 -7.39 16.09 Favored 'General case' 0 N--CA 1.432 -1.374 0 CA-C-N 113.044 -1.889 . . . . 0.0 107.554 169.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.437 17.4 m-85 -157.0 176.01 13.33 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -164.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.628 ' HB3' HD13 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -138.28 104.99 5.34 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 103.641 -2.725 . . . . 0.0 103.641 177.841 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.9 t70 160.28 -25.89 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.542 0 C-N-CA 129.567 3.147 . . . . 0.0 115.94 -167.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.343 76.1 Cg_exo -53.12 -178.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.385 2.474 1 C-N-CA 127.638 5.559 . . . . 0.0 119.131 -179.195 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . 0.423 ' HA ' ' O ' ' A' ' 42' ' ' HIS . 30.2 t -103.29 152.37 21.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.335 2.254 . . . . 0.0 109.392 -172.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.401 HD12 HD13 ' A' ' 43' ' ' LEU . 20.2 mt -102.34 130.85 49.19 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 177.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -89.53 38.55 0.91 Allowed 'General case' 0 C--N 1.383 2.042 0 C-N-CA 128.427 2.691 . . . . 0.0 111.26 -163.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 19.5 t 98.66 143.93 0.02 OUTLIER 'General case' 0 C--N 1.371 1.521 0 C-N-CA 125.754 1.622 . . . . 0.0 106.929 -168.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.51 HH22 HG21 ' A' ' 25' ' ' ILE . 38.1 mtm180 -107.18 122.37 46.39 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 100.452 -3.907 . . . . 0.0 100.452 168.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.444 ' SD ' ' HB2' ' A' ' 49' ' ' LEU . 1.6 tmm? -93.02 118.67 31.45 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 104.313 -2.477 . . . . 0.0 104.313 -174.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -124.67 114.96 20.01 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . 0.267 80.4 mt -140.08 148.59 22.53 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.833 HG23 ' HG ' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -133.96 -178.76 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 124.877 2.275 . . . . 0.0 110.461 -169.129 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.686 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.3 OUTLIER -157.28 138.67 13.79 Favored 'General case' 0 N--CA 1.441 -0.89 1 C-N-CA 134.268 5.027 . . . . 0.0 102.02 176.416 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.527 ' HB2' ' HG ' ' A' ' 141' ' ' LEU . 0.9 OUTLIER -164.91 -115.07 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 120.137 3.384 . . . . 0.0 120.137 -168.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.635 ' CD ' ' HG2' ' A' ' 140' ' ' ARG 0.25 0.0 OUTLIER -103.44 -69.48 0.8 Allowed 'General case' 0 C--N 1.354 0.763 1 C-N-CA 133.515 4.726 . . . . 0.0 114.594 -159.482 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.635 ' HG2' ' CD ' ' A' ' 139' ' ' ARG . 12.5 ptp180 -111.55 9.92 21.22 Favored 'General case' 0 N--CA 1.446 -0.647 1 C-N-CA 133.05 4.54 . . . . 0.0 107.25 173.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.623 HD23 ' CD ' ' A' ' 139' ' ' ARG . 0.3 OUTLIER -84.53 163.69 46.01 Favored Pre-proline 0 CA--C 1.574 1.868 0 CA-C-O 115.658 -2.115 . . . . 0.0 106.878 -156.72 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.514 ' HD2' HD13 ' A' ' 141' ' ' LEU . 55.3 Cg_exo -54.43 -29.66 60.0 Favored 'Trans proline' 0 N--CA 1.48 0.698 3 N-CA-C 123.644 4.44 . . . . 0.0 123.644 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -161.98 -165.66 19.31 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 127.893 2.663 . . . . 0.0 110.939 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.505 ' HA ' ' HB2' ' A' ' 137' ' ' ASN . 35.7 ttmt -135.45 139.55 44.17 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 131.098 3.759 . . . . 0.0 110.956 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -179.57 178.6 0.65 Allowed 'General case' 0 C--N 1.367 1.355 0 C-N-CA 126.44 1.896 . . . . 0.0 110.483 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . 0.352 2.1 p 158.45 107.9 0.0 OUTLIER 'General case' 0 C--N 1.367 1.331 0 C-N-CA 130.512 3.525 . . . . 0.0 111.168 173.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -168.77 89.12 0.22 Allowed 'General case' 0 C--N 1.361 1.091 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.627 ' HB3' HG22 ' A' ' 107' ' ' THR . . . -177.55 170.63 2.02 Favored 'General case' 0 C--N 1.364 1.201 0 N-CA-C 100.468 -3.901 . . . . 0.0 100.468 -177.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 30.0 m -117.63 150.62 19.69 Favored 'Isoleucine or valine' 0 C--N 1.375 1.7 0 CA-C-N 123.079 2.672 . . . . 0.0 116.425 -174.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.564 HD12 ' O ' ' A' ' 151' ' ' LYS 0.424 0.1 OUTLIER -130.82 147.01 33.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 1 N-CA-C 125.988 5.551 . . . . 0.0 125.988 -160.316 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.564 ' O ' HD12 ' A' ' 150' ' ' ILE 0.324 0.0 OUTLIER -78.92 149.04 32.48 Favored 'General case' 0 CA--C 1.496 -1.116 1 C-N-CA 140.861 7.664 . . . . 0.0 101.059 159.66 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.608 ' O ' HG23 ' A' ' 152' ' ' THR . 11.7 t -79.35 97.21 6.23 Favored 'General case' 0 CA--C 1.566 1.561 1 CA-C-O 129.689 4.566 . . . . 0.0 111.108 168.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.563 ' HB2' HD11 ' A' ' 70' ' ' ILE . 3.7 tt0 . . . . . 1 N--CA 1.37 -4.46 2 C-N-CA 138.226 6.611 . . . . 0.0 106.838 173.063 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.1 tpp . . . . . 0 C--O 1.233 0.214 0 N-CA-C 107.427 -1.324 . . . . 0.0 107.427 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 53.9 p -120.77 116.59 25.53 Favored 'General case' 0 C--N 1.365 1.25 0 C-N-CA 126.299 1.839 . . . . 0.0 112.517 -177.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.8 mm -89.54 59.7 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.364 0 CA-C-O 125.179 2.419 . . . . 0.0 109.47 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.615 ' HA ' ' HB ' ' A' ' 7' ' ' VAL 0.366 10.8 t-20 -54.44 -3.19 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.554 1 C-N-CA 133.831 4.852 . . . . 0.0 120.306 -170.833 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.05 -59.2 2.56 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 130.894 3.678 . . . . 0.0 111.145 172.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.77 -12.31 61.48 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 128.142 2.577 . . . . 0.0 112.47 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.615 ' HB ' ' HA ' ' A' ' 4' ' ' ASN . 5.7 t -88.43 -30.11 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 C-N-CA 130.508 3.523 . . . . 0.0 108.39 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.4 ' HA ' ' HE ' ' A' ' 11' ' ' ARG . 45.2 t80 -73.57 -42.11 62.04 Favored 'General case' 0 C--N 1.369 1.426 0 C-N-CA 125.778 1.631 . . . . 0.0 109.038 174.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 35.7 mt -60.69 -42.91 93.75 Favored 'Isoleucine or valine' 0 C--N 1.369 1.433 0 C-N-CA 126.958 2.103 . . . . 0.0 110.875 168.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.289 11.4 tpp180 -65.07 -47.29 77.81 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 8' ' ' PHE . 79.4 mtm180 -57.89 -31.82 67.12 Favored 'General case' 0 C--N 1.379 1.849 0 C-N-CA 128.77 2.828 . . . . 0.0 117.507 167.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -77.15 -46.62 22.81 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 127.384 2.273 . . . . 0.0 110.683 170.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.64 ' HA ' ' HG3' ' A' ' 16' ' ' ARG 0.337 31.1 mtpt -59.3 -28.42 66.75 Favored 'General case' 0 C--N 1.367 1.341 0 C-N-CA 126.646 1.979 . . . . 0.0 111.36 172.271 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.722 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.6 OUTLIER -71.81 -49.31 39.72 Favored 'General case' 0 C--O 1.21 -1.018 0 C-N-CA 125.504 1.522 . . . . 0.0 111.591 169.474 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.386 15.5 ptt180 -55.78 -33.34 64.27 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 170.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.64 ' HG3' ' HA ' ' A' ' 13' ' ' LYS 0.292 0.1 OUTLIER -75.43 -38.16 59.96 Favored 'General case' 0 C--N 1.399 2.747 0 O-C-N 120.393 -1.442 . . . . 0.0 113.772 167.009 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.296 89.6 m-70 -56.93 -44.89 82.93 Favored 'General case' 0 C--N 1.395 2.552 0 C-N-CA 130.177 3.391 . . . . 0.0 109.402 172.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.602 ' CE1' HD11 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -65.51 -53.49 41.71 Favored 'General case' 0 C--N 1.368 1.389 0 C-N-CA 129.78 3.232 . . . . 0.0 110.802 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -69.07 -40.01 78.74 Favored 'General case' 0 C--N 1.372 1.574 0 N-CA-C 117.951 2.574 . . . . 0.0 117.951 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.3 m -73.56 -35.47 65.47 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 126.861 2.064 . . . . 0.0 112.371 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.536 ' HB3' ' CD2' ' A' ' 64' ' ' PHE 0.281 50.7 mt-10 -77.3 -29.09 53.52 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 119.279 -2.138 . . . . 0.0 109.988 168.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -34.21 74.64 Favored 'General case' 0 C--N 1.376 1.72 0 O-C-N 119.196 -2.19 . . . . 0.0 112.637 169.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.321 7.4 ptm180 -69.65 -35.91 75.6 Favored 'General case' 0 C--N 1.375 1.7 0 CA-C-O 118.17 -0.919 . . . . 0.0 113.473 164.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -59.46 -50.41 74.03 Favored 'General case' 0 C--N 1.371 1.513 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.3 mt -71.77 -44.56 68.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 C-N-CA 125.475 1.51 . . . . 0.0 110.35 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.596 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.625 0.0 OUTLIER -70.15 -24.11 63.11 Favored 'General case' 0 C--N 1.375 1.679 0 O-C-N 119.396 -2.065 . . . . 0.0 114.247 174.443 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -75.02 -37.35 61.8 Favored 'General case' 0 C--N 1.375 1.693 0 O-C-N 119.683 -1.886 . . . . 0.0 112.879 170.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.505 ' HA ' ' HG2' ' A' ' 31' ' ' GLU 0.451 0.0 OUTLIER -69.3 -34.4 74.62 Favored 'General case' 0 C--N 1.402 2.89 0 CA-C-N 122.816 2.553 . . . . 0.0 113.735 172.866 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.73 HD13 ' CE1' ' A' ' 41' ' ' PHE 0.257 2.2 pp -67.19 -44.94 87.42 Favored 'Isoleucine or valine' 0 C--N 1.387 2.202 0 C-N-CA 124.624 1.169 . . . . 0.0 112.183 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 83.2 mtm180 -61.25 -38.57 87.18 Favored 'General case' 0 C--N 1.363 1.167 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 170.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.505 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.9 pt-20 -76.87 -41.57 43.34 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 119.432 -2.043 . . . . 0.0 113.031 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB3' HG21 ' A' ' 74' ' ' VAL . . . -73.46 -39.66 64.76 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.494 ' HA ' HD21 ' A' ' 78' ' ' ASN . 10.3 t -71.46 -35.5 70.89 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 124.896 1.278 . . . . 0.0 110.356 174.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -70.4 -38.0 74.59 Favored 'General case' 0 C--N 1.388 2.244 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 167.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.04 -30.42 62.41 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 126.298 1.839 . . . . 0.0 114.251 176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.25 -18.9 61.18 Favored 'General case' 0 C--N 1.383 2.028 0 CA-C-N 120.018 1.281 . . . . 0.0 112.162 170.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.14 18.23 47.39 Favored Glycine 0 C--N 1.376 2.753 0 CA-C-O 121.82 0.678 . . . . 0.0 113.355 168.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.511 HG23 HD22 ' A' ' 81' ' ' LEU . 0.5 OUTLIER -119.89 162.76 18.0 Favored 'Isoleucine or valine' 0 C--N 1.353 0.752 0 C-N-CA 123.774 0.83 . . . . 0.0 109.343 -175.212 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 22.67 -51.09 0.0 OUTLIER 'General case' 0 C--N 1.371 1.504 1 C-N-CA 137.974 6.51 . . . . 0.0 120.718 176.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.2 m 72.75 92.48 0.08 Allowed 'General case' 0 C--N 1.364 1.209 0 C-N-CA 131.141 3.776 . . . . 0.0 109.737 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.73 ' CE1' HD13 ' A' ' 29' ' ' ILE . 36.7 p90 -113.96 140.87 48.05 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 122.019 0.914 . . . . 0.0 111.568 -172.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -102.71 167.64 9.77 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 129.163 2.985 . . . . 0.0 105.114 170.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.397 2.8 pp -122.64 156.6 33.99 Favored 'General case' 0 CA--C 1.495 -1.162 0 O-C-N 119.639 -1.913 . . . . 0.0 110.829 167.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -138.83 146.01 40.74 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 100.33 -3.952 . . . . 0.0 100.33 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -142.66 151.8 41.77 Favored 'General case' 0 CA--C 1.499 -1.005 0 CA-C-O 121.719 0.771 . . . . 0.0 110.151 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.3 t -105.23 140.62 38.11 Favored 'General case' 0 C--N 1.358 0.952 0 N-CA-C 103.899 -2.63 . . . . 0.0 103.899 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . 0.327 7.4 mm-40 -80.82 -9.27 59.83 Favored 'General case' 0 C--O 1.203 -1.369 0 C-N-CA 127.874 2.47 . . . . 0.0 116.309 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.06 -48.3 82.38 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 125.731 3.878 . . . . 0.0 118.367 -175.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.676 HD23 ' H ' ' A' ' 134' ' ' ALA . 0.0 OUTLIER -64.81 -34.23 77.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-O 125.024 2.345 . . . . 0.0 112.365 172.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.755 ' CD2' HD11 ' A' ' 54' ' ' ILE 0.292 0.7 OUTLIER -68.09 -44.43 76.26 Favored 'General case' 0 C--O 1.196 -1.729 0 C-N-CA 129.671 3.188 . . . . 0.0 107.03 172.79 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -54.58 -37.83 65.99 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 129.461 3.104 . . . . 0.0 111.253 176.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -71.87 -39.34 69.7 Favored 'General case' 0 C--N 1.374 1.645 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 163.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.66 95.03 Favored 'General case' 0 C--N 1.379 1.876 0 CA-C-N 124.607 3.367 . . . . 0.0 115.345 170.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.755 HD11 ' CD2' ' A' ' 50' ' ' LEU . 56.7 mt -58.8 -45.79 91.22 Favored 'Isoleucine or valine' 0 C--N 1.368 1.389 1 C-N-CA 133.686 4.795 . . . . 0.0 112.562 176.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -106.99 -21.89 12.85 Favored 'General case' 0 C--N 1.366 1.317 0 N-CA-C 118.659 2.836 . . . . 0.0 118.659 172.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.4 ttp-105 -87.32 -30.91 20.48 Favored 'General case' 0 C--N 1.366 1.305 0 CA-C-N 123.893 3.042 . . . . 0.0 111.498 -178.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.705 ' HA ' HD22 ' A' ' 141' ' ' LEU . 23.4 mt-10 -102.75 -57.56 2.03 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 125.689 1.595 . . . . 0.0 111.309 -176.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.457 HD12 ' N ' ' A' ' 59' ' ' ASP 0.557 0.2 OUTLIER 55.44 135.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.573 0 C-N-CA 129.152 2.981 . . . . 0.0 114.379 178.475 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.457 ' N ' HD12 ' A' ' 58' ' ' ILE 0.718 32.8 t70 61.07 25.26 15.3 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 127.784 2.433 . . . . 0.0 113.73 -174.54 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.534 ' O ' HG12 ' A' ' 63' ' ' VAL 0.873 0.4 OUTLIER -65.42 58.31 0.03 OUTLIER 'General case' 0 C--O 1.2 -1.539 0 C-N-CA 129.597 3.159 . . . . 0.0 117.314 -177.09 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.503 1.7 p -78.6 -10.01 59.58 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 130.977 3.711 . . . . 0.0 114.681 174.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.781 ' CE2' HG21 ' A' ' 136' ' ' ILE . 71.1 t80 -68.18 -34.23 75.91 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 129.238 3.015 . . . . 0.0 108.156 165.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 60' ' ' GLU 0.279 0.4 OUTLIER -62.87 -46.04 97.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.362 0 C-N-CA 129.623 3.169 . . . . 0.0 107.929 177.957 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.536 ' CD2' ' HB3' ' A' ' 21' ' ' GLU . 85.1 m-85 -61.44 -32.61 72.59 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 131.678 3.991 . . . . 0.0 115.175 164.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -73.61 -43.44 59.64 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-N 123.63 2.923 . . . . 0.0 112.016 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.642 ' HG ' ' HA3' ' A' ' 109' ' ' GLY . 0.9 OUTLIER -70.64 -40.32 73.13 Favored 'General case' 0 CA--C 1.559 1.324 0 N-CA-C 113.737 1.014 . . . . 0.0 113.737 172.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 64' ' ' PHE 0.913 0.0 OUTLIER -77.76 -16.28 58.51 Favored 'General case' 0 C--N 1.377 1.787 0 O-C-N 119.972 -1.705 . . . . 0.0 114.754 176.315 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.432 ' CD2' ' O ' ' A' ' 64' ' ' PHE . 31.3 m-70 -76.29 -30.24 57.69 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 127.972 2.509 . . . . 0.0 108.622 163.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -72.26 -25.49 61.63 Favored 'General case' 0 C--N 1.377 1.762 0 O-C-N 119.473 -2.017 . . . . 0.0 112.301 163.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.429 HG13 ' HA ' ' A' ' 67' ' ' PHE . 1.0 OUTLIER -74.68 -31.63 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 C-N-CA 128.463 2.705 . . . . 0.0 111.581 172.339 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 pttp -52.68 -24.54 8.75 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 129.949 3.299 . . . . 0.0 118.676 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.267 35.8 t70 -97.37 -27.24 14.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 127.155 2.182 . . . . 0.0 109.513 -175.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.505 ' CE1' ' H ' ' A' ' 152' ' ' THR . 16.0 m-70 -77.28 6.79 6.09 Favored 'General case' 0 C--N 1.368 1.377 1 C-N-CA 132.454 4.302 . . . . 0.0 114.708 -174.501 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 32' ' ' ALA . 93.0 t -36.72 -35.68 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.385 2.122 0 C-N-CA 129.16 2.984 . . . . 0.0 115.915 166.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.417 HD22 ' H ' ' A' ' 75' ' ' LEU . 0.8 OUTLIER -70.29 -34.25 72.53 Favored 'General case' 0 C--N 1.365 1.252 0 O-C-N 119.783 -1.823 . . . . 0.0 113.6 177.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 79' ' ' GLU 0.323 35.0 mt-10 -76.41 -34.04 58.81 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 125.294 1.438 . . . . 0.0 113.794 171.715 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.345 1.9 m -70.72 -36.96 67.24 Favored 'Isoleucine or valine' 0 C--N 1.377 1.785 0 CA-C-O 125.439 2.542 . . . . 0.0 110.68 172.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.564 ' O ' HD23 ' A' ' 81' ' ' LEU . 44.1 m-20 -65.34 -32.41 74.03 Favored 'General case' 0 C--N 1.353 0.741 0 C-N-CA 128.107 2.563 . . . . 0.0 112.559 169.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 76' ' ' GLU 0.404 5.6 pt-20 -71.5 -29.66 65.05 Favored 'General case' 0 C--N 1.369 1.439 0 O-C-N 117.7 -3.125 . . . . 0.0 112.33 164.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -74.41 -5.59 43.29 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 128.14 2.576 . . . . 0.0 114.197 168.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 78' ' ' ASN . 2.9 pp -40.04 -46.73 2.17 Favored 'General case' 0 N--CA 1.508 2.43 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 -164.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 60.3 p -112.6 -49.15 2.96 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-N 125.404 3.729 . . . . 0.0 113.175 138.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.506 ' CE ' HG23 ' A' ' 97' ' ' VAL . 0.8 OUTLIER -130.13 169.52 13.24 Favored Pre-proline 0 N--CA 1.442 -0.839 2 C-N-CA 144.316 9.046 . . . . 0.0 99.519 156.353 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -52.32 149.45 22.71 Favored 'Trans proline' 0 CA--C 1.568 2.187 1 CA-C-N 129.663 4.487 . . . . 0.0 113.486 171.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . 0.281 21.6 Cg_exo -32.98 148.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.908 2 C-N-CA 127.95 5.766 . . . . 0.0 125.345 -151.173 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 24.7 mtm180 -105.87 53.24 0.15 Allowed Pre-proline 0 C--N 1.374 1.656 0 N-CA-C 118.584 2.809 . . . . 0.0 118.584 174.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -51.35 160.89 2.06 Favored 'Trans proline' 0 C--N 1.373 1.856 1 C-N-CA 129.051 6.501 . . . . 0.0 117.369 170.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -43.76 -43.21 5.94 Favored 'General case' 0 C--N 1.359 1.021 1 C-N-CA 133.005 4.522 . . . . 0.0 118.305 -173.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -77.47 154.25 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 C-N-CA 127.79 2.436 . . . . 0.0 114.653 173.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -115.64 -11.44 11.69 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 112.972 -1.922 . . . . 0.0 110.209 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -104.69 -27.67 11.67 Favored 'General case' 0 C--N 1.354 0.795 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 -175.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -109.92 1.83 19.39 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 126.855 2.062 . . . . 0.0 111.328 -176.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.332 0.2 OUTLIER -140.16 -86.85 0.2 Allowed 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 179.894 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . 0.306 0.4 OUTLIER -84.56 87.33 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.861 0 CA-C-O 127.849 3.69 . . . . 0.0 117.542 -169.661 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -106.18 -19.16 13.8 Favored 'General case' 0 C--N 1.313 -0.995 2 CA-C-N 105.142 -5.481 . . . . 0.0 110.118 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -91.91 -9.79 62.06 Favored Glycine 0 C--N 1.363 2.039 0 C-N-CA 127.097 2.284 . . . . 0.0 110.761 174.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.506 HG23 ' CE ' ' A' ' 83' ' ' MET . 68.7 t -91.85 91.62 3.56 Favored 'Isoleucine or valine' 0 C--N 1.372 1.553 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 173.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -115.22 19.13 15.83 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 127.934 2.494 . . . . 0.0 108.475 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 57.39 70.88 0.61 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 130.393 3.477 . . . . 0.0 115.778 -177.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.2 mmm180 -112.15 167.05 9.73 Favored Pre-proline 0 C--N 1.358 0.962 0 C-N-CA 125.364 1.466 . . . . 0.0 111.426 -175.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -62.18 135.62 55.55 Favored 'Trans proline' 0 C--N 1.362 1.247 1 C-N-CA 125.332 4.021 . . . . 0.0 116.614 176.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.05 56.5 4.61 Favored Glycine 0 C--N 1.361 1.928 0 C-N-CA 125.235 1.398 . . . . 0.0 113.701 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -137.01 158.01 45.44 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 120.467 -1.607 . . . . 0.0 111.411 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.665 HD23 HD11 ' A' ' 106' ' ' ILE . 12.7 tp -133.02 151.77 52.03 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 126.397 1.879 . . . . 0.0 113.132 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -125.92 118.2 24.91 Favored 'General case' 0 C--N 1.369 1.433 0 N-CA-C 103.649 -2.722 . . . . 0.0 103.649 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.665 HD11 HD23 ' A' ' 104' ' ' LEU . 1.0 OUTLIER -122.95 119.19 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 126.882 2.073 . . . . 0.0 106.676 -174.173 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 149' ' ' VAL . 2.9 m -127.21 108.23 10.71 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.417 ' CG ' HD21 ' A' ' 66' ' ' LEU . 53.0 t0 -159.17 161.61 36.23 Favored 'General case' 0 CA--C 1.482 -1.657 0 N-CA-C 101.087 -3.671 . . . . 0.0 101.087 -172.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.642 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 83.8 -38.0 2.81 Favored Glycine 0 N--CA 1.474 1.222 0 O-C-N 119.708 -1.87 . . . . 0.0 114.251 174.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 108.95 0.3 0.01 OUTLIER 'General case' 0 N--CA 1.427 -1.613 1 C-N-CA 136.157 5.783 . . . . 0.0 108.19 -161.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.839 ' HA ' HG23 ' A' ' 136' ' ' ILE . 2.3 tp -79.78 129.36 34.41 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 128.867 2.867 . . . . 0.0 109.264 175.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.7 m95 -96.73 100.97 12.5 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 170.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.319 2.0 mm? -97.26 131.24 44.17 Favored 'General case' 0 C--N 1.374 1.661 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 173.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -105.92 125.3 8.15 Favored Glycine 0 C--N 1.351 1.394 0 N-CA-C 107.234 -2.346 . . . . 0.0 107.234 162.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.565 ' CE1' HD12 ' A' ' 106' ' ' ILE 0.294 1.0 OUTLIER -118.56 152.54 35.82 Favored 'General case' 0 C--N 1.374 1.667 0 CA-C-N 122.373 3.087 . . . . 0.0 106.712 179.163 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.7 m -122.27 137.8 54.72 Favored 'General case' 0 C--N 1.365 1.24 0 N-CA-C 100.438 -3.912 . . . . 0.0 100.438 166.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.22 128.64 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.369 0 N-CA-C 100.702 -3.814 . . . . 0.0 100.702 165.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.629 ' CB ' HD21 ' A' ' 121' ' ' ASN . 14.2 p 40.31 -137.4 0.12 Allowed 'General case' 0 C--N 1.363 1.163 0 N-CA-C 121.266 3.802 . . . . 0.0 121.266 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.359 88.3 tttt 159.31 -65.72 0.0 OUTLIER Pre-proline 0 N--CA 1.421 -1.885 2 C-N-CA 133.879 4.872 . . . . 0.0 109.182 161.812 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -75.46 53.62 3.59 Favored 'Trans proline' 0 CA--C 1.554 1.515 0 C-N-CA 123.267 2.644 . . . . 0.0 115.431 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.629 HD21 ' CB ' ' A' ' 118' ' ' CYS . 0.4 OUTLIER -170.16 172.32 6.41 Favored 'General case' 0 C--N 1.371 1.5 0 N-CA-C 117.148 2.277 . . . . 0.0 117.148 -177.542 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.623 ' HG2' ' H ' ' A' ' 124' ' ' PHE . 29.0 tt0 -141.83 -91.29 0.14 Allowed 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 128.495 2.718 . . . . 0.0 105.634 156.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 6.9 mptt 50.77 14.85 0.2 Allowed 'General case' 0 C--N 1.364 1.223 1 C-N-CA 136.735 6.014 . . . . 0.0 117.505 -172.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.623 ' H ' ' HG2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -169.83 -119.83 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.171 0 C-N-CA 130.669 3.588 . . . . 0.0 106.964 -167.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.465 ' H ' ' HB3' ' A' ' 124' ' ' PHE . 10.0 mmtt -108.72 -65.53 1.13 Allowed 'General case' 0 N--CA 1.425 -1.712 0 N-CA-C 102.634 -3.098 . . . . 0.0 102.634 171.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -177.31 145.98 0.62 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 128.341 2.657 . . . . 0.0 107.893 169.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -147.2 38.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.065 0 N-CA-C 118.681 2.531 . . . . 0.0 118.681 -171.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.8 m -144.06 156.37 44.35 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 170.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.24 130.47 53.38 Favored 'General case' 0 C--N 1.358 0.978 1 N-CA-C 99.001 -4.444 . . . . 0.0 99.001 159.739 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . 0.327 35.9 mt-30 -119.99 72.39 0.93 Allowed 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 120.232 -1.542 . . . . 0.0 107.311 -172.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.256 4.8 t 104.12 117.1 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 125.597 1.559 . . . . 0.0 110.124 -177.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -114.87 113.86 24.76 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 173.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.407 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 6.0 ttp -94.01 108.16 20.01 Favored 'General case' 0 CA--C 1.497 -1.063 0 C-N-CA 126.077 1.751 . . . . 0.0 108.465 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.676 ' H ' HD23 ' A' ' 49' ' ' LEU . . . -123.61 114.81 20.5 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 121.276 0.56 . . . . 0.0 110.227 -172.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 6.3 mm -134.68 134.17 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.398 1.079 . . . . 0.0 110.544 178.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.839 HG23 ' HA ' ' A' ' 111' ' ' LEU . 0.1 OUTLIER -142.65 -179.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.15 0 C-N-CA 127.488 2.315 . . . . 0.0 113.278 -173.087 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.88 106.34 18.32 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 131.156 3.782 . . . . 0.0 107.719 155.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.729 ' CB ' HD21 ' A' ' 141' ' ' LEU 0.277 0.4 OUTLIER -96.59 -91.91 0.23 Allowed 'General case' 0 C--N 1.364 1.198 0 N-CA-C 120.069 3.359 . . . . 0.0 120.069 -175.838 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.574 ' HB2' ' HG2' ' A' ' 140' ' ' ARG . 27.0 mtp180 -127.55 -51.99 1.37 Allowed 'General case' 0 C--N 1.371 1.5 0 CA-C-O 123.384 1.564 . . . . 0.0 109.2 -158.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.574 ' HG2' ' HB2' ' A' ' 139' ' ' ARG . 1.6 ptm180 -123.58 19.95 9.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 129.729 3.212 . . . . 0.0 111.335 -168.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.729 HD21 ' CB ' ' A' ' 138' ' ' SER . 0.4 OUTLIER -138.83 164.8 37.07 Favored Pre-proline 0 CA--C 1.492 -1.255 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.871 -170.325 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.59 -41.15 0.85 Allowed 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 124.566 3.511 . . . . 0.0 114.592 171.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 74.2 156.75 4.76 Favored Glycine 0 CA--C 1.496 -1.143 0 C-N-CA 129.567 3.46 . . . . 0.0 115.625 -162.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -85.96 98.71 10.96 Favored 'General case' 0 N--CA 1.44 -0.967 0 C-N-CA 128.596 2.758 . . . . 0.0 112.293 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . 74.72 -167.59 0.09 Allowed 'General case' 0 C--N 1.36 1.06 0 C-N-CA 129.17 2.988 . . . . 0.0 115.65 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 7.6 p -171.84 136.15 0.89 Allowed 'General case' 0 C--N 1.361 1.106 0 C-N-CA 126.044 1.738 . . . . 0.0 108.575 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 147' ' ' LYS . 19.1 tptt 168.01 155.61 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 101.986 -3.338 . . . . 0.0 101.986 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -150.03 85.93 1.42 Allowed 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 105.752 -1.944 . . . . 0.0 105.752 -176.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . 0.531 ' H ' HG22 ' A' ' 107' ' ' THR . 50.6 t -77.07 -53.81 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 C-N-CA 130.578 3.551 . . . . 0.0 115.169 -169.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.467 HD11 ' CG2' ' A' ' 106' ' ' ILE . 1.2 pp -107.3 146.08 13.95 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 C-N-CA 131.444 3.898 . . . . 0.0 112.948 -174.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.443 68.6 mttt -114.43 148.19 38.12 Favored 'General case' 0 C--N 1.355 0.845 1 N-CA-C 98.48 -4.637 . . . . 0.0 98.48 148.268 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.505 ' H ' ' CE1' ' A' ' 73' ' ' HIS 0.994 0.5 OUTLIER -76.82 146.05 38.04 Favored 'General case' 0 N--CA 1.494 1.74 1 N-CA-C 129.65 6.907 . . . . 0.0 129.65 -134.56 . . . . . . . . 5 4 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 . . . . . 0 N--CA 1.416 -2.133 2 C-N-CA 135.27 5.428 . . . . 0.0 105.418 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.7 tmm? . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . 0.452 7.7 p 73.39 179.76 0.21 Allowed 'General case' 0 C--N 1.358 0.952 0 C-N-CA 127.806 2.442 . . . . 0.0 117.406 -177.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.5 mm -83.75 44.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.364 1.21 0 C-N-CA 128.198 2.599 . . . . 0.0 115.04 -171.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.669 ' HA ' HG13 ' A' ' 7' ' ' VAL . 18.1 m-80 -59.44 -8.66 1.91 Allowed 'General case' 0 N--CA 1.476 0.856 1 C-N-CA 133.07 4.548 . . . . 0.0 115.838 176.1 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.74 -57.91 10.39 Favored 'General case' 0 C--N 1.347 0.495 1 C-N-CA 133.268 4.627 . . . . 0.0 111.694 171.594 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.0 -15.24 61.1 Favored 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.562 2.345 . . . . 0.0 113.294 177.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.669 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.252 0.6 OUTLIER -87.77 -37.03 10.28 Favored 'Isoleucine or valine' 0 C--N 1.355 0.827 0 C-N-CA 127.514 2.325 . . . . 0.0 110.565 179.304 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -70.26 -40.42 74.38 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 129.435 3.094 . . . . 0.0 108.795 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.17 -43.91 99.08 Favored 'Isoleucine or valine' 0 C--N 1.376 1.759 0 C-N-CA 125.02 1.328 . . . . 0.0 109.629 165.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.269 0.3 OUTLIER -58.11 -49.35 77.26 Favored 'General case' 0 C--N 1.37 1.472 0 N-CA-C 116.175 1.917 . . . . 0.0 116.175 171.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -62.4 -31.39 72.06 Favored 'General case' 0 C--N 1.366 1.32 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 169.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -77.15 -51.24 11.33 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 126.93 2.092 . . . . 0.0 111.846 174.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -59.11 -28.76 66.83 Favored 'General case' 0 C--N 1.367 1.339 0 C-N-CA 130.173 3.389 . . . . 0.0 110.15 173.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 54' ' ' ILE . 0.4 OUTLIER -70.14 -51.6 30.18 Favored 'General case' 0 C--N 1.374 1.643 0 C-N-CA 124.779 1.232 . . . . 0.0 111.27 167.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.3 ttt-85 -55.08 -39.56 69.43 Favored 'General case' 0 CA--C 1.566 1.587 0 C-N-CA 125.692 1.597 . . . . 0.0 112.622 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.5 mmt-85 -63.39 -43.86 96.37 Favored 'General case' 0 C--N 1.38 1.9 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 165.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.2 m-70 -56.89 -49.6 75.05 Favored 'General case' 0 C--N 1.39 2.368 0 C-N-CA 128.878 2.871 . . . . 0.0 110.327 171.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.661 ' CE2' HD11 ' A' ' 50' ' ' LEU . 1.4 t80 -54.92 -54.21 45.58 Favored 'General case' 0 C--N 1.379 1.864 0 C-N-CA 131.107 3.763 . . . . 0.0 110.079 176.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -71.72 -42.48 67.27 Favored 'General case' 0 C--N 1.372 1.58 0 N-CA-C 119.336 3.088 . . . . 0.0 119.336 178.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.6 m -69.95 -42.74 72.82 Favored 'General case' 0 C--N 1.363 1.183 0 C-N-CA 127.047 2.139 . . . . 0.0 113.337 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.626 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 4.5 mp0 -74.84 -29.19 60.97 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.208 1.403 . . . . 0.0 109.878 171.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 18' ' ' PHE 0.264 0.2 OUTLIER -62.26 -34.18 76.05 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.043 -1.66 . . . . 0.0 113.275 166.393 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -62.99 -37.55 87.62 Favored 'General case' 0 C--N 1.381 1.974 0 C-N-CA 124.313 1.045 . . . . 0.0 111.432 167.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 tp60 -60.16 -47.71 84.77 Favored 'General case' 0 C--N 1.371 1.537 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 166.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.6 mt -66.84 -45.11 88.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 O-C-N 120.942 -1.099 . . . . 0.0 112.162 178.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.59 ' HA ' HG13 ' A' ' 29' ' ' ILE 0.56 0.7 OUTLIER -72.75 -23.02 60.77 Favored 'General case' 0 C--N 1.366 1.322 0 O-C-N 120.248 -1.533 . . . . 0.0 114.796 173.528 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -73.38 -36.09 66.01 Favored 'General case' 0 C--N 1.362 1.149 0 O-C-N 120.223 -1.548 . . . . 0.0 112.41 168.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.545 ' HG2' ' HG2' ' A' ' 71' ' ' LYS . 4.0 tp10 -74.03 -43.32 58.34 Favored 'General case' 0 C--N 1.394 2.521 0 O-C-N 119.281 -2.137 . . . . 0.0 109.645 171.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.59 HG13 ' HA ' ' A' ' 26' ' ' ASN 0.431 0.7 OUTLIER -63.66 -42.55 96.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 CA-C-N 120.714 1.597 . . . . 0.0 115.058 176.507 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -71.12 -32.34 68.89 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 120.204 1.366 . . . . 0.0 114.114 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -76.45 -39.62 52.83 Favored 'General case' 0 C--N 1.377 1.781 0 O-C-N 119.449 -2.032 . . . . 0.0 111.275 177.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.63 -44.58 56.61 Favored 'General case' 0 C--N 1.358 0.948 0 C-N-CA 125.348 1.459 . . . . 0.0 114.277 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.263 59.5 p -68.43 -30.37 69.25 Favored 'General case' 0 C--N 1.354 0.799 0 O-C-N 120.092 -1.63 . . . . 0.0 112.481 175.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -70.05 -47.35 62.37 Favored 'General case' 0 C--N 1.379 1.848 0 N-CA-C 114.258 1.207 . . . . 0.0 114.258 162.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.41 -33.09 74.92 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 126.421 1.888 . . . . 0.0 115.988 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -14.96 61.48 Favored 'General case' 0 C--N 1.376 1.72 0 CA-C-N 119.865 1.211 . . . . 0.0 112.645 168.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.52 17.91 47.41 Favored Glycine 0 C--N 1.385 3.251 0 O-C-N 121.076 -1.015 . . . . 0.0 113.324 170.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.512 HG11 ' CG ' ' A' ' 78' ' ' ASN 0.277 0.6 OUTLIER -107.84 177.24 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.359 0.987 0 C-N-CA 126.534 1.934 . . . . 0.0 107.224 -174.868 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 6.94 -65.89 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.564 2 C-N-CA 135.758 5.623 . . . . 0.0 122.019 -178.617 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.0 m 80.28 88.72 0.05 OUTLIER 'General case' 0 C--N 1.36 1.05 1 C-N-CA 132.075 4.15 . . . . 0.0 102.422 -165.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.462 ' CZ ' HG21 ' A' ' 77' ' ' VAL 0.321 52.0 p90 -111.15 140.87 45.34 Favored 'General case' 0 C--N 1.361 1.1 0 CA-C-O 122.743 1.259 . . . . 0.0 109.666 -167.173 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -100.96 162.4 12.92 Favored 'General case' 0 CA--C 1.499 -1.014 0 C-N-CA 126.148 1.779 . . . . 0.0 106.808 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.72 122.46 44.59 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.014 0.926 . . . . 0.0 108.916 -178.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -137.49 141.38 41.5 Favored 'General case' 0 N--CA 1.426 -1.663 1 N-CA-C 99.233 -4.358 . . . . 0.0 99.233 174.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.401 ' CD2' ' CD1' ' A' ' 50' ' ' LEU . 3.6 p90 -130.96 155.02 47.5 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 174.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.9 m -99.62 139.61 35.03 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 104.782 -2.303 . . . . 0.0 104.782 167.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -79.44 -8.74 59.33 Favored 'General case' 0 C--O 1.208 -1.129 0 C-N-CA 128.805 2.842 . . . . 0.0 116.374 -172.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.38 96.6 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 124.447 3.294 . . . . 0.0 116.539 -177.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.778 HD22 ' H ' ' A' ' 49' ' ' LEU 0.321 0.2 OUTLIER -68.62 -39.07 80.98 Favored 'General case' 0 CA--C 1.444 -3.127 0 C-N-CA 130.065 3.346 . . . . 0.0 113.151 174.884 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.888 HD23 HD11 ' A' ' 54' ' ' ILE 0.286 0.2 OUTLIER -65.01 -45.98 83.3 Favored 'General case' 0 C--O 1.202 -1.415 1 CA-C-N 108.304 -4.044 . . . . 0.0 108.991 170.71 . . . . . . . . 5 4 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -55.02 -34.32 63.39 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 117.28 -3.387 . . . . 0.0 110.915 170.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -76.63 -27.05 55.55 Favored 'General case' 0 C--N 1.365 1.281 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 166.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.0 -49.26 11.16 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 117.493 -3.254 . . . . 0.0 113.921 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.888 HD11 HD23 ' A' ' 50' ' ' LEU . 66.8 mt -51.56 -43.3 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.58 1 C-N-CA 134.686 5.194 . . . . 0.0 111.461 174.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.436 ' HA ' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -107.0 -26.0 11.36 Favored 'General case' 0 C--N 1.373 1.612 0 N-CA-C 119.549 3.166 . . . . 0.0 119.549 171.555 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 85.5 mmt-85 -85.44 -16.6 39.16 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-N 124.394 3.27 . . . . 0.0 113.015 -175.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.605 ' HA ' HD22 ' A' ' 141' ' ' LEU . 16.6 mt-10 -121.59 -56.76 1.86 Allowed 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 128.443 2.697 . . . . 0.0 110.268 -175.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.553 HD13 ' N ' ' A' ' 59' ' ' ASP 0.608 0.0 OUTLIER 73.6 -169.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 C-N-CA 129.894 3.278 . . . . 0.0 108.925 -178.089 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.553 ' N ' HD13 ' A' ' 58' ' ' ILE . 13.2 t70 -8.25 69.24 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.791 1 C-N-CA 133.756 4.822 . . . . 0.0 116.275 173.741 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.5 ' O ' HG12 ' A' ' 63' ' ' VAL 0.393 11.7 pt-20 -98.51 62.17 1.42 Allowed 'General case' 0 CA--C 1.481 -1.675 0 C-N-CA 129.469 3.108 . . . . 0.0 108.682 -173.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.389 24.3 p -79.21 -11.91 59.97 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 126.793 3.187 . . . . 0.0 113.244 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.626 ' CE2' HG21 ' A' ' 136' ' ' ILE . 25.2 t80 -69.56 -33.58 72.96 Favored 'General case' 0 CA--C 1.551 1.003 1 C-N-CA 133.131 4.572 . . . . 0.0 109.692 166.499 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.548 HG23 HD13 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -61.98 -44.96 99.64 Favored 'Isoleucine or valine' 0 C--N 1.381 1.936 0 C-N-CA 128.477 2.711 . . . . 0.0 108.767 -178.381 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.287 43.9 m-85 -62.42 -45.27 93.84 Favored 'General case' 0 C--O 1.205 -1.249 1 C-N-CA 134.38 5.072 . . . . 0.0 111.976 167.34 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -61.48 -46.21 90.98 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 124.902 3.501 . . . . 0.0 115.575 177.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.641 HD12 HD21 ' A' ' 111' ' ' LEU . 2.0 tm? -67.76 -45.94 73.5 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.744 1.217 . . . . 0.0 113.908 169.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.41 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.964 0.0 OUTLIER -77.05 -16.13 59.36 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.153 -2.217 . . . . 0.0 115.869 -179.616 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -72.65 -36.64 68.02 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 130.066 3.346 . . . . 0.0 107.214 162.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.95 -15.85 61.11 Favored 'General case' 0 CA--C 1.59 2.518 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.663 HG23 ' CD2' ' A' ' 73' ' ' HIS . 4.4 mm -86.23 -40.15 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 128.079 2.552 . . . . 0.0 113.743 171.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.545 ' HG2' ' HG2' ' A' ' 28' ' ' GLU . 31.6 ttpt -52.75 -14.27 0.52 Allowed 'General case' 0 N--CA 1.503 2.203 1 C-N-CA 136.104 5.762 . . . . 0.0 115.951 175.496 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.343 35.3 t70 -80.89 -34.51 33.47 Favored 'General case' 0 N--CA 1.432 -1.369 1 C-N-CA 135.97 5.708 . . . . 0.0 111.014 176.914 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.663 ' CD2' HG23 ' A' ' 70' ' ' ILE 0.371 0.0 OUTLIER -88.12 24.31 1.88 Allowed 'General case' 0 CA--C 1.487 -1.459 0 C-N-CA 130.103 3.361 . . . . 0.0 116.573 -168.407 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.593 ' HA ' HG13 ' A' ' 77' ' ' VAL . 73.1 t -38.4 -33.51 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.37 1.48 0 C-N-CA 129.206 3.002 . . . . 0.0 113.989 158.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.436 ' H ' HD22 ' A' ' 75' ' ' LEU . 2.6 mm? -64.92 -39.5 93.6 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 131.217 3.807 . . . . 0.0 115.628 171.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -74.82 -36.74 62.42 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 127.039 2.135 . . . . 0.0 111.921 173.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.593 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.514 0.2 OUTLIER -71.34 -28.85 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-O 124.178 1.942 . . . . 0.0 113.149 172.801 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.512 ' CG ' HG11 ' A' ' 38' ' ' VAL . 0.8 OUTLIER -63.53 -47.66 80.71 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 128.765 2.826 . . . . 0.0 110.957 164.464 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -59.26 -30.49 68.33 Favored 'General case' 0 C--N 1.382 2.002 0 C-N-CA 126.459 1.903 . . . . 0.0 114.58 168.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -68.57 -37.9 80.27 Favored 'General case' 0 CA--C 1.559 1.323 0 C-N-CA 127.652 2.381 . . . . 0.0 112.697 171.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.686 HD22 ' HB2' ' A' ' 125' ' ' LYS . 2.3 tm? -75.41 -12.9 60.35 Favored 'General case' 0 C--N 1.377 1.791 0 C-N-CA 129.227 3.011 . . . . 0.0 111.489 170.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.4 t -87.02 3.12 47.25 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 128.835 2.854 . . . . 0.0 117.587 -174.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.526 ' HE3' ' HB ' ' A' ' 94' ' ' ILE . 6.5 ttt -79.19 153.51 77.02 Favored Pre-proline 0 C--N 1.371 1.514 0 CA-C-O 115.388 -2.244 . . . . 0.0 105.495 171.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -62.08 -179.29 0.41 Allowed 'Trans proline' 0 CA--C 1.553 1.471 1 C-N-CA 125.864 4.376 . . . . 0.0 116.594 -168.183 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.73 149.78 74.93 Favored 'Trans proline' 0 C--N 1.37 1.704 0 CA-C-N 127.343 3.658 . . . . 0.0 113.522 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.718 ' HD2' HG21 ' A' ' 97' ' ' VAL 0.327 10.6 mmt85 -102.19 53.13 0.05 OUTLIER Pre-proline 0 CA--C 1.595 2.674 1 N-CA-C 121.906 4.039 . . . . 0.0 121.906 178.123 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.512 ' O ' ' HB2' ' A' ' 93' ' ' PHE 0.306 81.3 Cg_exo -67.48 160.28 48.59 Favored 'Trans proline' 0 C--N 1.388 2.624 1 C-N-CA 129.59 6.86 . . . . 0.0 117.004 170.887 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -23.24 -29.89 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.054 2 C-N-CA 135.401 5.481 . . . . 0.0 124.317 177.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . 0.273 0.0 OUTLIER -60.06 -156.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 1 C-N-CA 133.842 4.857 . . . . 0.0 119.65 179.869 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -146.36 -12.05 0.47 Allowed 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 129.669 3.188 . . . . 0.0 109.584 176.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -87.35 -13.64 42.96 Favored 'General case' 0 C--N 1.351 0.649 0 CA-C-O 123.097 1.427 . . . . 0.0 108.836 164.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.5 ' O ' ' HA ' ' A' ' 86' ' ' ARG . 1.0 OUTLIER -138.72 -3.15 1.68 Allowed 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 126.704 2.001 . . . . 0.0 114.782 -176.527 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' A' ' 87' ' ' PRO 0.355 3.2 t80 -137.03 93.15 2.8 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-O 126.059 2.838 . . . . 0.0 109.042 175.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.526 ' HB ' ' HE3' ' A' ' 83' ' ' MET 0.375 6.7 mt -103.93 93.11 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.519 1 CA-C-N 108.343 -4.026 . . . . 0.0 121.781 -152.651 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.27 5.2 t70 31.11 -63.21 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.662 1 C-N-CA 132.666 4.386 . . . . 0.0 120.974 177.987 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -72.63 -9.12 73.7 Favored Glycine 0 C--N 1.37 2.437 0 C-N-CA 127.303 2.382 . . . . 0.0 113.242 165.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.718 HG21 ' HD2' ' A' ' 86' ' ' ARG . 55.8 t -82.13 98.0 4.28 Favored 'Isoleucine or valine' 0 C--N 1.365 1.247 0 C-N-CA 128.692 2.797 . . . . 0.0 107.3 171.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . 0.319 64.1 tt0 46.39 -23.81 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 2 N-CA-C 123.756 4.724 . . . . 0.0 123.756 178.298 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.99 -63.01 1.18 Allowed 'General case' 0 CA--C 1.532 0.285 1 C-N-CA 133.369 4.667 . . . . 0.0 111.539 178.641 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -112.25 164.78 14.42 Favored Pre-proline 0 C--N 1.354 0.781 0 N-CA-C 103.437 -2.801 . . . . 0.0 103.437 171.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -59.18 144.43 99.39 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 125.133 3.889 . . . . 0.0 117.427 -174.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -104.6 60.1 0.44 Allowed Glycine 0 C--N 1.354 1.563 0 C-N-CA 126.3 1.905 . . . . 0.0 109.173 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 43.1 ptt85 -118.57 149.57 41.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.937 1.827 . . . . 0.0 113.996 -176.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.87 143.39 47.0 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 129.255 3.022 . . . . 0.0 108.305 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -129.88 117.83 20.78 Favored 'General case' 0 C--N 1.366 1.324 0 N-CA-C 103.035 -2.95 . . . . 0.0 103.035 177.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.432 ' HB ' HD11 ' A' ' 150' ' ' ILE 0.319 15.4 pt -135.57 140.98 43.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.318 0 C-N-CA 127.175 2.19 . . . . 0.0 107.664 -175.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.6 m -132.93 125.09 29.07 Favored 'General case' 0 CA--C 1.497 -1.087 0 O-C-N 118.252 -2.78 . . . . 0.0 106.29 -172.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.574 ' HB3' HD11 ' A' ' 66' ' ' LEU . 2.1 t0 -148.12 162.49 39.31 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 103.128 -2.915 . . . . 0.0 103.128 -169.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.617 ' HA3' ' HG ' ' A' ' 66' ' ' LEU . . . 84.29 -61.33 4.73 Favored Glycine 0 N--CA 1.479 1.552 0 O-C-N 119.885 -1.759 . . . . 0.0 115.793 170.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 162.12 -30.34 0.0 OUTLIER 'General case' 0 CA--C 1.563 1.456 1 C-N-CA 137.845 6.458 . . . . 0.0 106.611 -167.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.751 ' HB3' HG23 ' A' ' 136' ' ' ILE 0.559 0.5 OUTLIER -79.56 136.61 36.91 Favored 'General case' 0 C--N 1.379 1.878 2 C-N-CA 132.657 4.383 . . . . 0.0 122.358 -175.908 . . . . . . . . 5 4 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -90.32 101.84 14.57 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 175.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.276 0.2 OUTLIER -94.49 131.57 40.06 Favored 'General case' 0 C--N 1.383 2.032 0 N-CA-C 104.925 -2.25 . . . . 0.0 104.925 177.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -113.92 127.19 7.69 Favored Glycine 0 C--N 1.353 1.514 0 N-CA-C 105.95 -2.86 . . . . 0.0 105.95 174.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -120.95 139.93 52.57 Favored 'General case' 0 C--N 1.368 1.405 0 N-CA-C 104.121 -2.548 . . . . 0.0 104.121 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -132.52 137.42 47.16 Favored 'General case' 0 CA--C 1.481 -1.688 0 N-CA-C 100.956 -3.72 . . . . 0.0 100.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -68.62 164.04 2.9 Favored 'Isoleucine or valine' 0 C--N 1.368 1.39 0 CA-C-N 120.282 1.401 . . . . 0.0 109.41 169.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.554 ' CB ' HD21 ' A' ' 121' ' ' ASN . 24.8 p -39.04 99.2 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 126.662 1.985 . . . . 0.0 115.813 169.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.264 54.5 tptt -68.02 -40.62 23.3 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 119.404 3.113 . . . . 0.0 119.404 -168.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -100.15 58.46 0.04 OUTLIER 'Trans proline' 0 CA--C 1.549 1.271 0 CA-C-N 125.327 2.938 . . . . 0.0 111.165 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.554 HD21 ' CB ' ' A' ' 118' ' ' CYS . 0.2 OUTLIER 174.34 -173.83 0.07 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 125.721 1.609 . . . . 0.0 107.009 -175.118 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.436 ' H ' ' HD2' ' A' ' 123' ' ' LYS . 2.9 tp10 -156.09 -77.54 0.09 Allowed 'General case' 0 N--CA 1.412 -2.336 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 153.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.436 ' HD2' ' H ' ' A' ' 122' ' ' GLU 0.3 1.7 mptp? 60.84 -32.54 0.07 Allowed 'General case' 0 N--CA 1.436 -1.15 1 C-N-CA 135.58 5.552 . . . . 0.0 117.137 -172.872 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.31 -149.07 0.43 Allowed 'General case' 0 N--CA 1.442 -0.827 1 C-N-CA 132.119 4.168 . . . . 0.0 109.602 -179.523 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.686 ' HB2' HD22 ' A' ' 81' ' ' LEU 0.306 0.0 OUTLIER -99.7 -54.01 3.03 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 129.066 2.947 . . . . 0.0 107.456 172.534 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -171.65 107.36 0.38 Allowed Pre-proline 0 C--N 1.356 0.886 0 C-N-CA 125.485 1.514 . . . . 0.0 114.199 171.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.503 ' HD2' ' SG ' ' A' ' 118' ' ' CYS . 8.2 Cg_endo -121.69 19.06 0.02 OUTLIER 'Trans proline' 0 C--N 1.375 1.957 0 CA-C-N 124.015 2.47 . . . . 0.0 118.125 174.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . 0.26 0.7 OUTLIER -146.29 153.5 40.63 Favored 'General case' 0 CA--C 1.479 -1.769 0 N-CA-C 103.361 -2.829 . . . . 0.0 103.361 159.256 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.5 mt -103.82 135.03 46.13 Favored 'General case' 0 C--N 1.365 1.27 1 N-CA-C 99.758 -4.164 . . . . 0.0 99.758 161.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -129.95 74.85 1.61 Allowed 'General case' 0 CA--C 1.488 -1.41 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 -173.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.285 71.7 m 120.85 78.48 0.0 OUTLIER 'General case' 0 C--N 1.359 1.013 0 N-CA-C 103.845 -2.65 . . . . 0.0 103.845 -174.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -101.66 109.03 20.74 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 102.537 -3.134 . . . . 0.0 102.537 170.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.35 135.17 50.09 Favored 'General case' 0 C--N 1.348 0.528 0 C-N-CA 127.06 2.144 . . . . 0.0 111.134 -174.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -129.07 116.29 19.06 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 126.62 1.968 . . . . 0.0 110.647 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -135.2 133.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.365 1.255 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 174.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.796 HG22 ' H ' ' A' ' 137' ' ' ASN . 0.2 OUTLIER -121.35 -167.92 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.764 0 C-N-CA 127.432 2.293 . . . . 0.0 112.225 -172.243 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.796 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -177.19 -173.49 0.45 Allowed 'General case' 0 CA--C 1.476 -1.885 1 C-N-CA 137.991 6.517 . . . . 0.0 106.989 177.353 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.574 ' HB2' ' CD ' ' A' ' 139' ' ' ARG 0.375 12.5 m 153.81 -49.94 0.0 OUTLIER 'General case' 0 CA--C 1.499 -1.014 0 CA-C-N 109.923 -3.308 . . . . 0.0 103.975 -168.064 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.574 ' CD ' ' HB2' ' A' ' 138' ' ' SER . 0.0 OUTLIER -133.17 -78.66 0.48 Allowed 'General case' 0 N--CA 1.424 -1.765 0 CA-C-N 111.249 -2.705 . . . . 0.0 111.985 -157.421 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.558 ' HG3' ' HD3' ' A' ' 139' ' ' ARG . 0.0 OUTLIER -105.89 -19.44 13.74 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 130.222 3.409 . . . . 0.0 119.394 -165.413 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.724 ' HB2' ' HA ' ' A' ' 137' ' ' ASN . 2.7 mt -83.75 158.32 62.61 Favored Pre-proline 0 N--CA 1.439 -1.019 0 C-N-CA 129.647 3.179 . . . . 0.0 114.049 -162.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -80.02 -41.19 0.19 Allowed 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 124.489 3.459 . . . . 0.0 114.237 -170.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 87.14 -91.94 1.77 Allowed Glycine 0 CA--C 1.493 -1.342 1 C-N-CA 131.96 4.6 . . . . 0.0 119.105 166.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . 0.253 22.4 pttp -53.35 90.77 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 120.943 3.683 . . . . 0.0 120.943 -165.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -144.52 30.81 1.21 Allowed 'General case' 0 C--N 1.354 0.784 0 C-N-CA 125.664 1.586 . . . . 0.0 113.792 -176.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 24.9 m 174.5 161.82 0.2 Allowed 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 100.711 -3.811 . . . . 0.0 100.711 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -168.21 100.06 0.44 Allowed 'General case' 0 C--N 1.364 1.23 0 CA-C-N 121.902 2.137 . . . . 0.0 116.338 -177.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -176.49 82.69 0.02 OUTLIER 'General case' 0 C--N 1.379 1.85 0 C-N-CA 124.685 1.194 . . . . 0.0 111.622 -175.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . 0.267 21.7 m -53.5 110.73 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.247 0 N-CA-C 121.351 3.834 . . . . 0.0 121.351 -175.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.432 HD11 ' HB ' ' A' ' 106' ' ' ILE . 4.5 pt -129.94 144.09 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 131.387 3.875 . . . . 0.0 113.226 177.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . 0.385 38.7 mttm -116.65 146.98 42.35 Favored 'General case' 0 CA--C 1.5 -0.956 1 N-CA-C 98.969 -4.456 . . . . 0.0 98.969 155.043 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 5.9 t -77.62 139.47 39.5 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 -132.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 . . . . . 0 C--O 1.262 1.761 0 CA-C-N 109.01 -3.723 . . . . 0.0 117.51 -162.011 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.0 mtt . . . . . 0 CA--C 1.518 -0.28 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.9 p -67.35 120.26 13.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 129.397 3.079 . . . . 0.0 114.05 176.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.6 mm -47.69 41.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 1 C-N-CA 133.916 4.886 . . . . 0.0 121.292 -172.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.711 ' HA ' HG13 ' A' ' 7' ' ' VAL . 35.4 m-80 -59.14 -1.88 0.22 Allowed 'General case' 0 N--CA 1.478 0.967 1 C-N-CA 133.165 4.586 . . . . 0.0 117.322 177.051 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.33 -57.7 9.53 Favored 'General case' 0 C--N 1.349 0.571 1 C-N-CA 131.956 4.102 . . . . 0.0 111.728 172.839 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -75.13 -14.57 60.58 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.013 2.125 . . . . 0.0 112.616 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.711 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.316 0.8 OUTLIER -86.66 -33.67 7.26 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 C-N-CA 126.791 2.036 . . . . 0.0 110.696 176.395 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -66.76 -44.69 80.76 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 128.599 2.759 . . . . 0.0 109.002 172.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 30.7 mt -58.2 -43.21 85.23 Favored 'Isoleucine or valine' 0 C--N 1.363 1.169 0 CA-C-N 113.615 -1.629 . . . . 0.0 111.696 165.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.259 12.6 ttm105 -59.94 -49.44 77.66 Favored 'General case' 0 C--N 1.369 1.435 0 O-C-N 119.733 -1.855 . . . . 0.0 115.654 170.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.431 ' HD2' ' HG2' ' A' ' 55' ' ' GLN . 75.9 mtm180 -58.59 -30.53 67.27 Favored 'General case' 0 C--N 1.37 1.482 0 N-CA-C 119.113 3.005 . . . . 0.0 119.113 167.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -77.16 -49.02 16.11 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.696 3.198 . . . . 0.0 111.035 173.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.407 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 14.2 mmtp -57.49 -29.14 64.02 Favored 'General case' 0 C--N 1.376 1.752 0 C-N-CA 128.629 2.772 . . . . 0.0 109.679 170.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.66 HD13 HG23 ' A' ' 54' ' ' ILE . 0.0 OUTLIER -72.32 -43.45 64.12 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.038 1.335 . . . . 0.0 113.854 168.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -55.8 -40.92 73.38 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 119.764 -1.835 . . . . 0.0 112.496 168.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.3 mmt-85 -63.38 -48.09 79.36 Favored 'General case' 0 C--N 1.379 1.879 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 165.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.407 ' CG ' ' O ' ' A' ' 13' ' ' LYS 0.29 11.4 m-70 -57.03 -46.89 82.04 Favored 'General case' 0 C--N 1.39 2.354 1 C-N-CA 131.932 4.093 . . . . 0.0 110.27 175.81 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.625 ' CE1' HD21 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -58.55 -54.54 45.91 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 130.144 3.378 . . . . 0.0 110.889 175.238 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -73.17 -45.16 58.11 Favored 'General case' 0 C--N 1.374 1.67 0 N-CA-C 118.046 2.609 . . . . 0.0 118.046 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 55.9 m -65.78 -41.41 92.06 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.252 2.221 . . . . 0.0 112.748 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.567 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.392 3.7 mp0 -77.28 -29.25 53.7 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 120.611 -1.306 . . . . 0.0 111.249 172.071 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.67 -31.27 70.52 Favored 'General case' 0 C--N 1.388 2.258 0 O-C-N 119.18 -2.2 . . . . 0.0 112.76 167.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -69.17 -38.33 78.64 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 125.203 1.401 . . . . 0.0 110.632 165.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 31.4 tp60 -58.47 -46.87 85.74 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 168.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.453 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.7 mt -70.75 -45.46 73.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.001 0 O-C-N 121.24 -0.912 . . . . 0.0 112.285 175.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.628 0.5 OUTLIER -70.61 -23.69 62.6 Favored 'General case' 0 C--N 1.379 1.871 0 CA-C-N 119.825 1.193 . . . . 0.0 113.662 177.099 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -69.31 -45.95 68.3 Favored 'General case' 0 C--N 1.387 2.198 0 O-C-N 120.19 -1.569 . . . . 0.0 109.814 167.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.42 ' HG2' ' CG ' ' A' ' 71' ' ' LYS . 18.9 tp10 -64.19 -36.75 85.09 Favored 'General case' 0 C--N 1.378 1.806 0 O-C-N 119.764 -1.835 . . . . 0.0 114.308 174.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.409 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 4.8 mt -62.31 -50.09 81.34 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 C-N-CA 125.055 1.342 . . . . 0.0 113.943 171.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.3 ttm105 -68.31 -28.6 67.32 Favored 'General case' 0 C--N 1.361 1.085 0 CA-C-N 121.534 1.97 . . . . 0.0 115.056 176.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -76.21 -45.38 33.34 Favored 'General case' 0 C--N 1.37 1.489 0 O-C-N 119.776 -1.827 . . . . 0.0 110.331 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.6 -40.42 66.53 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.443 ' HA ' HD21 ' A' ' 78' ' ' ASN 0.348 4.0 p -68.93 -39.04 79.84 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.617 1.167 . . . . 0.0 111.19 177.801 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 mmtp -66.32 -46.25 77.53 Favored 'General case' 0 C--N 1.376 1.758 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 167.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.93 71.93 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 126.114 1.766 . . . . 0.0 114.783 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.33 -13.89 60.81 Favored 'General case' 0 C--N 1.376 1.736 0 CA-C-N 119.411 1.005 . . . . 0.0 113.495 169.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 96.98 18.02 30.68 Favored Glycine 0 C--N 1.38 2.988 0 CA-C-N 119.567 1.076 . . . . 0.0 114.094 171.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.556 HG23 HD11 ' A' ' 81' ' ' LEU . 1.9 m -118.83 175.8 3.56 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 N-CA-C 106.419 -1.697 . . . . 0.0 106.419 -175.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.316 3.6 m -52.44 162.04 0.59 Allowed 'General case' 0 N--CA 1.428 -1.546 1 C-N-CA 132.574 4.35 . . . . 0.0 118.966 176.86 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.6 m -92.82 112.71 24.76 Favored 'General case' 0 CA--C 1.49 -1.335 0 C-N-CA 124.821 1.249 . . . . 0.0 107.632 -178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.489 ' HA ' ' O ' ' A' ' 127' ' ' PRO 0.277 42.9 p90 -114.0 144.53 42.95 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.056 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -118.35 163.12 17.19 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-O 123.601 1.667 . . . . 0.0 112.359 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -122.06 121.78 37.76 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 125.766 1.626 . . . . 0.0 114.403 -174.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -122.01 162.05 21.84 Favored 'General case' 0 C--N 1.373 1.621 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 171.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.46 ' CD2' HD13 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -116.34 172.55 7.12 Favored 'General case' 0 C--N 1.349 0.558 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 170.035 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.9 m -97.59 117.84 32.76 Favored 'General case' 0 C--N 1.353 0.734 0 N-CA-C 102.893 -3.002 . . . . 0.0 102.893 159.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.54 ' HA ' ' HB2' ' A' ' 50' ' ' LEU 0.529 0.0 OUTLIER -78.12 -10.16 59.5 Favored 'General case' 0 CA--C 1.556 1.18 0 O-C-N 120.004 -1.685 . . . . 0.0 115.281 -175.298 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.7 -38.82 46.57 Favored 'General case' 0 C--N 1.376 1.746 0 CA-C-O 126.127 2.87 . . . . 0.0 110.071 172.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.402 HD21 ' HA ' ' A' ' 133' ' ' MET . 21.0 tp -64.45 -35.01 79.55 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 127.809 2.444 . . . . 0.0 111.213 168.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.625 HD21 ' CE1' ' A' ' 18' ' ' PHE . 1.8 mp -74.71 -28.09 60.66 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.123 166.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -57.15 -30.6 64.6 Favored 'General case' 0 C--N 1.365 1.262 0 O-C-N 118.299 -2.75 . . . . 0.0 109.747 171.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -79.53 -55.43 5.04 Favored 'General case' 0 C--N 1.386 2.195 0 N-CA-C 117.821 2.526 . . . . 0.0 117.821 158.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.16 -30.69 70.55 Favored 'General case' 0 N--CA 1.502 2.15 1 CA-C-N 127.366 4.621 . . . . 0.0 118.852 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.66 HG23 HD13 ' A' ' 14' ' ' LEU . 42.1 mt -68.53 -46.49 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 128.08 2.552 . . . . 0.0 112.529 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.551 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.1 mt-30 -102.54 -18.98 15.04 Favored 'General case' 0 C--N 1.371 1.517 0 N-CA-C 119.031 2.975 . . . . 0.0 119.031 176.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -90.0 -7.41 54.05 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-N 123.168 2.713 . . . . 0.0 111.794 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 141' ' ' LEU . 28.4 mt-10 -125.96 -65.25 1.0 Allowed 'General case' 0 C--N 1.354 0.786 0 C-N-CA 126.403 1.881 . . . . 0.0 108.93 -176.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.551 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.49 0.2 OUTLIER 71.47 147.02 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 128.574 2.75 . . . . 0.0 112.593 178.243 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.421 ' HB2' HD12 ' A' ' 58' ' ' ILE . 22.0 t70 58.6 -61.52 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.447 0 C-N-CA 129.409 3.084 . . . . 0.0 113.679 -175.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.59 ' O ' HG12 ' A' ' 63' ' ' VAL 0.508 7.0 pt-20 27.69 61.56 0.1 Allowed 'General case' 0 C--O 1.205 -1.275 1 C-N-CA 133.799 4.84 . . . . 0.0 114.301 -178.101 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.438 34.9 p -78.03 -10.82 59.79 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 118.171 -2.831 . . . . 0.0 114.043 -172.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.435 ' HE2' HG21 ' A' ' 136' ' ' ILE . 10.8 t80 -68.95 -33.49 73.8 Favored 'General case' 0 CA--C 1.552 1.032 1 C-N-CA 133.653 4.781 . . . . 0.0 110.56 164.314 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.59 HG12 ' O ' ' A' ' 60' ' ' GLU . 0.3 OUTLIER -67.52 -44.33 86.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.412 0 C-N-CA 129.785 3.234 . . . . 0.0 108.804 -178.518 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.567 ' CD1' ' HB3' ' A' ' 21' ' ' GLU 0.292 28.1 m-85 -63.81 -43.94 94.74 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 130.591 3.556 . . . . 0.0 112.682 166.445 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -59.25 -44.91 92.36 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.259 2.3 . . . . 0.0 114.681 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.73 ' HG ' HD21 ' A' ' 111' ' ' LEU . 0.3 OUTLIER -59.47 -50.72 72.83 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 129.4 3.08 . . . . 0.0 113.125 169.797 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.812 0.1 OUTLIER -77.67 -17.48 57.64 Favored 'General case' 0 C--N 1.377 1.779 0 O-C-N 119.201 -2.187 . . . . 0.0 114.64 176.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.453 ' CE1' HG12 ' A' ' 25' ' ' ILE . 52.9 m-70 -80.03 -16.29 55.42 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 126.852 2.061 . . . . 0.0 111.405 166.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -84.36 -40.93 17.27 Favored 'General case' 0 CA--C 1.556 1.201 0 O-C-N 120.38 -1.45 . . . . 0.0 110.488 160.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.676 HD13 ' N ' ' A' ' 153' ' ' GLN 0.327 0.9 OUTLIER -58.51 -26.16 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.808 0 C-N-CA 128.521 2.728 . . . . 0.0 113.896 176.009 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.42 ' CG ' ' HG2' ' A' ' 28' ' ' GLU . 29.5 pttt -61.72 -11.95 14.39 Favored 'General case' 0 C--N 1.359 1.002 0 C-N-CA 129.615 3.166 . . . . 0.0 117.431 174.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . 0.316 80.5 m-20 -89.18 -36.81 15.46 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 123.8 1.762 . . . . 0.0 109.987 -173.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.529 ' NE2' ' HG3' ' A' ' 151' ' ' LYS . 1.9 t-80 -87.46 24.14 1.73 Allowed 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 131.48 3.912 . . . . 0.0 116.206 -166.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.561 ' HA ' HG13 ' A' ' 77' ' ' VAL 0.283 95.7 t -41.95 -31.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 128.171 2.589 . . . . 0.0 114.118 161.168 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.97 -39.07 92.92 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 127.108 2.163 . . . . 0.0 115.748 171.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.47 ' HG3' ' HE1' ' A' ' 73' ' ' HIS 0.368 63.9 mm-40 -76.24 -34.74 59.2 Favored 'General case' 0 C--N 1.366 1.324 0 O-C-N 118.908 -2.37 . . . . 0.0 113.698 170.413 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.561 HG13 ' HA ' ' A' ' 74' ' ' VAL 0.404 1.9 p -70.81 -29.29 37.01 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.699 0 CA-C-O 124.084 1.897 . . . . 0.0 113.654 173.318 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.443 HD21 ' HA ' ' A' ' 33' ' ' SER . 4.6 m120 -64.43 -45.37 87.79 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 130.36 3.464 . . . . 0.0 110.326 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.28 -30.28 71.13 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 126.187 1.795 . . . . 0.0 112.762 172.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.518 ' CE1' HG23 ' A' ' 77' ' ' VAL 0.609 0.2 OUTLIER -74.86 -29.6 61.08 Favored 'General case' 0 C--N 1.373 1.625 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 169.381 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.556 HD11 HG23 ' A' ' 38' ' ' VAL 0.307 0.4 OUTLIER -76.86 -46.52 24.37 Favored 'General case' 0 C--N 1.377 1.795 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 168.955 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.5 m -66.64 3.32 1.03 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 120.676 3.584 . . . . 0.0 120.676 -169.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.826 ' CE ' HG23 ' A' ' 97' ' ' VAL . 8.0 ptm -77.04 166.67 42.92 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 128.644 2.778 . . . . 0.0 112.587 178.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.421 ' HA ' ' HD3' ' A' ' 85' ' ' PRO . 83.1 Cg_exo -56.93 142.21 93.46 Favored 'Trans proline' 0 C--N 1.367 1.522 1 C-N-CA 125.321 4.014 . . . . 0.0 112.824 176.606 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 84' ' ' PRO . 50.2 Cg_exo -58.2 158.37 22.35 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 124.228 3.285 . . . . 0.0 118.634 -157.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.443 ' HB2' ' HA ' ' A' ' 123' ' ' LYS . 4.7 mmm-85 -66.22 2.0 0.03 OUTLIER Pre-proline 0 CA--C 1.583 2.221 1 N-CA-C 123.353 4.575 . . . . 0.0 123.353 172.757 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -52.52 160.9 3.24 Favored 'Trans proline' 0 C--N 1.38 2.216 3 C-N-CA 127.726 5.618 . . . . 0.0 123.048 -169.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -42.61 -26.98 0.14 Allowed 'General case' 0 C--N 1.361 1.107 1 C-N-CA 137.73 6.412 . . . . 0.0 119.036 -175.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.0 -41.03 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.351 0 C-N-CA 129.145 2.978 . . . . 0.0 115.743 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 55.81 -18.21 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.813 1 C-N-CA 136.182 5.793 . . . . 0.0 115.588 -177.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -98.3 -18.36 18.4 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 126.919 2.088 . . . . 0.0 113.536 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -113.95 3.73 15.5 Favored 'General case' 0 CA--C 1.505 -0.767 0 C-N-CA 123.66 0.784 . . . . 0.0 111.411 -174.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.257 1.3 m-85 -122.4 -66.42 1.03 Allowed 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 117.979 2.585 . . . . 0.0 117.979 -178.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.419 ' HB ' ' HB ' ' A' ' 97' ' ' VAL . 3.4 pt -78.26 138.02 21.02 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 C-N-CA 127.857 2.463 . . . . 0.0 113.161 -177.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -137.97 -26.15 0.95 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 111.883 -2.417 . . . . 0.0 112.327 -170.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -95.9 -6.23 59.37 Favored Glycine 0 C--N 1.36 1.912 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.826 HG23 ' CE ' ' A' ' 83' ' ' MET . 11.6 t -113.24 113.57 44.42 Favored 'Isoleucine or valine' 0 C--N 1.365 1.264 0 N-CA-C 104.083 -2.562 . . . . 0.0 104.083 175.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -79.91 42.88 0.57 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.463 2.305 . . . . 0.0 116.672 -175.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 11.5 t80 77.42 -22.62 0.27 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 129.956 3.302 . . . . 0.0 115.362 178.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 45.1 ptt85 -87.59 168.57 16.8 Favored Pre-proline 0 C--N 1.352 0.71 0 C-N-CA 130.555 3.542 . . . . 0.0 110.72 178.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -52.42 155.71 9.36 Favored 'Trans proline' 0 C--N 1.356 0.929 1 C-N-CA 126.348 4.699 . . . . 0.0 119.821 178.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -92.22 54.28 2.84 Favored Glycine 0 C--N 1.353 1.487 0 C-N-CA 126.555 2.026 . . . . 0.0 113.347 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.1 ptt180 -119.42 146.56 45.27 Favored 'General case' 0 C--N 1.349 0.546 0 C-N-CA 125.59 1.556 . . . . 0.0 111.695 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pp -140.16 150.42 44.2 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 126.423 1.889 . . . . 0.0 111.715 -175.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.2 tt0 -130.16 130.87 45.29 Favored 'General case' 0 C--N 1.367 1.336 0 C-N-CA 127.277 2.231 . . . . 0.0 105.444 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.855 HD13 ' HG2' ' A' ' 153' ' ' GLN . 4.9 pt -134.51 138.68 49.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.662 ' O ' HG22 ' A' ' 150' ' ' ILE . 8.9 t -101.64 106.97 18.09 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 173.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.39 143.77 34.14 Favored 'General case' 0 CA--C 1.477 -1.845 0 N-CA-C 103.284 -2.858 . . . . 0.0 103.284 -168.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 81.71 -21.76 6.23 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.866 2.174 . . . . 0.0 112.23 178.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 116.53 -9.49 0.0 OUTLIER 'General case' 0 C--N 1.376 1.73 1 C-N-CA 135.653 5.581 . . . . 0.0 110.623 -167.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.826 HD13 HD12 ' A' ' 136' ' ' ILE 0.64 0.0 OUTLIER -78.82 138.2 38.07 Favored 'General case' 0 CA--C 1.481 -1.68 1 C-N-CA 135.025 5.33 . . . . 0.0 118.654 -178.649 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . 0.478 ' HE1' ' ND2' ' A' ' 137' ' ' ASN . 54.8 m95 -90.45 98.48 11.8 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 103.191 -2.892 . . . . 0.0 103.191 172.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.571 HD13 HD11 ' A' ' 66' ' ' LEU 0.369 0.1 OUTLIER -108.46 119.43 39.49 Favored 'General case' 0 C--N 1.376 1.719 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.758 176.085 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -106.76 131.73 10.79 Favored Glycine 0 C--N 1.361 1.943 0 N-CA-C 108.719 -1.753 . . . . 0.0 108.719 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.672 ' CE1' HD11 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -115.53 145.97 42.14 Favored 'General case' 0 C--N 1.375 1.706 0 N-CA-C 103.249 -2.871 . . . . 0.0 103.249 177.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -138.86 124.42 19.5 Favored 'General case' 0 CA--C 1.488 -1.42 0 N-CA-C 103.897 -2.631 . . . . 0.0 103.897 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -79.57 145.03 9.94 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 120.116 1.326 . . . . 0.0 110.876 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 25.0 m -4.44 84.1 0.0 OUTLIER 'General case' 0 C--N 1.37 1.458 0 C-N-CA 130.353 3.461 . . . . 0.0 119.856 -172.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.266 19.0 tptm -43.39 -48.63 17.57 Favored Pre-proline 0 C--N 1.365 1.266 0 C-N-CA 129.955 3.302 . . . . 0.0 116.238 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -87.06 90.02 0.6 Allowed 'Trans proline' 0 CA--C 1.561 1.87 0 C-N-CA 123.464 2.776 . . . . 0.0 107.589 156.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.406 HD22 ' HE ' ' A' ' 86' ' ' ARG 0.264 11.0 m120 -47.78 116.97 1.65 Allowed 'General case' 0 C--N 1.369 1.413 0 C-N-CA 131.19 3.796 . . . . 0.0 119.226 -175.389 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -83.48 -7.41 59.55 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 130.927 3.691 . . . . 0.0 120.652 -176.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.443 ' HA ' ' HB2' ' A' ' 86' ' ' ARG 0.295 19.4 mmtm 53.51 46.69 25.63 Favored 'General case' 0 N--CA 1.434 -1.229 1 C-N-CA 132.017 4.127 . . . . 0.0 119.958 176.71 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.271 38.1 m-85 -156.63 170.36 22.56 Favored 'General case' 0 CA--C 1.489 -1.384 0 CA-C-N 114.475 -1.238 . . . . 0.0 113.972 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.78 76.27 0.97 Allowed 'General case' 0 C--N 1.364 1.224 0 C-N-CA 127.575 2.35 . . . . 0.0 109.416 174.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.449 ' N ' ' HD3' ' A' ' 127' ' ' PRO . 1.2 p30 -175.48 49.9 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.321 1 C-N-CA 137.937 6.495 . . . . 0.0 110.564 177.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.489 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 11.1 Cg_exo -98.7 -178.23 0.26 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.057 3.172 . . . . 0.0 114.182 -164.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.5 p -125.74 163.98 21.65 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.08 130.38 48.66 Favored 'General case' 0 C--N 1.361 1.104 0 N-CA-C 100.288 -3.967 . . . . 0.0 100.288 176.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -109.68 58.49 0.61 Allowed 'General case' 0 CA--C 1.496 -1.121 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 -168.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . . 17.2 t 119.08 120.39 0.0 OUTLIER 'General case' 0 C--N 1.364 1.22 0 O-C-N 126.796 2.56 . . . . 0.0 106.259 -169.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -114.55 109.42 18.24 Favored 'General case' 0 C--N 1.357 0.907 1 N-CA-C 97.199 -5.112 . . . . 0.0 97.199 159.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . 0.421 ' O ' ' HA ' ' A' ' 113' ' ' LEU . 0.0 OUTLIER -93.88 119.52 32.91 Favored 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 125.632 1.573 . . . . 0.0 107.87 -177.26 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -127.77 114.93 17.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 120.347 1.43 . . . . 0.0 108.422 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 5.3 mt -142.35 144.19 25.2 Favored 'Isoleucine or valine' 0 C--N 1.373 1.623 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.826 HD12 HD13 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -125.51 177.66 4.76 Favored 'Isoleucine or valine' 0 C--N 1.351 0.65 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -164.161 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.478 ' ND2' ' HE1' ' A' ' 112' ' ' TRP . 0.2 OUTLIER -133.14 117.5 17.56 Favored 'General case' 0 C--N 1.361 1.082 2 N-CA-C 98.023 -4.806 . . . . 0.0 98.023 162.202 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.99 -61.65 0.03 OUTLIER 'General case' 0 CA--C 1.504 -0.792 0 N-CA-C 103.838 -2.652 . . . . 0.0 103.838 -173.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.718 ' CD ' ' H ' ' A' ' 140' ' ' ARG 0.716 0.2 OUTLIER 94.88 132.09 0.02 OUTLIER 'General case' 0 C--N 1.369 1.417 0 CA-C-O 122.524 1.154 . . . . 0.0 112.704 -177.736 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.718 ' H ' ' CD ' ' A' ' 139' ' ' ARG . 0.0 OUTLIER 124.5 -41.32 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.454 3 C-N-CA 135.705 5.602 . . . . 0.0 99.018 -144.388 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.64 HD13 ' HG3' ' A' ' 140' ' ' ARG . 0.0 OUTLIER -106.15 154.4 39.66 Favored Pre-proline 0 C--N 1.38 1.893 2 N-CA-C 127.924 6.268 . . . . 0.0 127.924 171.046 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -97.35 -22.67 0.12 Allowed 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 125.257 3.971 . . . . 0.0 115.823 175.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 3.44 -88.65 0.0 OUTLIER Glycine 0 N--CA 1.479 1.561 1 C-N-CA 136.136 6.589 . . . . 0.0 120.254 -164.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -151.07 132.29 14.47 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 128.223 2.609 . . . . 0.0 105.394 175.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -115.09 123.33 48.72 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 115.345 1.609 . . . . 0.0 115.345 -176.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 38.3 m 175.6 165.34 0.34 Allowed 'General case' 0 C--N 1.363 1.166 1 N-CA-C 98.756 -4.535 . . . . 0.0 98.756 178.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.336 97.1 mttt -131.11 -79.78 0.53 Allowed 'General case' 0 C--N 1.369 1.437 0 CA-C-N 124.002 3.092 . . . . 0.0 115.688 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.634 ' HB3' HG21 ' A' ' 107' ' ' THR 0.264 . . 69.3 176.55 0.27 Allowed 'General case' 0 CA--C 1.569 1.691 0 N-CA-C 118.682 2.845 . . . . 0.0 118.682 172.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 10.4 t -132.38 118.19 34.74 Favored 'Isoleucine or valine' 0 C--N 1.38 1.925 0 O-C-N 118.379 -2.701 . . . . 0.0 116.366 -171.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.861 HD13 ' HG2' ' A' ' 151' ' ' LYS 0.432 0.0 OUTLIER -130.35 151.01 35.21 Favored 'Isoleucine or valine' 0 C--N 1.364 1.237 1 C-N-CA 134.455 5.102 . . . . 0.0 109.783 175.802 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.861 ' HG2' HD13 ' A' ' 150' ' ' ILE 0.381 7.2 ptmt -73.87 152.82 40.11 Favored 'General case' 0 CA--C 1.511 -0.523 1 C-N-CA 135.177 5.391 . . . . 0.0 105.095 175.73 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.484 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 82.8 p -86.21 93.64 9.1 Favored 'General case' 0 C--O 1.203 -1.38 2 O-C-N 114.173 -5.33 . . . . 0.0 109.077 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.855 ' HG2' HD13 ' A' ' 106' ' ' ILE 0.426 0.0 OUTLIER . . . . . 0 C--O 1.251 1.147 1 N-CA-C 126.395 5.702 . . . . 0.0 126.395 -162.303 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.4 mtt . . . . . 0 N--CA 1.466 0.347 0 CA-C-O 123.017 1.389 . . . . 0.0 108.719 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -71.92 64.11 0.49 Allowed 'General case' 0 C--N 1.359 1.008 0 N-CA-C 117.957 2.577 . . . . 0.0 117.957 -171.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.0 mm 31.04 52.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.374 1.636 1 C-N-CA 134.685 5.194 . . . . 0.0 114.168 176.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . 0.37 3.4 m120 -50.19 -10.23 0.05 Allowed 'General case' 0 N--CA 1.466 0.347 1 C-N-CA 132.685 4.394 . . . . 0.0 119.673 -170.921 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -50.75 72.8 Favored 'General case' 0 N--CA 1.445 -0.717 1 C-N-CA 133.341 4.656 . . . . 0.0 111.696 166.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -80.35 -16.83 53.64 Favored 'General case' 0 C--N 1.372 1.57 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.0 t -81.55 -39.42 17.03 Favored 'Isoleucine or valine' 0 C--N 1.364 1.213 0 C-N-CA 130.41 3.484 . . . . 0.0 108.828 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.56 -47.99 76.7 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 128.363 2.665 . . . . 0.0 110.339 173.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.81 -43.22 66.47 Favored 'Isoleucine or valine' 0 C--N 1.362 1.14 0 C-N-CA 125.708 1.603 . . . . 0.0 113.495 166.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.1 mtm180 -60.45 -50.78 72.19 Favored 'General case' 0 CA--C 1.56 1.345 0 C-N-CA 126.132 1.773 . . . . 0.0 114.086 171.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -60.47 -26.98 67.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 128.793 2.837 . . . . 0.0 117.634 167.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -77.72 -51.09 11.13 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 130.381 3.472 . . . . 0.0 110.991 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.8 mmtt -57.75 -29.75 65.04 Favored 'General case' 0 C--N 1.379 1.885 0 C-N-CA 128.907 2.883 . . . . 0.0 109.739 169.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' A' ' 54' ' ' ILE . 0.2 OUTLIER -66.68 -49.75 65.11 Favored 'General case' 0 C--N 1.37 1.487 0 CA-C-N 114.233 -1.349 . . . . 0.0 113.887 164.27 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -57.64 -39.56 77.27 Favored 'General case' 0 C--N 1.371 1.533 0 CA-C-N 123.474 2.852 . . . . 0.0 114.452 171.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -61.18 -53.18 60.15 Favored 'General case' 0 C--N 1.379 1.85 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 167.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . 0.293 50.1 m-70 -58.21 -48.73 79.45 Favored 'General case' 0 C--N 1.383 2.046 0 C-N-CA 129.157 2.983 . . . . 0.0 111.922 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.612 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU 0.287 0.9 OUTLIER -57.07 -55.64 32.04 Favored 'General case' 0 C--N 1.372 1.581 0 C-N-CA 128.372 2.669 . . . . 0.0 114.583 174.947 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.98 -35.46 62.05 Favored 'General case' 0 C--N 1.361 1.099 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -176.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.0 m -67.96 -45.01 75.39 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 124.634 1.174 . . . . 0.0 112.806 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.64 ' HB3' ' CD1' ' A' ' 64' ' ' PHE . 38.1 mt-10 -77.56 -29.96 52.43 Favored 'General case' 0 C--N 1.361 1.075 0 O-C-N 120.263 -1.523 . . . . 0.0 112.491 173.023 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.312 2.2 m-85 -67.38 -25.96 66.22 Favored 'General case' 0 C--N 1.383 2.05 0 O-C-N 118.706 -2.497 . . . . 0.0 112.362 169.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -66.31 -46.97 75.09 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-O 117.088 -1.434 . . . . 0.0 109.827 161.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -56.68 -47.61 79.47 Favored 'General case' 0 C--N 1.364 1.227 0 N-CA-C 118.842 2.904 . . . . 0.0 118.842 171.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.526 HG12 ' CE1' ' A' ' 68' ' ' HIS . 6.8 mt -70.21 -42.12 78.94 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 O-C-N 120.638 -1.289 . . . . 0.0 111.49 176.023 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.729 0.0 OUTLIER -74.75 -23.27 58.52 Favored 'General case' 0 C--N 1.373 1.59 0 O-C-N 119.224 -2.173 . . . . 0.0 115.345 177.186 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.61 -37.38 73.84 Favored 'General case' 0 C--N 1.383 2.026 0 C-N-CA 125.652 1.581 . . . . 0.0 110.724 167.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.93 -39.36 93.39 Favored 'General case' 0 C--N 1.388 2.245 0 O-C-N 118.961 -2.337 . . . . 0.0 112.013 170.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.456 HG12 ' CZ ' ' A' ' 41' ' ' PHE . 2.6 mt -61.55 -42.0 92.34 Favored 'Isoleucine or valine' 0 C--N 1.373 1.59 0 CA-C-N 120.177 1.353 . . . . 0.0 114.321 172.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.424 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 44.8 ttm180 -59.71 -49.52 77.41 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 124.815 1.246 . . . . 0.0 114.356 174.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -77.06 -37.97 53.54 Favored 'General case' 0 C--N 1.372 1.58 0 C-N-CA 128.527 2.731 . . . . 0.0 113.912 -176.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.534 ' HB3' HG11 ' A' ' 74' ' ' VAL . . . -80.31 -29.16 38.09 Favored 'General case' 0 CA--C 1.494 -1.175 0 CA-C-O 122.49 1.138 . . . . 0.0 113.336 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.461 ' HB2' HD21 ' A' ' 78' ' ' ASN 0.344 23.2 p -79.11 -32.78 44.66 Favored 'General case' 0 C--N 1.357 0.904 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.727 173.277 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 90.2 mttt -60.43 -38.78 85.15 Favored 'General case' 0 C--N 1.374 1.647 0 N-CA-C 114.719 1.377 . . . . 0.0 114.719 163.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.09 -36.76 64.29 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.764 2.426 . . . . 0.0 112.843 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.61 61.25 Favored 'General case' 0 C--N 1.383 2.033 0 CA-C-N 119.342 0.974 . . . . 0.0 112.508 168.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.36 17.15 51.16 Favored Glycine 0 C--N 1.364 2.114 0 C-N-CA 127.161 2.315 . . . . 0.0 114.076 172.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.8 HG23 HD11 ' A' ' 81' ' ' LEU . 0.2 OUTLIER -119.52 148.13 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.607 0 CA-C-O 124.482 2.086 . . . . 0.0 108.824 -174.776 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . 0.322 0.1 OUTLIER -11.25 -58.77 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.655 2 C-N-CA 135.757 5.623 . . . . 0.0 121.846 -179.584 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . 0.302 90.8 p 100.23 171.28 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.743 0 C-N-CA 129.3 3.04 . . . . 0.0 108.542 -171.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.456 ' CZ ' HG12 ' A' ' 29' ' ' ILE . 54.2 p90 -151.12 154.79 37.62 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 126.189 1.796 . . . . 0.0 107.195 176.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.428 ' O ' ' HA ' ' A' ' 128' ' ' SER . 72.0 t60 -116.33 124.15 49.41 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 122.296 1.046 . . . . 0.0 109.835 174.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -94.55 160.91 14.43 Favored 'General case' 0 C--N 1.338 0.105 0 O-C-N 118.275 -2.765 . . . . 0.0 114.356 -175.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -138.73 141.41 38.91 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.25 1.82 . . . . 0.0 106.631 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -108.56 154.61 21.7 Favored 'General case' 0 C--N 1.367 1.337 0 C-N-CA 125.445 1.498 . . . . 0.0 108.238 170.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.5 p -101.37 110.71 22.76 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 125.063 1.345 . . . . 0.0 113.067 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.563 ' HA ' ' CB ' ' A' ' 50' ' ' LEU 0.965 0.0 OUTLIER -72.73 -8.28 54.62 Favored 'General case' 0 C--N 1.355 0.816 1 C-N-CA 134.004 4.922 . . . . 0.0 120.656 -175.304 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 -47.08 15.82 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 125.292 2.472 . . . . 0.0 109.707 167.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.8 tp -60.67 -36.07 77.83 Favored 'General case' 0 C--N 1.369 1.429 0 C-N-CA 128.339 2.656 . . . . 0.0 110.06 164.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.612 ' HG ' ' CZ ' ' A' ' 18' ' ' PHE 0.367 0.2 OUTLIER -74.52 -28.51 61.0 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 113.203 -1.817 . . . . 0.0 111.443 170.414 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -59.93 -29.47 68.41 Favored 'General case' 0 CA--C 1.559 1.31 0 O-C-N 116.524 -3.86 . . . . 0.0 109.287 171.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -73.21 -50.93 19.72 Favored 'General case' 0 C--N 1.381 1.948 0 N-CA-C 116.997 2.221 . . . . 0.0 116.997 158.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.456 ' HB3' HD13 ' A' ' 50' ' ' LEU . . . -61.8 -29.48 70.18 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 123.945 3.066 . . . . 0.0 116.919 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.573 ' HA ' HD23 ' A' ' 14' ' ' LEU . 1.3 tt -75.58 -39.01 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.139 1 C-N-CA 132.754 4.422 . . . . 0.0 112.693 -178.168 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.19 -26.28 15.0 Favored 'General case' 0 C--N 1.371 1.502 0 C-N-CA 118.525 -1.27 . . . . 0.0 112.8 172.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -74.03 -52.31 13.12 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 120.617 -1.302 . . . . 0.0 112.179 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.511 ' HG2' HD11 ' A' ' 141' ' ' LEU . 2.6 mp0 -109.51 8.42 25.16 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 116.826 2.158 . . . . 0.0 116.826 -175.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 59' ' ' ASP 0.474 0.0 OUTLIER 23.83 -26.59 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.512 2.633 2 C-N-CA 136.656 5.982 . . . . 0.0 125.723 175.096 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.487 ' N ' HD13 ' A' ' 58' ' ' ILE . 10.6 p-10 -112.92 -47.47 3.04 Favored 'General case' 0 CA--C 1.467 -2.214 1 C-N-CA 132.334 4.253 . . . . 0.0 108.706 176.613 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.469 ' O ' ' HB ' ' A' ' 63' ' ' VAL 0.892 0.0 OUTLIER 15.47 55.61 0.01 OUTLIER 'General case' 0 C--N 1.359 0.995 0 N-CA-C 121.348 3.833 . . . . 0.0 121.348 -166.887 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.258 21.6 p -78.78 -19.07 53.08 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 129.605 3.162 . . . . 0.0 110.705 174.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.412 ' HE2' HG21 ' A' ' 136' ' ' ILE 0.266 40.5 t80 -65.48 -34.51 78.43 Favored 'General case' 0 CA--C 1.543 0.703 1 C-N-CA 132.458 4.303 . . . . 0.0 111.636 168.621 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.484 ' CG2' HD21 ' A' ' 111' ' ' LEU . 0.5 OUTLIER -60.66 -45.87 96.77 Favored 'Isoleucine or valine' 0 C--N 1.364 1.233 0 C-N-CA 130.231 3.413 . . . . 0.0 109.076 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.64 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 43.2 m-85 -62.61 -46.0 90.29 Favored 'General case' 0 CA--C 1.493 -1.241 1 C-N-CA 132.422 4.289 . . . . 0.0 112.79 170.078 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -63.89 -42.47 97.46 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 121.564 1.984 . . . . 0.0 114.902 177.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.459 HD21 ' HB3' ' A' ' 108' ' ' ASP . 2.2 tm? -65.02 -49.27 70.83 Favored 'General case' 0 CA--C 1.565 1.526 0 C-N-CA 127.797 2.439 . . . . 0.0 113.516 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.431 ' CE1' ' HA ' ' A' ' 64' ' ' PHE 0.782 0.0 OUTLIER -78.5 -16.26 57.7 Favored 'General case' 0 C--N 1.371 1.524 0 O-C-N 118.485 -2.634 . . . . 0.0 115.909 178.23 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.526 ' CE1' HG12 ' A' ' 25' ' ' ILE . 46.5 m-70 -76.81 -28.31 55.52 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 129.405 3.082 . . . . 0.0 106.797 164.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -70.08 -34.89 73.74 Favored 'General case' 0 CA--C 1.569 1.704 0 O-C-N 118.769 -2.457 . . . . 0.0 112.483 159.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.804 HD13 ' HB2' ' A' ' 153' ' ' GLN . 20.1 mm -72.1 -11.88 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.087 1 C-N-CA 132.258 4.223 . . . . 0.0 118.05 176.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.3 pttm -60.06 -26.94 66.55 Favored 'General case' 0 C--N 1.32 -0.699 2 N-CA-C 124.157 4.873 . . . . 0.0 124.157 -175.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.34 -20.26 15.93 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 127.239 2.215 . . . . 0.0 108.735 -172.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.721 ' CD2' ' HA ' ' A' ' 153' ' ' GLN . 2.1 m-70 -77.22 16.07 0.64 Allowed 'General case' 0 C--N 1.372 1.563 0 C-N-CA 129.174 2.99 . . . . 0.0 112.414 172.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.571 ' HA ' ' CG1' ' A' ' 77' ' ' VAL . 3.9 p -49.99 -27.93 4.08 Favored 'Isoleucine or valine' 0 C--N 1.378 1.82 0 C-N-CA 128.678 2.791 . . . . 0.0 111.569 157.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.24 -31.01 69.29 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 128.215 2.606 . . . . 0.0 113.22 174.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -76.28 -40.06 52.69 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 126.967 2.107 . . . . 0.0 112.324 172.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.571 ' CG1' ' HA ' ' A' ' 74' ' ' VAL 0.461 3.0 p -70.11 -27.82 33.81 Favored 'Isoleucine or valine' 0 C--N 1.367 1.353 0 CA-C-O 124.629 2.156 . . . . 0.0 111.636 171.405 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.461 HD21 ' HB2' ' A' ' 33' ' ' SER . 9.1 m120 -70.12 -38.7 75.64 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.991 2.116 . . . . 0.0 114.39 167.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -30.43 70.0 Favored 'General case' 0 C--N 1.369 1.423 0 CA-C-N 121.075 1.761 . . . . 0.0 111.269 170.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -64.04 -36.17 83.11 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 129.139 2.976 . . . . 0.0 112.03 167.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.8 HD11 HG23 ' A' ' 38' ' ' VAL 0.275 0.5 OUTLIER -73.36 -45.84 52.65 Favored 'General case' 0 C--N 1.39 2.365 0 O-C-N 119.81 -1.806 . . . . 0.0 113.769 170.321 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.486 ' N ' HD12 ' A' ' 81' ' ' LEU . 15.5 m -70.81 -39.51 73.03 Favored 'General case' 0 CA--C 1.5 -0.954 1 C-N-CA 132.695 4.398 . . . . 0.0 117.546 -171.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.677 ' CE ' HG23 ' A' ' 97' ' ' VAL . 15.5 mmm -125.39 99.2 33.84 Favored Pre-proline 0 C--N 1.376 1.722 0 CA-C-O 125.712 2.672 . . . . 0.0 115.363 166.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.476 ' HD2' ' CE ' ' A' ' 125' ' ' LYS . 4.8 Cg_endo -138.21 -176.88 0.0 OUTLIER 'Trans proline' 0 CA--C 1.576 2.613 2 C-N-CA 133.116 9.211 . . . . 0.0 99.951 146.802 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -86.73 134.49 3.87 Favored 'Trans proline' 0 CA--C 1.566 2.117 2 O-C-N 112.765 -4.387 . . . . 0.0 118.426 -177.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.437 ' HG2' ' H ' ' A' ' 86' ' ' ARG . 6.3 ptm180 -85.64 -27.58 0.38 Allowed Pre-proline 0 CA--C 1.563 1.45 1 C-N-CA 136.17 5.788 . . . . 0.0 116.633 159.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -85.16 160.51 11.47 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 124.286 3.324 . . . . 0.0 117.773 -169.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.83 -17.77 13.98 Favored 'General case' 0 C--N 1.355 0.816 0 CA-C-N 113.046 -1.888 . . . . 0.0 109.984 170.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -96.35 174.27 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 C-N-CA 130.467 3.507 . . . . 0.0 117.104 -172.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -119.72 -9.75 9.69 Favored 'General case' 0 C--N 1.349 0.563 0 CA-C-N 110.748 -2.933 . . . . 0.0 113.031 -176.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -106.82 -36.73 6.58 Favored 'General case' 0 C--N 1.353 0.755 0 C-N-CA 126.321 1.848 . . . . 0.0 115.015 -176.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -120.42 34.07 5.35 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 128.746 2.819 . . . . 0.0 106.918 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . 0.284 1.5 p90 -66.28 -136.94 0.0 OUTLIER 'General case' 0 C--N 1.353 0.733 0 C-N-CA 128.875 2.87 . . . . 0.0 117.741 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 6.1 pt -112.15 139.06 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 C-N-CA 127.635 2.374 . . . . 0.0 110.921 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -144.83 -23.59 0.51 Allowed 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 111.497 -2.592 . . . . 0.0 112.376 -171.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -94.23 -7.22 60.96 Favored Glycine 0 C--N 1.36 1.916 0 N-CA-C 110.294 -1.123 . . . . 0.0 110.294 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.677 HG23 ' CE ' ' A' ' 83' ' ' MET . 95.5 t -81.82 91.64 2.17 Favored 'Isoleucine or valine' 0 C--N 1.366 1.319 0 CA-C-O 125.224 2.44 . . . . 0.0 110.225 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -125.8 21.18 7.67 Favored 'General case' 0 N--CA 1.445 -0.704 1 C-N-CA 132.313 4.245 . . . . 0.0 105.582 175.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . 0.344 0.1 OUTLIER -30.3 157.51 0.0 OUTLIER 'General case' 0 C--N 1.354 0.765 2 N-CA-C 125.06 5.207 . . . . 0.0 125.06 -170.888 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 67.9 mtm180 -112.25 159.32 34.31 Favored Pre-proline 0 C--N 1.361 1.078 0 C-N-CA 127.02 2.128 . . . . 0.0 108.232 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -74.5 156.89 45.2 Favored 'Trans proline' 0 C--N 1.364 1.355 0 C-N-CA 125.22 3.947 . . . . 0.0 112.893 176.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.6 24.68 2.61 Favored Glycine 0 C--N 1.362 2.014 0 C-N-CA 128.872 3.13 . . . . 0.0 119.017 -167.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -140.99 140.96 34.44 Favored 'General case' 0 N--CA 1.444 -0.764 0 O-C-N 120.961 -1.317 . . . . 0.0 107.695 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 mt -115.95 129.3 56.33 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 127.004 2.122 . . . . 0.0 108.54 -176.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -129.89 110.87 12.04 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 18.0 pt -135.72 139.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 110.673 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 1.9 m -112.49 127.71 56.13 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 173.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.459 ' HB3' HD21 ' A' ' 66' ' ' LEU . 47.8 t0 -139.11 -174.54 3.88 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 100.625 -3.843 . . . . 0.0 100.625 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.81 -59.44 3.01 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 121.468 3.347 . . . . 0.0 121.468 154.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . 0.272 1.1 m-80 129.74 -28.57 0.01 OUTLIER 'General case' 0 CA--C 1.564 1.485 0 C-N-CA 131.163 3.785 . . . . 0.0 104.403 -144.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.484 HD21 ' CG2' ' A' ' 63' ' ' VAL . 0.2 OUTLIER -79.47 132.47 36.36 Favored 'General case' 0 C--N 1.359 1.006 1 C-N-CA 132.412 4.285 . . . . 0.0 117.959 -171.853 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -92.02 101.48 14.02 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 167.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.443 HD11 ' CD1' ' A' ' 66' ' ' LEU 0.294 1.4 mm? -95.09 121.53 36.82 Favored 'General case' 0 C--N 1.383 2.037 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 176.456 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -116.19 122.65 5.6 Favored Glycine 0 C--N 1.355 1.611 0 N-CA-C 106.484 -2.647 . . . . 0.0 106.484 171.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -117.6 147.0 43.25 Favored 'General case' 0 C--N 1.367 1.347 0 CA-C-N 121.402 2.601 . . . . 0.0 104.656 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.9 m -134.57 133.31 40.09 Favored 'General case' 0 C--N 1.367 1.334 0 N-CA-C 103.118 -2.919 . . . . 0.0 103.118 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -92.84 139.96 17.12 Favored 'Isoleucine or valine' 0 C--N 1.352 0.698 0 C-N-CA 125.497 1.519 . . . . 0.0 109.514 177.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . 0.306 20.0 p -7.41 73.15 0.0 OUTLIER 'General case' 0 C--N 1.38 1.898 0 C-N-CA 131.571 3.948 . . . . 0.0 119.869 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.333 44.5 tttp -44.3 -53.68 13.56 Favored Pre-proline 0 C--N 1.363 1.161 1 C-N-CA 133.585 4.754 . . . . 0.0 116.959 -171.869 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.64 71.52 1.45 Allowed 'Trans proline' 0 CA--C 1.564 1.983 0 C-N-CA 123.368 2.712 . . . . 0.0 110.429 161.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -55.66 141.25 38.54 Favored 'General case' 0 C--N 1.367 1.366 0 N-CA-C 120.692 3.59 . . . . 0.0 120.692 -173.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.15 113.48 2.96 Favored 'General case' 0 N--CA 1.425 -1.706 2 N-CA-C 95.529 -5.73 . . . . 0.0 95.529 167.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 33.6 mmtm -71.43 55.98 0.24 Allowed 'General case' 0 C--N 1.345 0.382 0 C-N-CA 129.937 3.295 . . . . 0.0 117.241 -172.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -58.28 148.83 26.04 Favored 'General case' 0 N--CA 1.47 0.562 1 C-N-CA 132.538 4.335 . . . . 0.0 117.586 177.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.476 ' CE ' ' HD2' ' A' ' 84' ' ' PRO 0.307 0.0 OUTLIER -110.82 48.78 0.9 Allowed 'General case' 0 C--N 1.368 1.391 0 CA-C-O 123.816 1.769 . . . . 0.0 107.546 176.024 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.408 ' N ' ' HD3' ' A' ' 127' ' ' PRO . 31.4 t70 -173.36 62.77 0.28 Allowed Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 130.789 3.635 . . . . 0.0 108.448 176.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.41 ' O ' ' HA ' ' A' ' 41' ' ' PHE . 29.8 Cg_exo -71.78 -177.07 2.32 Favored 'Trans proline' 0 C--N 1.355 0.88 1 C-N-CA 126.589 4.859 . . . . 0.0 118.838 -175.018 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 42' ' ' HIS . 77.7 p -137.63 153.07 49.92 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-N 110.413 -3.085 . . . . 0.0 103.343 167.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 43.1 mt -103.24 130.68 50.53 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 101.329 -3.582 . . . . 0.0 101.329 175.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -126.34 67.4 1.22 Allowed 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -160.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.261 72.5 m 110.8 84.04 0.0 OUTLIER 'General case' 0 C--N 1.372 1.587 0 N-CA-C 103.727 -2.694 . . . . 0.0 103.727 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -101.58 109.81 21.68 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 101.418 -3.549 . . . . 0.0 101.418 173.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.52 121.98 45.39 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 127.325 2.25 . . . . 0.0 107.355 -174.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -128.15 114.76 17.42 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 176.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -133.8 149.73 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.293 0 CA-C-O 123.053 1.406 . . . . 0.0 109.211 -176.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.537 HD13 HD21 ' A' ' 141' ' ' LEU . 0.1 OUTLIER -129.02 -179.7 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 C-N-CA 125.275 1.43 . . . . 0.0 108.597 -175.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.524 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -133.6 124.52 27.0 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 128.735 2.814 . . . . 0.0 116.863 -170.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.401 ' HB3' HH11 ' A' ' 139' ' ' ARG 0.36 14.5 m 150.22 -83.8 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.089 1 C-N-CA 132.135 4.174 . . . . 0.0 102.926 176.561 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.65 ' HG2' ' HG2' ' A' ' 140' ' ' ARG . 0.0 OUTLIER 153.83 152.23 0.01 OUTLIER 'General case' 0 CA--C 1.483 -1.596 1 N-CA-C 96.747 -5.279 . . . . 0.0 96.747 -166.309 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.65 ' HG2' ' HG2' ' A' ' 139' ' ' ARG . 4.8 ptm180 39.77 -51.78 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.975 2 CA-C-N 129.347 5.522 . . . . 0.0 124.173 -178.657 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.537 HD21 HD13 ' A' ' 136' ' ' ILE 0.416 0.0 OUTLIER 73.12 132.78 0.04 OUTLIER Pre-proline 0 N--CA 1.427 -1.621 1 C-N-CA 150.524 11.53 . . . . 0.0 118.821 178.175 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -74.86 -46.29 0.25 Allowed 'Trans proline' 0 C--N 1.368 1.562 0 C-N-CA 124.309 3.34 . . . . 0.0 111.226 162.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . 116.12 123.03 3.5 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 130.093 3.711 . . . . 0.0 115.413 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -145.61 128.62 16.51 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 120.783 -1.422 . . . . 0.0 112.464 175.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -175.13 -171.22 0.5 Allowed 'General case' 0 C--N 1.349 0.586 0 C-N-CA 127.258 2.223 . . . . 0.0 108.267 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 24.5 t -133.65 -166.7 1.82 Allowed 'General case' 0 C--N 1.364 1.231 0 C-N-CA 125.971 1.709 . . . . 0.0 106.832 178.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -107.93 68.69 0.71 Allowed 'General case' 0 CA--C 1.512 -0.514 0 C-N-CA 127.257 2.223 . . . . 0.0 112.434 -177.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . 0.353 . . -152.14 31.2 0.55 Allowed 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 113.084 -1.871 . . . . 0.0 108.43 -169.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 34.7 m -130.87 -166.15 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.96 0 C-N-CA 126.283 1.833 . . . . 0.0 110.636 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.466 ' CD1' ' HG2' ' A' ' 151' ' ' LYS 0.543 0.0 OUTLIER -87.88 150.07 3.88 Favored 'Isoleucine or valine' 0 C--N 1.356 0.866 1 C-N-CA 133.397 4.679 . . . . 0.0 110.089 176.107 . . . . . . . . 5 4 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.466 ' HG2' ' CD1' ' A' ' 150' ' ' ILE . 0.0 OUTLIER -75.12 158.31 33.29 Favored 'General case' 0 N--CA 1.416 -2.127 1 C-N-CA 145.279 9.432 . . . . 0.0 110.91 -171.888 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.506 ' O ' HG23 ' A' ' 152' ' ' THR . 14.6 t -74.18 113.88 11.89 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 128.003 3.763 . . . . 0.0 102.883 166.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.804 ' HB2' HD13 ' A' ' 70' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.402 -2.844 0 CA-C-N 109.582 -3.463 . . . . 0.0 108.841 -167.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 tpt . . . . . 0 CA--C 1.517 -0.319 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 29.4 p -90.73 -174.51 4.09 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 127.62 2.368 . . . . 0.0 112.761 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.3 mm -95.2 25.23 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.972 0 CA-C-O 125.049 2.356 . . . . 0.0 110.111 176.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -90.07 33.63 0.87 Allowed 'General case' 0 C--N 1.35 0.605 0 C-N-CA 127.94 2.496 . . . . 0.0 114.264 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -58.23 1.93 Allowed 'General case' 0 N--CA 1.448 -0.557 1 C-N-CA 135.515 5.526 . . . . 0.0 106.768 164.557 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 13.5 mt-10 -66.21 -9.82 35.79 Favored 'General case' 0 C--N 1.369 1.449 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 -178.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.31 -38.14 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 C-N-CA 129.561 3.145 . . . . 0.0 112.035 177.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -71.56 -47.4 55.29 Favored 'General case' 0 C--N 1.357 0.933 1 C-N-CA 132.148 4.179 . . . . 0.0 107.665 177.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.9 mt -58.72 -43.88 88.76 Favored 'Isoleucine or valine' 0 C--N 1.37 1.497 0 C-N-CA 125.254 1.422 . . . . 0.0 112.132 168.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HB3' HD13 ' A' ' 58' ' ' ILE 0.296 91.2 mtm-85 -64.09 -50.14 69.48 Favored 'General case' 0 C--N 1.376 1.739 0 O-C-N 120.046 -1.659 . . . . 0.0 114.33 169.09 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 29.7 mtp180 -57.5 -28.64 63.63 Favored 'General case' 0 C--N 1.374 1.639 0 CA-C-N 124.405 3.275 . . . . 0.0 119.165 172.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -77.6 -51.64 10.32 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 130.374 3.47 . . . . 0.0 112.006 172.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -57.44 -28.62 63.48 Favored 'General case' 0 C--N 1.378 1.809 0 C-N-CA 128.131 2.572 . . . . 0.0 110.742 170.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.661 HD12 ' HA ' ' A' ' 58' ' ' ILE . 0.2 OUTLIER -70.71 -45.36 65.08 Favored 'General case' 0 C--O 1.206 -1.215 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.544 167.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -55.81 -40.39 72.67 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.747 -1.221 . . . . 0.0 114.106 169.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 69.3 mmt-85 -63.45 -49.08 75.08 Favored 'General case' 0 C--N 1.374 1.654 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 166.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -56.77 -43.51 80.87 Favored 'General case' 0 C--N 1.395 2.555 0 C-N-CA 129.397 3.079 . . . . 0.0 110.875 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.446 ' CZ ' ' HG ' ' A' ' 50' ' ' LEU . 0.3 OUTLIER -60.76 -54.95 39.01 Favored 'General case' 0 C--N 1.361 1.091 0 C-N-CA 130.546 3.538 . . . . 0.0 112.174 175.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -75.82 -39.62 56.42 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 -178.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.1 m -73.2 -36.11 66.46 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.749 2.42 . . . . 0.0 112.426 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.654 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.341 33.4 mt-10 -77.64 -29.37 51.66 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 120.463 -1.398 . . . . 0.0 110.89 167.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.515 ' CZ ' ' CE2' ' A' ' 45' ' ' TYR . 0.2 OUTLIER -59.18 -32.58 70.04 Favored 'General case' 0 C--N 1.383 2.049 0 O-C-N 119.175 -2.203 . . . . 0.0 113.511 168.59 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.438 ' HE ' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -67.49 -45.98 74.27 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 127.774 2.43 . . . . 0.0 109.527 167.468 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -57.47 -39.75 77.06 Favored 'General case' 0 C--N 1.366 1.294 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 170.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.543 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.1 mt -72.07 -45.56 62.59 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 O-C-N 120.908 -1.12 . . . . 0.0 111.657 177.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.438 HD21 ' HE ' ' A' ' 23' ' ' ARG 0.488 8.3 p30 -70.84 -24.16 62.48 Favored 'General case' 0 C--N 1.373 1.61 0 O-C-N 120.179 -1.575 . . . . 0.0 114.283 173.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -73.77 -29.99 62.52 Favored 'General case' 0 C--N 1.377 1.778 0 C-N-CA 127.159 2.184 . . . . 0.0 110.182 169.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.68 -38.46 64.9 Favored 'General case' 0 C--N 1.39 2.346 0 O-C-N 118.315 -2.741 . . . . 0.0 109.739 172.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.436 HG12 ' CE2' ' A' ' 41' ' ' PHE . 1.3 mt -64.62 -46.13 93.37 Favored 'Isoleucine or valine' 0 C--N 1.373 1.588 0 CA-C-O 118.04 -0.981 . . . . 0.0 111.101 167.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.8 tpp180 -55.38 -45.0 76.62 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 122.632 2.469 . . . . 0.0 116.705 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.59 -41.16 47.27 Favored 'General case' 0 CA--C 1.488 -1.418 0 C-N-CA 128.018 2.527 . . . . 0.0 112.639 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.13 -31.4 30.6 Favored 'General case' 0 C--N 1.355 0.835 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -178.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . 0.297 25.6 p -75.4 -34.82 61.1 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.388 1.475 . . . . 0.0 108.722 177.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -71.15 -35.88 71.85 Favored 'General case' 0 C--N 1.368 1.395 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 165.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 -36.2 64.31 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.79 -14.74 60.31 Favored 'General case' 0 C--N 1.375 1.697 0 CA-C-N 120.761 1.619 . . . . 0.0 114.016 171.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.37 15.42 44.15 Favored Glycine 0 C--N 1.376 2.8 0 O-C-N 121.187 -0.945 . . . . 0.0 114.51 172.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.776 HG22 HD23 ' A' ' 81' ' ' LEU . 7.5 p -99.98 179.37 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 126.379 1.872 . . . . 0.0 107.026 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.82 ' HB3' HD21 ' A' ' 81' ' ' LEU 0.27 32.5 t -83.56 155.71 23.14 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 124.676 2.179 . . . . 0.0 110.957 167.444 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.9 m -92.89 130.1 38.59 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 111.943 -2.39 . . . . 0.0 109.935 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.436 ' CE2' HG12 ' A' ' 29' ' ' ILE . 5.0 p90 -113.41 152.73 29.66 Favored 'General case' 0 C--N 1.35 0.628 0 C-N-CA 129.09 2.956 . . . . 0.0 105.704 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -101.5 161.35 13.7 Favored 'General case' 0 C--N 1.354 0.795 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -121.41 120.3 34.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.146 -1.596 . . . . 0.0 111.281 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -128.55 141.46 51.36 Favored 'General case' 0 C--N 1.366 1.292 0 N-CA-C 107.337 -1.357 . . . . 0.0 107.337 173.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.768 ' CZ ' HD12 ' A' ' 50' ' ' LEU . 4.3 m-85 -101.48 150.16 23.33 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.892 1.277 . . . . 0.0 108.871 172.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.4 m -123.06 85.78 2.48 Favored 'General case' 0 C--N 1.349 0.587 0 N-CA-C 100.444 -3.91 . . . . 0.0 100.444 165.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.415 ' HG2' ' H ' ' A' ' 47' ' ' GLN . 4.7 mm-40 -48.24 -10.9 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.104 0 N-CA-C 121.217 3.784 . . . . 0.0 121.217 -168.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.68 -37.55 79.09 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 125.948 3.976 . . . . 0.0 116.166 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.799 HD13 ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -68.28 -43.38 77.86 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-O 125.968 2.794 . . . . 0.0 111.132 171.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.799 ' H ' HD13 ' A' ' 49' ' ' LEU . 2.7 tt -64.11 -38.72 92.07 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 118.62 -2.55 . . . . 0.0 109.533 176.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -60.43 -32.46 71.38 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 129.621 3.168 . . . . 0.0 109.585 171.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 49' ' ' LEU . 78.0 mtm180 -63.02 -47.12 84.42 Favored 'General case' 0 C--N 1.391 2.383 0 O-C-N 120.357 -1.464 . . . . 0.0 113.625 161.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -28.59 68.47 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 117.632 2.456 . . . . 0.0 117.632 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.581 HD12 ' CD2' ' A' ' 50' ' ' LEU 0.336 0.1 OUTLIER -70.3 -39.19 76.38 Favored 'Isoleucine or valine' 0 C--N 1.362 1.136 0 C-N-CA 131.698 3.999 . . . . 0.0 111.179 179.299 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.4 mt-30 -107.39 -26.48 10.96 Favored 'General case' 0 C--N 1.372 1.559 0 N-CA-C 117.24 2.311 . . . . 0.0 117.24 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -83.5 -18.6 37.92 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.801 2.091 . . . . 0.0 113.933 -175.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 140' ' ' ARG . 1.9 mp0 -115.21 -67.68 0.98 Allowed 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 127.528 2.331 . . . . 0.0 109.085 166.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.661 ' HA ' HD12 ' A' ' 14' ' ' LEU 0.487 0.3 OUTLIER 74.91 135.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.429 -1.419 . . . . 0.0 111.121 -173.477 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.543 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 21.6 t70 44.88 45.19 8.4 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 130.922 3.689 . . . . 0.0 114.77 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.514 ' HG2' HD11 ' A' ' 14' ' ' LEU 0.399 10.4 pt-20 -74.33 62.26 0.95 Allowed 'General case' 0 CA--C 1.491 -1.308 0 C-N-CA 129.632 3.173 . . . . 0.0 114.436 179.43 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.39 14.0 p -79.0 -20.94 47.82 Favored 'General case' 0 N--CA 1.438 -1.032 0 C-N-CA 128.862 2.865 . . . . 0.0 113.18 176.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.523 ' CD2' HD21 ' A' ' 141' ' ' LEU . 5.9 t80 -64.21 -33.35 75.61 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.726 2.01 . . . . 0.0 111.151 166.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.5 HG23 HD13 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -57.62 -46.48 86.42 Favored 'Isoleucine or valine' 0 C--N 1.37 1.466 0 C-N-CA 128.846 2.858 . . . . 0.0 109.392 -175.674 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.654 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 45.9 m-85 -61.68 -45.39 94.19 Favored 'General case' 0 CA--C 1.495 -1.171 1 C-N-CA 134.184 4.994 . . . . 0.0 112.65 169.527 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -66.12 -44.62 83.76 Favored 'General case' 0 C--N 1.35 0.597 0 CA-C-N 122.001 2.182 . . . . 0.0 114.503 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.717 ' HG ' HD21 ' A' ' 111' ' ' LEU . 1.4 tm? -63.09 -50.46 70.45 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.36 1.864 . . . . 0.0 114.177 166.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.429 ' CZ ' HG13 ' A' ' 63' ' ' VAL 0.742 0.0 OUTLIER -76.7 -29.15 56.16 Favored 'General case' 0 C--N 1.372 1.564 0 O-C-N 118.979 -2.326 . . . . 0.0 111.59 -175.829 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.543 ' CE1' HG12 ' A' ' 25' ' ' ILE . 63.7 m-70 -64.17 -28.17 69.57 Favored 'General case' 0 C--N 1.367 1.353 0 C-N-CA 125.489 1.515 . . . . 0.0 112.147 162.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 51.1 tttp -77.27 -26.66 52.67 Favored 'General case' 0 C--N 1.377 1.786 0 O-C-N 121.214 -0.929 . . . . 0.0 112.017 171.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . 0.322 0.0 OUTLIER -88.13 -44.29 15.68 Favored 'Isoleucine or valine' 0 C--N 1.37 1.494 0 C-N-CA 126.353 1.861 . . . . 0.0 115.054 178.914 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . 0.553 9.1 mmpt? -49.02 0.21 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 1 C-N-CA 137.194 6.197 . . . . 0.0 120.365 -178.129 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.62 -24.04 67.46 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 131.033 3.733 . . . . 0.0 107.859 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.413 ' NE2' ' HB2' ' A' ' 153' ' ' GLN . 0.1 OUTLIER -42.07 1.55 0.0 OUTLIER 'General case' 0 C--N 1.389 2.315 1 C-N-CA 139.394 7.078 . . . . 0.0 119.207 176.659 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.485 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 46.2 t -50.03 -49.22 22.21 Favored 'Isoleucine or valine' 0 CA--C 1.461 -2.463 1 C-N-CA 135.864 5.666 . . . . 0.0 107.382 170.486 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.49 ' H ' HD22 ' A' ' 75' ' ' LEU . 1.7 mm? -58.88 -29.26 66.88 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 117.468 2.395 . . . . 0.0 117.468 176.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -75.19 -50.84 14.96 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 127.523 2.329 . . . . 0.0 112.634 172.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . 0.372 14.6 p -66.93 -29.55 46.67 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.043 0 C-N-CA 127.631 2.373 . . . . 0.0 111.545 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.485 ' HB3' ' O ' ' A' ' 74' ' ' VAL . 8.0 t-20 -75.11 -32.75 61.49 Favored 'General case' 0 C--N 1.365 1.255 1 C-N-CA 132.322 4.249 . . . . 0.0 112.826 169.135 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . 0.356 6.7 pt-20 -67.74 -29.81 69.13 Favored 'General case' 0 C--N 1.38 1.894 0 CA-C-N 122.407 2.367 . . . . 0.0 110.034 169.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 18.1 m-30 -66.47 -47.66 72.37 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 163.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.82 HD21 ' HB3' ' A' ' 39' ' ' SER 0.381 15.9 tp -71.96 -11.16 60.65 Favored 'General case' 0 C--N 1.373 1.595 0 C-N-CA 130.011 3.325 . . . . 0.0 119.762 176.773 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.9 m -65.83 3.48 0.78 Allowed 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 128.223 2.609 . . . . 0.0 117.975 -175.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 46.0 ttp -124.21 163.13 37.82 Favored Pre-proline 0 CA--C 1.567 1.624 0 C-N-CA 128.818 2.847 . . . . 0.0 106.411 174.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -65.24 -175.64 0.42 Allowed 'Trans proline' 0 C--N 1.38 2.187 1 C-N-CA 128.894 6.396 . . . . 0.0 111.449 167.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.27 134.9 38.49 Favored 'Trans proline' 0 C--N 1.392 2.822 2 CA-C-N 134.767 6.31 . . . . 0.0 112.422 175.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.401 ' HD2' HG12 ' A' ' 94' ' ' ILE 0.364 25.5 ttp180 -25.48 -55.22 0.18 Allowed Pre-proline 0 C--N 1.35 0.619 0 C-N-CA 129.554 3.142 . . . . 0.0 118.487 -174.122 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -65.02 141.46 70.42 Favored 'Trans proline' 0 CA--C 1.542 0.891 1 C-N-CA 126.526 4.817 . . . . 0.0 121.63 168.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.456 ' H ' HD12 ' A' ' 89' ' ' ILE . 2.9 m-20 -109.28 -22.51 12.04 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.96 2.904 . . . . 0.0 111.561 169.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.568 HD13 ' N ' ' A' ' 93' ' ' PHE . 0.4 OUTLIER -132.85 -168.2 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.519 1 C-N-CA 135.702 5.601 . . . . 0.0 108.067 -174.613 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -110.61 -18.7 13.11 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 169.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.435 ' H ' ' HB ' ' A' ' 89' ' ' ILE . 16.3 pt-20 -103.75 -30.79 10.18 Favored 'General case' 0 C--N 1.365 1.281 1 N-CA-C 122.752 4.353 . . . . 0.0 122.752 -169.32 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -104.83 -5.99 20.65 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 120.543 -1.348 . . . . 0.0 110.794 -177.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.568 ' N ' HD13 ' A' ' 89' ' ' ILE 0.797 4.0 p90 25.39 -48.78 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.761 2 N-CA-C 125.412 5.338 . . . . 0.0 125.412 -172.195 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.51 ' CG2' HG12 ' A' ' 97' ' ' VAL . 19.3 mt -91.5 129.09 42.75 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.286 0 C-N-CA 129.314 3.045 . . . . 0.0 112.774 175.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -134.75 -56.07 0.83 Allowed 'General case' 0 CA--C 1.495 -1.144 0 CA-C-N 113.885 -1.507 . . . . 0.0 113.658 -175.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -109.21 29.54 9.54 Favored Glycine 0 CA--C 1.49 -1.473 0 N-CA-C 108.639 -1.784 . . . . 0.0 108.639 172.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.51 HG12 ' CG2' ' A' ' 94' ' ' ILE . 1.2 t -113.65 142.03 27.59 Favored 'Isoleucine or valine' 0 C--N 1.365 1.265 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 170.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -85.72 16.71 3.78 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 127.7 2.4 . . . . 0.0 116.564 -175.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.4 t80 68.06 41.59 1.99 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 128.004 2.522 . . . . 0.0 112.665 178.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -112.07 153.69 44.52 Favored Pre-proline 0 N--CA 1.447 -0.613 0 C-N-CA 127.649 2.38 . . . . 0.0 111.116 -173.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -78.12 170.57 18.5 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 125.163 3.909 . . . . 0.0 113.545 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.24 33.63 4.02 Favored Glycine 0 C--N 1.349 1.283 0 N-CA-C 118.164 2.026 . . . . 0.0 118.164 -175.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.2 ptt-85 -141.06 152.54 44.91 Favored 'General case' 0 N--CA 1.44 -0.974 0 O-C-N 121.067 -1.255 . . . . 0.0 109.024 177.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -109.24 125.84 52.68 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 126.37 1.868 . . . . 0.0 107.223 177.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -128.51 109.4 11.35 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 101.37 -3.567 . . . . 0.0 101.37 174.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.523 HD11 ' CZ ' ' A' ' 115' ' ' PHE . 9.7 pt -135.97 140.59 43.76 Favored 'Isoleucine or valine' 0 C--N 1.349 0.56 0 C-N-CA 125.235 1.414 . . . . 0.0 112.61 -174.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.419 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 2.7 m -111.57 121.85 46.24 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 119.871 -1.768 . . . . 0.0 108.73 173.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.708 ' HB2' HG22 ' A' ' 150' ' ' ILE . 42.1 t0 -139.19 171.77 13.8 Favored 'General case' 0 CA--C 1.504 -0.826 1 N-CA-C 100.093 -4.04 . . . . 0.0 100.093 177.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 78.75 -68.37 3.03 Favored Glycine 0 N--CA 1.475 1.288 0 O-C-N 118.033 -2.917 . . . . 0.0 113.378 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.612 HD21 HD11 ' A' ' 141' ' ' LEU . 0.1 OUTLIER 156.01 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.366 1.294 2 C-N-CA 134.324 5.05 . . . . 0.0 109.474 -152.609 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.717 HD21 ' HG ' ' A' ' 66' ' ' LEU 0.476 1.1 pt? -78.22 137.4 38.11 Favored 'General case' 0 CA--C 1.507 -0.706 1 C-N-CA 134.978 5.311 . . . . 0.0 119.813 -177.543 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.34 100.66 13.42 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 176.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.435 HD11 ' CD1' ' A' ' 66' ' ' LEU 0.314 0.0 OUTLIER -94.84 127.78 41.1 Favored 'General case' 0 C--N 1.38 1.907 0 N-CA-C 104.167 -2.531 . . . . 0.0 104.167 176.191 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -125.16 130.43 7.34 Favored Glycine 0 C--N 1.352 1.464 0 N-CA-C 106.138 -2.785 . . . . 0.0 106.138 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.523 ' CZ ' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -131.95 137.17 47.83 Favored 'General case' 0 C--N 1.361 1.108 0 CA-C-N 121.469 2.634 . . . . 0.0 105.671 178.384 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.0 m -124.99 102.05 7.34 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.841 1.655 . . . . 0.0 106.808 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.08 116.35 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 121.328 1.876 . . . . 0.0 107.276 172.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 1.6 m 3.66 104.58 0.0 OUTLIER 'General case' 0 C--N 1.38 1.921 0 C-N-CA 130.937 3.695 . . . . 0.0 117.677 -160.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.522 ' H ' ' HB2' ' A' ' 130' ' ' GLN . 34.4 ttpt -34.31 -44.25 0.56 Allowed Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 118.474 2.768 . . . . 0.0 118.474 -178.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -98.13 18.7 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.288 0 C-N-CA 123.47 2.78 . . . . 0.0 114.305 172.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.461 0.6 OUTLIER -161.53 108.05 1.38 Allowed 'General case' 0 CA--C 1.562 1.417 0 N-CA-C 118.899 2.926 . . . . 0.0 118.899 -178.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -99.3 -45.05 6.0 Favored 'General case' 0 C--N 1.351 0.671 0 O-C-N 118.67 -2.519 . . . . 0.0 115.193 170.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.411 0.0 OUTLIER -40.2 -14.74 0.01 OUTLIER 'General case' 0 C--N 1.353 0.726 1 C-N-CA 136.278 5.831 . . . . 0.0 120.754 -172.347 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -110.46 -6.07 15.01 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.773 2.029 . . . . 0.0 113.073 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.552 ' HB2' HD13 ' A' ' 81' ' ' LEU 0.416 0.0 OUTLIER 64.65 -51.71 0.31 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 128.379 2.672 . . . . 0.0 117.567 176.341 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . 0.283 2.5 p30 -64.03 -15.97 0.33 Allowed Pre-proline 0 CA--C 1.551 1.004 1 C-N-CA 132.08 4.152 . . . . 0.0 119.562 173.386 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . 0.358 39.7 Cg_exo -37.78 -176.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.486 1 C-N-CA 128.771 6.314 . . . . 0.0 121.008 166.464 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.0 m -99.61 164.3 12.13 Favored 'General case' 0 CA--C 1.486 -1.518 0 N-CA-C 104.113 -2.551 . . . . 0.0 104.113 -173.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.3 mp -100.12 129.04 46.11 Favored 'General case' 0 C--N 1.348 0.505 0 N-CA-C 100.208 -3.997 . . . . 0.0 100.208 176.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.522 ' HB2' ' H ' ' A' ' 119' ' ' LYS . 0.6 OUTLIER -93.19 60.21 3.18 Favored 'General case' 0 C--N 1.364 1.198 0 C-N-CA 126.258 1.823 . . . . 0.0 107.635 -171.038 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . . . . . . . . 0.304 1.9 p 102.8 138.27 0.01 OUTLIER 'General case' 0 C--N 1.373 1.593 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 -171.113 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -114.87 133.69 55.76 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 100.796 -3.779 . . . . 0.0 100.796 163.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 7.7 ttp -109.29 120.36 42.27 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 127.263 2.225 . . . . 0.0 105.446 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.627 ' H ' HD21 ' A' ' 49' ' ' LEU . . . -127.71 116.16 19.83 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 3.0 mm -139.8 138.44 38.66 Favored 'Isoleucine or valine' 0 C--N 1.366 1.318 0 CA-C-N 119.341 0.973 . . . . 0.0 109.495 178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.621 HG23 ' HB3' ' A' ' 111' ' ' LEU . 0.3 OUTLIER -127.68 169.03 19.74 Favored 'Isoleucine or valine' 0 C--N 1.349 0.583 0 C-N-CA 128.164 2.586 . . . . 0.0 108.022 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.512 ' H ' HG22 ' A' ' 136' ' ' ILE . 0.4 OUTLIER -100.33 123.64 44.81 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.13 2.972 . . . . 0.0 114.398 -176.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.261 2.5 p 171.86 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 123.934 1.825 . . . . 0.0 115.424 175.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.0 -50.32 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.651 0 CA-C-N 109.628 -3.442 . . . . 0.0 107.871 -155.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.485 ' HA ' ' O ' ' A' ' 57' ' ' GLU . 14.6 ptp180 175.74 73.81 0.01 OUTLIER 'General case' 0 CA--C 1.484 -1.564 0 CA-C-O 126.005 2.812 . . . . 0.0 104.081 -170.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.612 HD11 HD21 ' A' ' 110' ' ' ASN 0.285 0.0 OUTLIER -61.69 133.5 93.55 Favored Pre-proline 0 N--CA 1.447 -0.599 0 N-CA-C 117.764 2.505 . . . . 0.0 117.764 -162.62 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 141' ' ' LEU . 63.4 Cg_endo -83.65 -12.18 8.89 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.969 3.112 . . . . 0.0 112.837 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.431 ' HA2' ' CD1' ' A' ' 62' ' ' TYR . . . 104.85 92.36 2.26 Favored Glycine 0 CA--C 1.491 -1.434 0 C-N-CA 127.206 2.336 . . . . 0.0 112.382 -168.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -94.2 156.55 16.49 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-O 122.578 1.18 . . . . 0.0 111.911 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -142.01 110.31 5.99 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 127.717 2.407 . . . . 0.0 104.898 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 32.9 p -138.4 89.83 2.41 Favored 'General case' 0 CA--C 1.5 -0.967 0 C-N-CA 124.123 0.969 . . . . 0.0 113.431 -171.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.272 48.7 mmtm 78.82 -45.13 0.37 Allowed 'General case' 0 CA--C 1.505 -0.777 0 C-N-CA 129.601 3.16 . . . . 0.0 112.571 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . 76.92 87.96 0.08 Allowed 'General case' 0 C--N 1.358 0.952 0 N-CA-C 116.548 2.055 . . . . 0.0 116.548 163.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . 0.382 15.8 t -58.49 -72.83 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.371 1.542 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 -174.199 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.708 HG22 ' HB2' ' A' ' 108' ' ' ASP 0.506 0.0 OUTLIER -87.81 147.22 5.41 Favored 'Isoleucine or valine' 0 C--N 1.349 0.576 0 C-N-CA 131.065 3.746 . . . . 0.0 116.488 -175.526 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.46 ' O ' HG23 ' A' ' 150' ' ' ILE 0.334 5.6 ptpt -78.02 149.6 33.99 Favored 'General case' 0 N--CA 1.423 -1.802 2 C-N-CA 138.292 6.637 . . . . 0.0 113.584 177.24 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 20.2 p -96.33 97.73 9.72 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 118.314 -2.741 . . . . 0.0 107.809 169.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.413 ' HB2' ' NE2' ' A' ' 73' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.257 1.472 1 C-N-CA 135.319 5.448 . . . . 0.0 109.155 174.676 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 ttt . . . . . 0 CA--C 1.529 0.139 0 CA-C-O 124.366 2.031 . . . . 0.0 111.753 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.5 175.46 8.8 Favored 'General case' 0 C--N 1.348 0.528 0 C-N-CA 128.268 2.627 . . . . 0.0 113.933 -176.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 12.6 mm -80.79 47.42 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.893 0 C-N-CA 128.406 2.682 . . . . 0.0 112.507 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.47 ' HA ' HG13 ' A' ' 7' ' ' VAL . 14.1 m120 -75.42 18.24 0.23 Allowed 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 131.598 3.959 . . . . 0.0 113.414 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 p -81.86 -62.56 1.6 Allowed 'General case' 0 C--N 1.348 0.516 1 C-N-CA 133.714 4.806 . . . . 0.0 110.3 176.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -71.29 -9.23 57.79 Favored 'General case' 0 C--N 1.368 1.387 0 C-N-CA 125.585 1.554 . . . . 0.0 112.279 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.47 HG13 ' HA ' ' A' ' 4' ' ' ASN 0.286 0.7 OUTLIER -88.41 -28.45 5.38 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 C-N-CA 126.877 2.071 . . . . 0.0 108.969 174.368 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -72.86 -38.96 66.87 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 125.7 1.6 . . . . 0.0 108.688 174.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 28.8 mt -61.68 -44.52 98.85 Favored 'Isoleucine or valine' 0 C--N 1.376 1.734 0 C-N-CA 125.051 1.34 . . . . 0.0 110.636 165.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.314 0.6 OUTLIER -58.85 -48.91 79.7 Favored 'General case' 0 C--N 1.367 1.336 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 173.301 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -57.74 -34.11 69.17 Favored 'General case' 0 C--N 1.374 1.636 0 N-CA-C 118.835 2.902 . . . . 0.0 118.835 166.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -77.08 -49.28 15.66 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 128.141 2.576 . . . . 0.0 111.917 176.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -58.18 -29.28 65.51 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 130.04 3.336 . . . . 0.0 109.375 170.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.717 ' HG ' ' HA ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -76.14 -37.56 57.84 Favored 'General case' 0 C--N 1.378 1.819 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 169.832 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -58.45 -44.19 89.1 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.767 1.227 . . . . 0.0 111.419 166.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -62.85 -45.14 93.98 Favored 'General case' 0 C--N 1.382 2.019 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 166.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.92 -42.92 80.85 Favored 'General case' 0 C--N 1.388 2.243 0 C-N-CA 129.542 3.137 . . . . 0.0 112.207 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.448 ' CD1' HD11 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -66.01 -54.41 26.34 Favored 'General case' 0 C--N 1.363 1.174 0 C-N-CA 128.509 2.724 . . . . 0.0 113.114 177.138 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -74.67 -36.03 62.81 Favored 'General case' 0 C--N 1.367 1.361 0 N-CA-C 115.386 1.624 . . . . 0.0 115.386 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.5 m -72.78 -40.81 65.63 Favored 'General case' 0 C--N 1.365 1.256 0 C-N-CA 125.958 1.703 . . . . 0.0 111.946 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.621 ' HB3' ' CD1' ' A' ' 64' ' ' PHE 0.545 52.0 mt-10 -77.77 -29.92 51.19 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 119.982 -1.699 . . . . 0.0 114.066 169.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -59.32 -36.95 76.58 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 118.284 -2.76 . . . . 0.0 112.665 168.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . 0.251 7.4 ptm180 -71.22 -33.35 69.8 Favored 'General case' 0 C--N 1.376 1.756 0 C-N-CA 124.031 0.933 . . . . 0.0 112.368 168.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -61.91 -48.22 81.41 Favored 'General case' 0 C--N 1.362 1.134 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 170.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.466 HG12 ' CE1' ' A' ' 68' ' ' HIS . 1.1 mt -72.33 -46.42 57.02 Favored 'Isoleucine or valine' 0 C--N 1.36 1.054 0 O-C-N 121.333 -0.855 . . . . 0.0 110.975 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.567 0.0 OUTLIER -74.23 -23.5 59.17 Favored 'General case' 0 C--N 1.373 1.6 0 O-C-N 119.761 -1.837 . . . . 0.0 114.29 177.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -72.83 -32.78 65.73 Favored 'General case' 0 C--N 1.388 2.24 0 O-C-N 120.213 -1.554 . . . . 0.0 110.515 168.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.52 -40.73 85.1 Favored 'General case' 0 C--N 1.389 2.307 0 O-C-N 118.509 -2.619 . . . . 0.0 112.407 168.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.486 ' HB ' ' CZ ' ' A' ' 41' ' ' PHE 0.395 0.1 OUTLIER -64.77 -44.63 96.43 Favored 'Isoleucine or valine' 0 C--N 1.369 1.422 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 176.461 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -67.97 -38.84 83.23 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 172.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -76.51 -35.91 58.06 Favored 'General case' 0 CA--C 1.483 -1.597 0 C-N-CA 125.325 1.45 . . . . 0.0 111.463 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.8 -33.74 60.15 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 176.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.3 t -73.77 -37.3 65.04 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 125.512 1.525 . . . . 0.0 109.852 175.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp -68.66 -44.65 73.65 Favored 'General case' 0 C--N 1.377 1.786 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 168.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.25 -30.47 64.91 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.094 1.758 . . . . 0.0 113.543 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.03 -17.53 60.49 Favored 'General case' 0 C--N 1.383 2.022 0 CA-C-N 119.307 0.958 . . . . 0.0 113.197 169.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.37 18.31 28.9 Favored Glycine 0 C--N 1.374 2.693 0 O-C-N 121.179 -0.95 . . . . 0.0 114.775 174.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.488 HG23 HD23 ' A' ' 81' ' ' LEU . 0.4 OUTLIER -111.48 171.59 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 -179.673 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 t -59.06 177.84 0.15 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 129.398 3.079 . . . . 0.0 115.979 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.6 m -96.86 126.39 41.97 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 125.689 1.596 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.486 ' CZ ' ' HB ' ' A' ' 29' ' ' ILE 0.286 41.8 p90 -113.6 141.02 47.69 Favored 'General case' 0 C--N 1.357 0.921 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 174.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -116.14 164.9 13.79 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 123.42 1.581 . . . . 0.0 113.326 -172.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -121.18 133.96 55.2 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.361 1.864 . . . . 0.0 113.872 -174.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -139.44 162.04 36.02 Favored 'General case' 0 C--N 1.37 1.496 0 N-CA-C 105.026 -2.212 . . . . 0.0 105.026 169.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . 0.287 9.8 m-85 -125.31 161.34 27.19 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 126.688 1.995 . . . . 0.0 113.589 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.1 m -132.66 89.83 2.69 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 103.334 -2.839 . . . . 0.0 103.334 159.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' A' ' 51' ' ' ASP . 11.1 mp0 -47.45 -10.25 0.02 OUTLIER 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 131.658 3.983 . . . . 0.0 118.354 -175.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.47 -37.12 56.39 Favored 'General case' 0 N--CA 1.503 2.212 1 CA-C-N 128.417 5.099 . . . . 0.0 119.201 -176.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.678 HD12 ' H ' ' A' ' 50' ' ' LEU . 0.4 OUTLIER -69.6 -41.37 75.82 Favored 'General case' 0 C--O 1.242 0.7 1 C-N-CA 134.415 5.086 . . . . 0.0 110.82 173.798 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.678 ' H ' HD12 ' A' ' 49' ' ' LEU 0.282 4.2 tt -74.8 -28.99 60.95 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 127.343 2.257 . . . . 0.0 110.707 171.011 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.473 ' HA ' HG22 ' A' ' 54' ' ' ILE . 10.1 t70 -68.05 -31.95 71.96 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 130.323 3.449 . . . . 0.0 108.165 176.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -70.99 -40.79 71.66 Favored 'General case' 0 C--N 1.373 1.594 0 O-C-N 119.874 -1.766 . . . . 0.0 114.984 160.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.97 -28.22 62.27 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.597 ' HA ' HD12 ' A' ' 14' ' ' LEU . 2.7 tt -72.89 -35.9 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 1 C-N-CA 132.064 4.146 . . . . 0.0 110.828 178.292 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.498 ' HA ' HG22 ' A' ' 58' ' ' ILE . 1.2 mt-30 -108.63 -30.14 8.37 Favored 'General case' 0 C--N 1.367 1.365 0 N-CA-C 119.155 3.02 . . . . 0.0 119.155 171.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -88.91 -5.24 58.13 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 119.701 -1.875 . . . . 0.0 114.067 -172.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' A' ' 60' ' ' GLU . 2.9 tt0 -137.73 -64.58 0.54 Allowed 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 -178.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.498 HG22 ' HA ' ' A' ' 55' ' ' GLN 0.697 0.0 OUTLIER 119.55 -28.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.374 1.659 0 N-CA-C 121.768 3.988 . . . . 0.0 121.768 167.37 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.717 ' HA ' ' HG ' ' A' ' 14' ' ' LEU . 31.1 t70 -147.37 80.34 1.51 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 130.735 3.614 . . . . 0.0 105.992 -170.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.554 ' O ' HG12 ' A' ' 63' ' ' VAL 0.54 12.5 pt-20 -79.77 59.1 3.0 Favored 'General case' 0 C--N 1.38 1.922 0 O-C-N 118.883 -2.386 . . . . 0.0 112.301 177.216 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . 0.369 36.0 p -79.56 -21.66 44.81 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 129.816 3.247 . . . . 0.0 113.955 177.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -67.45 -30.24 69.92 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 130.643 3.577 . . . . 0.0 111.132 167.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.693 HG23 HD21 ' A' ' 111' ' ' LEU . 0.4 OUTLIER -64.9 -44.68 96.17 Favored 'Isoleucine or valine' 0 C--N 1.367 1.328 0 C-N-CA 126.078 1.751 . . . . 0.0 110.579 178.773 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.621 ' CD1' ' HB3' ' A' ' 21' ' ' GLU . 59.5 m-85 -58.88 -43.33 90.91 Favored 'General case' 0 C--O 1.204 -1.293 1 C-N-CA 133.727 4.811 . . . . 0.0 111.542 170.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -67.57 -45.6 75.11 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 121.786 2.084 . . . . 0.0 115.954 175.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.66 ' CD2' ' HA3' ' A' ' 109' ' ' GLY . 2.8 tm? -62.19 -49.21 76.72 Favored 'General case' 0 CA--C 1.57 1.738 0 O-C-N 119.198 -2.189 . . . . 0.0 112.315 169.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.645 ' CE1' HG13 ' A' ' 63' ' ' VAL 0.859 0.0 OUTLIER -77.49 -16.28 58.82 Favored 'General case' 0 C--N 1.379 1.869 0 O-C-N 118.923 -2.361 . . . . 0.0 115.078 -178.657 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.466 ' CE1' HG12 ' A' ' 25' ' ' ILE 0.295 58.2 m-70 -75.65 -23.13 56.28 Favored 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.437 2.295 . . . . 0.0 109.896 163.331 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . 0.44 71.6 mmtt -75.47 -40.19 57.67 Favored 'General case' 0 N--CA 1.528 3.436 0 C-N-CA 114.767 -2.773 . . . . 0.0 114.28 153.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.523 HD13 ' OXT' ' A' ' 153' ' ' GLN . 16.1 mm -53.63 -25.87 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.627 0 C-N-CA 129.643 3.177 . . . . 0.0 115.126 175.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -52.91 -26.1 13.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 C-N-CA 131.056 3.742 . . . . 0.0 118.209 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -101.3 2.89 40.22 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 125.282 1.433 . . . . 0.0 107.551 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 151' ' ' LYS 0.279 94.3 m-70 -86.17 13.22 8.19 Favored 'General case' 0 C--N 1.375 1.716 0 C-N-CA 128.622 2.769 . . . . 0.0 112.177 179.263 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.497 ' HB ' HD22 ' A' ' 75' ' ' LEU . 78.6 t -39.16 -55.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.372 1.576 1 C-N-CA 133.334 4.654 . . . . 0.0 109.55 157.368 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.497 HD22 ' HB ' ' A' ' 74' ' ' VAL . 3.6 mm? -58.59 -28.52 65.66 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.546 2.338 . . . . 0.0 115.996 176.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -75.47 -44.78 42.27 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 125.319 1.448 . . . . 0.0 112.23 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.415 HG21 ' CE2' ' A' ' 41' ' ' PHE 0.341 0.3 OUTLIER -67.83 -32.11 55.1 Favored 'Isoleucine or valine' 0 C--N 1.371 1.54 0 CA-C-O 124.338 2.018 . . . . 0.0 112.684 175.56 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -74.98 -39.49 61.25 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 129.883 3.273 . . . . 0.0 114.319 173.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -63.41 -29.2 70.53 Favored 'General case' 0 C--N 1.373 1.595 0 CA-C-N 120.694 1.588 . . . . 0.0 112.191 166.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -70.74 -32.08 69.13 Favored 'General case' 0 CA--C 1.58 2.098 0 C-N-CA 126.046 1.739 . . . . 0.0 114.485 167.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.509 HD22 ' HA ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -69.27 -45.76 68.87 Favored 'General case' 0 N--CA 1.51 2.566 0 C-N-CA 128.814 2.846 . . . . 0.0 112.239 169.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.2 m -66.13 3.27 0.9 Allowed 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 130.097 3.359 . . . . 0.0 119.327 -165.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 27.8 ptm -83.86 165.56 38.78 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 124.691 1.196 . . . . 0.0 112.456 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -65.39 171.99 8.44 Favored 'Trans proline' 0 C--N 1.372 1.766 0 C-N-CA 124.951 3.768 . . . . 0.0 110.942 168.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -54.65 155.48 17.23 Favored 'Trans proline' 0 C--N 1.361 1.186 0 C-N-CA 125.183 3.922 . . . . 0.0 115.475 -167.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.45 ' CD ' HD12 ' A' ' 94' ' ' ILE 0.28 0.0 OUTLIER -70.07 -60.08 3.82 Favored Pre-proline 0 N--CA 1.483 1.211 0 O-C-N 120.502 -1.374 . . . . 0.0 112.851 -178.263 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -58.73 162.6 12.61 Favored 'Trans proline' 0 N--CA 1.454 -0.811 2 C-N-CA 126.002 4.468 . . . . 0.0 122.696 172.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 121.88 -6.3 0.0 OUTLIER 'General case' 0 C--N 1.372 1.55 3 C-N-CA 145.41 9.484 . . . . 0.0 101.142 -169.609 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.481 HG22 ' H ' ' A' ' 90' ' ' ASP 0.504 0.4 OUTLIER 105.3 161.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.382 1.999 1 C-N-CA 141.659 7.984 . . . . 0.0 114.124 163.096 . . . . . . . . 5 4 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.481 ' H ' HG22 ' A' ' 89' ' ' ILE . 3.9 t70 -60.14 -11.52 6.29 Favored 'General case' 0 CA--C 1.553 1.063 0 O-C-N 118.099 -2.875 . . . . 0.0 114.433 170.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -93.87 -34.4 13.14 Favored 'General case' 0 C--N 1.358 0.962 0 C-N-CA 129.996 3.318 . . . . 0.0 115.21 167.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.59 -2.27 8.42 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 116.905 2.187 . . . . 0.0 116.905 -176.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -115.37 -49.78 2.75 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 116.826 2.158 . . . . 0.0 116.826 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.45 HD12 ' CD ' ' A' ' 86' ' ' ARG . 0.2 OUTLIER -77.51 137.71 21.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 -169.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -163.83 -37.74 0.03 OUTLIER 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 111.91 -2.405 . . . . 0.0 109.18 -170.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -91.47 21.44 35.39 Favored Glycine 0 C--N 1.366 2.229 0 C-N-CA 124.885 1.231 . . . . 0.0 112.855 -177.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.411 HG11 HD13 ' A' ' 94' ' ' ILE 0.256 4.0 p -101.89 98.05 6.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-O 124.298 1.999 . . . . 0.0 110.531 179.822 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -88.27 7.08 33.89 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 129.25 3.02 . . . . 0.0 114.51 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -117.42 166.8 11.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 112.041 -2.345 . . . . 0.0 109.764 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -90.38 162.58 33.94 Favored Pre-proline 0 C--N 1.357 0.923 0 C-N-CA 125.225 1.41 . . . . 0.0 112.149 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -65.24 147.56 88.07 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 124.636 3.557 . . . . 0.0 116.193 178.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 63.98 -50.84 0.08 OUTLIER Glycine 0 C--N 1.357 1.714 0 N-CA-C 118.798 2.279 . . . . 0.0 118.798 162.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -128.87 159.56 35.41 Favored 'General case' 0 CA--C 1.501 -0.91 0 CA-C-O 123.931 1.824 . . . . 0.0 113.265 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.5 128.8 53.77 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.311 2.645 . . . . 0.0 104.647 174.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 tp10 -129.78 131.86 46.36 Favored 'General case' 0 CA--C 1.498 -1.026 0 N-CA-C 103.526 -2.768 . . . . 0.0 103.526 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.511 HD12 HD12 ' A' ' 70' ' ' ILE . 2.8 mt -131.54 133.37 61.84 Favored 'Isoleucine or valine' 0 C--N 1.356 0.886 0 C-N-CA 126.487 1.915 . . . . 0.0 108.266 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.6 HG21 ' HA ' ' A' ' 148' ' ' ALA . 1.6 m -134.1 115.51 14.35 Favored 'General case' 0 C--N 1.353 0.743 0 O-C-N 120.72 -1.237 . . . . 0.0 110.615 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 176.14 -173.2 0.09 Allowed 'General case' 0 C--N 1.365 1.274 0 N-CA-C 100.217 -3.994 . . . . 0.0 100.217 173.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.66 ' HA3' ' CD2' ' A' ' 66' ' ' LEU . . . 72.6 9.23 73.77 Favored Glycine 1 CA--C 1.44 -4.597 0 O-C-N 118.285 -2.759 . . . . 0.0 117.29 175.375 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.542 ' O ' HG22 ' A' ' 136' ' ' ILE . 1.5 m-80 70.61 9.24 6.84 Favored 'General case' 0 C--N 1.377 1.781 0 C-N-CA 128.624 2.77 . . . . 0.0 110.876 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.693 HD21 HG23 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -120.56 130.33 54.16 Favored 'General case' 0 N--CA 1.44 -0.946 1 C-N-CA 134.45 5.1 . . . . 0.0 114.601 -164.587 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . 0.454 ' CE3' ' HA ' ' A' ' 146' ' ' SER . 9.8 m95 -112.51 100.15 8.52 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 101.065 -3.68 . . . . 0.0 101.065 174.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.296 1.3 pt? -107.51 138.59 43.45 Favored 'General case' 0 C--N 1.368 1.381 0 O-C-N 120.554 -1.341 . . . . 0.0 109.894 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -128.76 142.35 13.44 Favored Glycine 0 C--N 1.355 1.616 0 N-CA-C 107.452 -2.259 . . . . 0.0 107.452 172.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.45 132.36 44.23 Favored 'General case' 0 C--N 1.366 1.312 0 N-CA-C 104.636 -2.357 . . . . 0.0 104.636 176.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.4 m -109.97 108.94 19.36 Favored 'General case' 0 C--N 1.367 1.342 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.403 HG13 ' CB ' ' A' ' 127' ' ' PRO . 1.0 OUTLIER -75.03 105.31 3.92 Favored 'Isoleucine or valine' 0 C--N 1.363 1.163 0 C-N-CA 127.827 2.451 . . . . 0.0 111.663 -176.655 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 16.7 m 42.83 72.58 0.17 Allowed 'General case' 0 C--N 1.368 1.408 0 C-N-CA 129.831 3.252 . . . . 0.0 115.282 -170.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . 0.363 37.9 ttpt -30.81 -62.04 0.25 Allowed Pre-proline 0 C--N 1.361 1.095 1 C-N-CA 132.275 4.23 . . . . 0.0 118.768 -171.924 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -71.84 66.97 3.17 Favored 'Trans proline' 0 CA--C 1.556 1.621 0 C-N-CA 125.087 3.858 . . . . 0.0 111.039 169.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . 0.345 7.9 m120 -36.53 149.73 0.02 OUTLIER 'General case' 0 C--N 1.363 1.153 2 N-CA-C 125.615 5.413 . . . . 0.0 125.615 -170.012 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -162.65 -46.23 0.04 OUTLIER 'General case' 0 C--N 1.358 0.955 0 C-N-CA 130.91 3.684 . . . . 0.0 113.96 -174.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . 0.353 0.0 OUTLIER 75.54 100.27 0.07 Allowed 'General case' 0 N--CA 1.424 -1.763 1 C-N-CA 133.185 4.594 . . . . 0.0 113.246 -178.833 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -105.62 16.68 25.01 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 117.86 2.541 . . . . 0.0 117.86 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . 0.72 0.0 OUTLIER 19.86 55.11 0.01 OUTLIER 'General case' 0 C--N 1.366 1.289 0 N-CA-C 121.292 3.812 . . . . 0.0 121.292 174.17 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.509 ' HA ' HD22 ' A' ' 81' ' ' LEU . 44.9 m-20 170.59 46.42 0.0 OUTLIER Pre-proline 0 CA--C 1.568 1.667 1 C-N-CA 140.319 7.448 . . . . 0.0 105.785 -172.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.43 ' CD ' ' H ' ' A' ' 126' ' ' ASP . 13.7 Cg_exo -92.56 -179.25 1.03 Allowed 'Trans proline' 0 C--N 1.361 1.205 0 CA-C-N 127.349 3.66 . . . . 0.0 118.951 -158.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 12.1 p -124.62 150.08 46.39 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 104.675 -2.342 . . . . 0.0 104.675 174.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 mp -101.82 130.34 48.24 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 102.174 -3.269 . . . . 0.0 102.174 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -114.62 45.72 1.51 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 119.949 -1.72 . . . . 0.0 109.364 -170.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' CYS . . . . . 0.437 ' SG ' HD21 ' A' ' 49' ' ' LEU . 45.4 t 141.81 126.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.522 0 C-N-CA 128.201 2.6 . . . . 0.0 105.194 -170.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -115.36 111.47 20.9 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 102.583 -3.117 . . . . 0.0 102.583 165.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 4.5 ttt -99.43 121.22 40.83 Favored 'General case' 0 C--N 1.364 1.212 0 C-N-CA 130.03 3.332 . . . . 0.0 108.505 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.486 ' HB1' HG21 ' A' ' 63' ' ' VAL . . . -128.69 116.44 19.55 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.56 1.544 . . . . 0.0 109.174 178.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.515 HG22 ' H ' ' A' ' 144' ' ' LYS . 11.5 mm -136.03 128.29 45.59 Favored 'Isoleucine or valine' 0 C--N 1.365 1.252 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 176.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.542 HG22 ' O ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -103.88 171.39 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 C-N-CA 127.723 2.409 . . . . 0.0 108.61 -179.079 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.72 -178.78 5.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.148 1.779 . . . . 0.0 106.398 163.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . 0.744 52.6 p -65.24 75.8 0.06 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 117.644 2.461 . . . . 0.0 117.644 175.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.535 ' CD ' ' H ' ' A' ' 141' ' ' LEU . 0.0 OUTLIER -71.83 -21.49 61.68 Favored 'General case' 0 C--N 1.377 1.772 0 CA-C-N 110.989 -2.823 . . . . 0.0 106.614 148.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.416 ' N ' ' HD3' ' A' ' 139' ' ' ARG 0.402 70.6 mtt85 165.8 -45.86 0.0 OUTLIER 'General case' 0 CA--C 1.473 -2.009 1 C-N-CA 144.85 9.26 . . . . 0.0 114.218 -179.217 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.535 ' H ' ' CD ' ' A' ' 139' ' ' ARG 0.262 0.1 OUTLIER -41.82 103.92 0.33 Allowed Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 129.298 3.039 . . . . 0.0 117.513 -175.756 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -80.09 97.35 1.05 Allowed 'Trans proline' 0 C--N 1.304 -1.775 0 C-N-CA 124.442 3.428 . . . . 0.0 110.841 171.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -175.92 -99.08 0.12 Allowed Glycine 0 N--CA 1.464 0.52 0 N-CA-C 118.858 2.303 . . . . 0.0 118.858 -174.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.515 ' H ' HG22 ' A' ' 135' ' ' ILE 0.407 6.9 tttt 65.01 159.44 0.11 Allowed 'General case' 0 CA--C 1.571 1.753 0 N-CA-C 120.383 3.475 . . . . 0.0 120.383 -173.115 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -141.73 -147.39 0.21 Allowed 'General case' 0 C--N 1.373 1.613 0 C-N-CA 127.458 2.303 . . . . 0.0 110.863 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.454 ' HA ' ' CE3' ' A' ' 112' ' ' TRP . 6.2 t -158.3 177.88 10.78 Favored 'General case' 0 C--N 1.376 1.75 0 O-C-N 119.418 -2.051 . . . . 0.0 111.945 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . 0.29 84.1 tttt 153.64 -45.03 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.942 1 C-N-CA 133.599 4.76 . . . . 0.0 110.879 176.79 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.6 ' HA ' HG21 ' A' ' 107' ' ' THR . . . 87.05 6.68 0.27 Allowed 'General case' 0 C--N 1.354 0.79 0 N-CA-C 121.303 3.816 . . . . 0.0 121.303 168.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 3.4 t -140.15 144.06 28.6 Favored 'Isoleucine or valine' 0 C--N 1.375 1.714 0 CA-C-N 122.452 2.387 . . . . 0.0 115.801 -177.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.666 HD13 ' O ' ' A' ' 151' ' ' LYS 0.396 0.1 OUTLIER -130.31 144.9 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.646 2 N-CA-C 122.548 4.277 . . . . 0.0 122.548 -177.38 . . . . . . . . 5 4 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' LYS . . . . . 0.666 ' O ' HD13 ' A' ' 150' ' ' ILE . 0.0 OUTLIER -94.16 149.55 21.13 Favored 'General case' 0 CA--C 1.48 -1.744 2 C-N-CA 146.004 9.722 . . . . 0.0 97.652 167.87 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.584 ' O ' HG23 ' A' ' 152' ' ' THR 0.322 11.3 t -76.1 96.14 3.78 Favored 'General case' 0 CA--C 1.575 1.93 3 CA-C-O 130.563 4.982 . . . . 0.0 122.666 -162.49 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.546 ' HA ' HD12 ' A' ' 150' ' ' ILE 0.481 0.0 OUTLIER . . . . . 0 N--CA 1.381 -3.913 2 C-N-CA 136.099 5.759 . . . . 0.0 117.524 166.591 . . . . . . . . 4 3 . 1 stop_ save_